A0A087XAG7_POEFO Loading...

tRNA methyltransferase 10 homolog A

S-adenosyl-L-methionine-dependent guanine N(1)-methyltransferase that catalyzes the formation of N(1)-methylguanine at position 9 (m1G9) in tRNAs. Probably not able to catalyze formation of N(1)-methyladenine at position 9 (m1A9) in tRNAs.

AlphaFold DB , UniProt , Accession A0A087XAG7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 310 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.8	Very low	32.9	Very low	250 Å²	250	132 Å²	132	100%	1.232	87%	0.865	S	S	*	*				0	126.8	0	-72.7	174.8	168.8	0	0	106.4
2	A	35.8	Very low	33.6	Very low	105 Å²	105	130.5 Å²	130.5	87%	0.868	86%	0.855	S	S	*	*			cis	-150.8	164.9	-23.1	0	0	0	0	0	105.1
3	D	31.3	Very low	33.7	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	86%	0.861	S	S	*	*			trans	-61.6	179.8	-174.1	-159.7	-1	0	0	0	115.7
4	V	35.6	Very low	33.6	Very low	115 Å²	115	140.6 Å²	140.6	70%	0.697	86%	0.862	S	S	*	*			trans	125.7	87	144.6	-171.9	0	0	0	0	115.9
5	S	33.3	Very low	33.6	Very low	112 Å²	112	144.2 Å²	144.2	78%	0.783	85%	0.854	S	S	*	*				44.3	144.8	120.6	71.9	0	0	0	0	123.8
6	G	31	Very low	33.5	Very low	83 Å²	83	142.8 Å²	142.8	86%	0.856	85%	0.853	S	S	*	*			trans	-175.7	75.1	163.7	0	0	0	0	0	113
7	E	31.2	Very low	33.5	Very low	196 Å²	196	142 Å²	142	92%	0.916	84%	0.839	S	S	*	*			trans	-106.3	133.7	169	-168.8	178.2	-153.9	0	0	108
8	A	33.1	Very low	33.4	Very low	107 Å²	107	141.1 Å²	141.1	88%	0.884	84%	0.841	S	S	*	*			trans	-152.4	115.3	166.9	0	0	0	0	0	111.8
9	A	29.9	Very low	33.5	Very low	97 Å²	97	145.7 Å²	145.7	80%	0.802	84%	0.842	S	S	*	*			trans	-88	150.1	165.6	0	0	0	0	0	110.7
10	A	32.3	Very low	33.3	Very low	105 Å²	105	144.4 Å²	144.4	87%	0.868	84%	0.841	S	S	*	*			trans	-153.5	135.3	157	0	0	0	0	0	111.4
11	T	32.6	Very low	33.3	Very low	132 Å²	132	144.7 Å²	144.7	81%	0.81	84%	0.84	S	S	*	*			trans	-104.7	-164	-164.2	-26.1	0	0	0	0	111
12	P	41.6	Very low	33.3	Very low	114 Å²	114	139.2 Å²	139.2	74%	0.74	82%	0.821	S	S	*	*				-106.9	174.6	-115.3	39.9	-22.5	0	0	0	115.4
13	K	34.4	Very low	33.1	Very low	214 Å²	214	137.3 Å²	137.3	93%	0.93	81%	0.811	S	S	*	*			trans	-129.4	148.4	164.6	-91.3	-175.1	177.9	179.9	0	113.1
14	Q	33.1	Very low	33.7	Very low	189 Å²	189	137.6 Å²	137.6	88%	0.883	81%	0.813	S	S	*	*			trans	-81.7	144.1	-155.6	-65	167.8	-52.3	0	0	116.1
15	R	32.6	Very low	33.9	Very low	194 Å²	194	138.4 Å²	138.4	73%	0.732	82%	0.818	S	S	*	*				33	122.2	122.1	-147.6	171.7	-164.2	-102.6	-4.3	119.3	E17	R15-E17 IonicContact CZ-OE1 2.66Å; R15-E17 IonicContact CZ-OE2 3.92Å; R15-E17 IonicContact NH1-OE1 2.72Å; R15-E17 PolarHBondContact NH1-OE1 3.12Å; R15-E17 IonicContact NH1-OE2 3.18Å; R15-E17 PolarHBondContact NH1-OE2 3.2Å; R15-E17 VanDerWaalsContact NH2-CD 3.29Å; R15-E17 IonicContact NH2-OE1 3.05Å; R15-E17 PolarHBondContact NH2-OE1 3.16Å; R15-E17 IonicContact NH2-OE2 2.83Å
16	S	31.8	Very low	34.4	Very low	121 Å²	121	138.2 Å²	138.2	85%	0.846	81%	0.812	S	S	*	*			trans	-135.1	119.3	146.1	59.8	0	0	0	0	109.7
17	E	34.9	Very low	35	Very low	130 Å²	130	140.3 Å²	140.3	61%	0.607	81%	0.81	S	S	*	*			trans	-80	144.7	172.2	-74.1	171.6	135.4	0	0	111.1	R15	R15-E17 IonicContact CZ-OE1 2.66Å; R15-E17 IonicContact CZ-OE2 3.92Å; R15-E17 IonicContact NH1-OE1 2.72Å; R15-E17 PolarHBondContact NH1-OE1 3.12Å; R15-E17 IonicContact NH1-OE2 3.18Å; R15-E17 PolarHBondContact NH1-OE2 3.2Å; R15-E17 VanDerWaalsContact NH2-CD 3.29Å; R15-E17 IonicContact NH2-OE1 3.05Å; R15-E17 PolarHBondContact NH2-OE1 3.16Å; R15-E17 IonicContact NH2-OE2 2.83Å
18	S	31.5	Very low	35.3	Very low	125 Å²	125	133.8 Å²	133.8	87%	0.874	80%	0.796	S	S	*	*			trans	-142.6	119.2	149.4	58.9	0	0	0	0	109.4
19	R	34.4	Very low	36.3	Very low	229 Å²	229	135.7 Å²	135.7	86%	0.864	79%	0.791	S	S	*	*			trans	-82.3	142.5	179	-72.4	173.2	166.6	-179.3	-5.1	111.8
20	S	30.3	Very low	37.5	Very low	119 Å²	119	139.8 Å²	139.8	83%	0.832	79%	0.793	S	S	*	*			trans	160.2	131	139.6	57.5	0	0	0	0	105.9
21	D	32.1	Very low	38.8	Very low	151 Å²	151	139.7 Å²	139.7	81%	0.807	78%	0.782	S	S	*	*			cis	-165	145.5	39.7	-174.2	19.2	0	0	0	108.8	G23	D21-G23 PolarHBondContact O-N 3.36Å
22	T	36.7	Very low	40.2	Very low	136 Å²	136	137.5 Å²	137.5	83%	0.834	77%	0.765	S	S	*	*			trans	-82.8	107.6	179.7	35.1	0	0	0	0	110.1
23	G	31.3	Very low	42.1	Very low	65 Å²	65	135.2 Å²	135.2	67%	0.67	75%	0.752	S	S	*	*			trans	-107.9	107.7	163.4	0	0	0	0	0	110	D21 V25	D21-G23 PolarHBondContact O-N 3.36Å; G23-V25 PolarHBondContact O-N 2.98Å
24	D	44.3	Very low	43.9	Very low	156 Å²	156	134.2 Å²	134.2	83%	0.834	75%	0.747	S	S	*	*			trans	-54.1	115.4	178.1	-149.8	-10.8	0	0	0	111.7
25	V	39.5	Very low	45.9	Very low	132 Å²	132	135.8 Å²	135.8	80%	0.8	75%	0.745	S	S	*	*			trans	-121.4	94.1	171.7	-174.6	0	0	0	0	108.8	G23	G23-V25 PolarHBondContact O-N 2.98Å
26	V	43.2	Very low	48	Very low	108 Å²	108	131.8 Å²	131.8	66%	0.655	74%	0.735	S	S	*	*			trans	-38.2	135.8	161.2	179.3	0	0	0	0	110.3	G28	V26-G28 PolarHBondContact O-N 3.15Å
27	P	44.5	Very low	50.2	Low	127 Å²	127	130.4 Å²	130.4	83%	0.825	71%	0.713	S	S	*	*			trans	-69.8	86.9	174.9	28.1	-30.8	0	0	0	109.1	N29	P27-N29 PolarHBondContact O-N 3.43Å
28	G	37.3	Very low	52.4	Low	59 Å²	59	132 Å²	132	61%	0.608	72%	0.719	S	S	*	*			trans	-61.6	107.2	173.8	0	0	0	0	0	109.4	V26 Q30	V26-G28 PolarHBondContact O-N 3.15Å; G28-Q30 PolarHBondContact O-N 3.26Å
29	N	53.7	Low	55	Low	146 Å²	146	133.6 Å²	133.6	78%	0.781	71%	0.71	S	S	*	*			trans	-45	95.2	172.1	-151.4	10.2	0	0	0	109.9	P27 T31	P27-N29 PolarHBondContact O-N 3.43Å; N29-T31 PolarHBondContact O-N 3.05Å
30	Q	54.3	Low	57.3	Low	184 Å²	184	126.5 Å²	126.5	86%	0.86	69%	0.688	S	S	*	*			trans	-68.8	88.1	177.3	-74.4	-173	11.6	0	0	108.1	G28 L32	G28-Q30 PolarHBondContact O-N 3.26Å; Q30-L32 PolarHBondContact O-N 3.46Å
31	T	60.1	Low	59.8	Low	103 Å²	103	125.2 Å²	125.2	63%	0.632	67%	0.672	S	S	*	*			trans	-66.2	104	177.2	54.6	0	0	0	0	108.3	N29 S33	N29-T31 PolarHBondContact O-N 3.05Å; T31-S33 PolarHBondContact O-N 2.85Å
32	L	62.9	Low	62.3	Low	86 Å²	86	125.5 Å²	125.5	45%	0.45	67%	0.666	S	S	.	*			trans	-42.2	132.8	175.6	-72.2	165.2	0	0	0	110.6	Q30 Q36 K37	Q30-L32 PolarHBondContact O-N 3.46Å; L32-Q36 HydrophobicContact CB-CB 4.36Å; L32-Q36 HydrophobicContact CD2-CB 4.34Å; L32-K37 HydrophobicContact CB-CD 4.23Å; L32-K37 HydrophobicContact CB-CG 3.54Å; L32-K37 HydrophobicContact CD1-CG 4.45Å; L32-K37 VanDerWaalsContact O-CD 3.28Å; L32-K37 WeakPolarHBondContact O-CD 3.34Å; L32-K37 WeakPolarHBondContact O-CE 3.47Å; L32-K37 WeakPolarHBondContact O-CG 2.99Å
33	S	80.5	Confident	64.5	Low	66 Å²	66	123.9 Å²	123.9	46%	0.462	65%	0.649	S	S	.	*			trans	-54.1	145.5	179.5	172.4	0	0	0	0	110.4	T31 R35 Q36 K37	T31-S33 PolarHBondContact O-N 2.85Å; S33-R35 PolarHBondContact O-N 3.04Å; S33-Q36 VanDerWaalsContact N-OE1 3.11Å; S33-Q36 WeakPolarHBondContact O-CA 3.47Å; S33-Q36 WeakPolarHBondContact O-CB 3.45Å; S33-Q36 PolarHBondContact O-N 3.4Å; S33-K37 PolarHBondContact O-N 3.43Å
34	K	72.1	Confident	67	Low	192 Å²	192	125.1 Å²	125.1	84%	0.835	64%	0.637	S	S	*	*	H	α-helix	trans	-49.2	-33.1	-179.6	-69.1	-178	178.7	177	0	112.5	K38	K34-K38 WeakPolarHBondContact O-CB 3.38Å; K34-K38 PolarHBondContact O-N 3Å; K34-K38 VanDerWaalsContact O-N 3.12Å
35	R	75.9	Confident	68.9	Low	222 Å²	222	123.3 Å²	123.3	84%	0.838	62%	0.622	S	S	*	*	H	α-helix	trans	-72.5	-40.6	174.5	-74.6	-174.5	176.9	-155.4	0.4	113.6	S33 K38 K39	S33-R35 PolarHBondContact O-N 3.04Å; R35-K38 PolarHBondContact O-N 3.44Å; R35-K39 WeakPolarHBondContact O-CB 3.48Å; R35-K39 PolarHBondContact O-N 3.01Å
36	Q	76.7	Confident	70.8	Confident	110 Å²	110	124 Å²	124	51%	0.514	61%	0.61	S	S	.	*	H	α-helix	trans	-66.7	-43	176.6	-71.2	169.7	-25.8	0	0	110.9	L32 S33 K38 K39 L40	L32-Q36 HydrophobicContact CB-CB 4.36Å; L32-Q36 HydrophobicContact CD2-CB 4.34Å; S33-Q36 VanDerWaalsContact N-OE1 3.11Å; S33-Q36 WeakPolarHBondContact O-CA 3.47Å; S33-Q36 WeakPolarHBondContact O-CB 3.45Å; S33-Q36 PolarHBondContact O-N 3.4Å; Q36-K38 PolarHBondContact O-N 2.87Å; Q36-K39 PolarHBondContact O-N 3.05Å; Q36-L40 PolarHBondContact O-N 3.36Å
37	K	77.9	Confident	72.6	Confident	92 Å²	92	123.2 Å²	123.2	40%	0.4	60%	0.6	S	S	.	*	H	α-helix	trans	-59.1	-46.1	173.2	-69.4	-179.6	173.4	172	0	111.8	L32 S33 K39 L40 L41	L32-K37 HydrophobicContact CB-CD 4.23Å; L32-K37 HydrophobicContact CB-CG 3.54Å; L32-K37 HydrophobicContact CD1-CG 4.45Å; L32-K37 VanDerWaalsContact O-CD 3.28Å; L32-K37 WeakPolarHBondContact O-CD 3.34Å; L32-K37 WeakPolarHBondContact O-CE 3.47Å; L32-K37 WeakPolarHBondContact O-CG 2.99Å; S33-K37 PolarHBondContact O-N 3.43Å; K37-K39 VanDerWaalsContact C-N 3.35Å; K37-K39 PolarHBondContact O-N 3.45Å; K37-L40 PolarHBondContact O-N 2.83Å; K37-L41 WeakPolarHBondContact O-CB 3.41Å; K37-L41 WeakPolarHBondContact O-CD1 3Å; K37-L41 PolarHBondContact O-N 3.11Å
38	K	82	Confident	74.4	Confident	165 Å²	165	124.1 Å²	124.1	72%	0.717	59%	0.593	S	S	*	*	H	α-helix	trans	-63.6	-36.9	177.1	-169.5	173.9	-177.3	175.4	0	112.8	K34 R35 Q36 K42	K34-K38 WeakPolarHBondContact O-CB 3.38Å; K34-K38 PolarHBondContact O-N 3Å; K34-K38 VanDerWaalsContact O-N 3.12Å; R35-K38 PolarHBondContact O-N 3.44Å; Q36-K38 PolarHBondContact O-N 2.87Å; K38-K42 WeakPolarHBondContact O-CB 3.44Å; K38-K42 PolarHBondContact O-N 2.77Å
39	K	86.2	Confident	76.5	Confident	157 Å²	157	126.1 Å²	126.1	68%	0.683	59%	0.586	S	S	*	*	H	α-helix	trans	-66.8	-43.6	175.6	-170.1	178.5	179.4	-175.9	0	111.3	R35 Q36 K37 K42 Q43	R35-K39 WeakPolarHBondContact O-CB 3.48Å; R35-K39 PolarHBondContact O-N 3.01Å; Q36-K39 PolarHBondContact O-N 3.05Å; K37-K39 VanDerWaalsContact C-N 3.35Å; K37-K39 PolarHBondContact O-N 3.45Å; K39-K42 PolarHBondContact O-N 3.13Å; K39-Q43 WeakPolarHBondContact O-CB 3.41Å; K39-Q43 PolarHBondContact O-N 3.13Å
40	L	82.5	Confident	77.9	Confident	80 Å²	80	124.7 Å²	124.7	42%	0.419	57%	0.57	S	S	.	*	H	α-helix	trans	-64.1	-47.4	177.6	-167.3	73.1	0	0	0	111.5	Q36 K37 K42 Q43 Q44	Q36-L40 PolarHBondContact O-N 3.36Å; K37-L40 PolarHBondContact O-N 2.83Å; L40-K42 VanDerWaalsContact C-N 3.31Å; L40-K42 PolarHBondContact O-N 3.31Å; L40-Q43 WeakPolarHBondContact O-CB 3.25Å; L40-Q43 PolarHBondContact O-N 3Å; L40-Q43 VanDerWaalsContact O-N 3.08Å; L40-Q44 WeakPolarHBondContact O-CG 3.34Å; L40-Q44 PolarHBondContact O-N 3.28Å
41	L	82.3	Confident	79.2	Confident	93 Å²	93	121 Å²	121	49%	0.487	55%	0.553	S	S	.	*	H	α-helix	trans	-58.7	-40.4	174.3	-96.2	138.8	0	0	0	112.4	K37 Q43 K45	K37-L41 WeakPolarHBondContact O-CB 3.41Å; K37-L41 WeakPolarHBondContact O-CD1 3Å; K37-L41 PolarHBondContact O-N 3.11Å; L41-Q43 VanDerWaalsContact C-N 3.33Å; L41-K45 WeakPolarHBondContact O-CB 3.45Å; L41-K45 VanDerWaalsContact O-CG 3.29Å; L41-K45 WeakPolarHBondContact O-CG 3.47Å; L41-K45 PolarHBondContact O-N 3.21Å
42	K	84.1	Confident	80.4	Confident	156 Å²	156	119.9 Å²	119.9	68%	0.678	54%	0.542	S	S	*	.	H	α-helix	trans	-66.9	-36	175.7	-171.9	176	-178.9	179.1	0	111.8	K38 K39 L40 W46	K38-K42 WeakPolarHBondContact O-CB 3.44Å; K38-K42 PolarHBondContact O-N 2.77Å; K39-K42 PolarHBondContact O-N 3.13Å; L40-K42 VanDerWaalsContact C-N 3.31Å; L40-K42 PolarHBondContact O-N 3.31Å; K42-W46 VanDerWaalsContact O-CB 3.25Å; K42-W46 WeakPolarHBondContact O-CB 3.3Å; K42-W46 PolarHBondContact O-N 2.97Å
43	Q	83.4	Confident	81.2	Confident	102 Å²	102	118.9 Å²	118.9	48%	0.477	53%	0.532	S	S	.	.	H	α-helix	trans	-71	-43	178	-170.7	166.8	4.7	0	0	111.8	K39 L40 L41 W46 E47	K39-Q43 WeakPolarHBondContact O-CB 3.41Å; K39-Q43 PolarHBondContact O-N 3.13Å; L40-Q43 WeakPolarHBondContact O-CB 3.25Å; L40-Q43 PolarHBondContact O-N 3Å; L40-Q43 VanDerWaalsContact O-N 3.08Å; L41-Q43 VanDerWaalsContact C-N 3.33Å; Q43-W46 WeakPolarHBondContact O-CB 3.31Å; Q43-W46 PolarHBondContact O-N 3.16Å; Q43-E47 WeakPolarHBondContact O-CG 3.18Å; Q43-E47 PolarHBondContact O-N 2.97Å
44	Q	83.8	Confident	81.4	Confident	91 Å²	91	120.4 Å²	120.4	43%	0.425	53%	0.531	S	S	.	.	H	α-helix	trans	-60.4	-50.8	173.1	-73.1	173.2	-15	0	0	111.1	L40 W46 E47 E48	L40-Q44 WeakPolarHBondContact O-CG 3.34Å; L40-Q44 PolarHBondContact O-N 3.28Å; Q44-W46 VanDerWaalsContact C-N 3.26Å; Q44-W46 PolarHBondContact O-N 3.48Å; Q44-E47 PolarHBondContact O-N 2.9Å; Q44-E48 WeakPolarHBondContact O-CB 3.32Å; Q44-E48 WeakPolarHBondContact O-CG 3.22Å; Q44-E48 PolarHBondContact O-N 2.95Å
45	K	83.4	Confident	82	Confident	119 Å²	119	118.1 Å²	118.1	52%	0.517	52%	0.517	S	S	.	.	H	α-helix	trans	-57.1	-39.3	173.9	-74.1	-176.7	178.6	-167.1	0	112.6	L41 E49	L41-K45 WeakPolarHBondContact O-CB 3.45Å; L41-K45 VanDerWaalsContact O-CG 3.29Å; L41-K45 WeakPolarHBondContact O-CG 3.47Å; L41-K45 PolarHBondContact O-N 3.21Å; K45-E49 VanDerWaalsContact O-CB 3.24Å; K45-E49 WeakPolarHBondContact O-CB 3.38Å; K45-E49 VanDerWaalsContact O-CG 3.25Å; K45-E49 WeakPolarHBondContact O-CG 3.25Å; K45-E49 PolarHBondContact O-N 3.39Å
46	W	80.4	Confident	82.5	Confident	145 Å²	145	115.1 Å²	115.1	55%	0.549	51%	0.506	S	S	.	.	H	α-helix	trans	-66.9	-36.7	176.2	-175.8	-91.4	0	0	0	112.3	K42 Q43 Q44 R50 R53	K42-W46 VanDerWaalsContact O-CB 3.25Å; K42-W46 WeakPolarHBondContact O-CB 3.3Å; K42-W46 PolarHBondContact O-N 2.97Å; Q43-W46 WeakPolarHBondContact O-CB 3.31Å; Q43-W46 PolarHBondContact O-N 3.16Å; Q44-W46 VanDerWaalsContact C-N 3.26Å; Q44-W46 PolarHBondContact O-N 3.48Å; W46-R50 PolarHBondContact O-N 3.3Å; W46-R53 VanDerWaalsContact CD2-NH1 3.33Å; W46-R53 VanDerWaalsContact CZ3-NH1 3.26Å; W46-R53 VanDerWaalsContact NE1-NH2 3.19Å; W46-R53 PolarHBondContact O-NH2 3.41Å
47	E	81.1	Confident	82.7	Confident	93 Å²	93	118.7 Å²	118.7	44%	0.435	52%	0.515	S	S	.	.	H	α-helix	trans	-71.2	-43.3	175.9	-77.3	174.2	-178.7	0	0	112	Q43 Q44 E49 R50	Q43-E47 WeakPolarHBondContact O-CG 3.18Å; Q43-E47 PolarHBondContact O-N 2.97Å; Q44-E47 PolarHBondContact O-N 2.9Å; E47-E49 PolarHBondContact O-N 3.31Å; E47-R50 WeakPolarHBondContact O-CB 3.46Å; E47-R50 PolarHBondContact O-N 2.88Å
48	E	81.1	Confident	83.1	Confident	146 Å²	146	121.4 Å²	121.4	68%	0.682	53%	0.526	S	S	*	.	H	α-helix	trans	-59.2	-46.4	172.4	-70.5	168.4	-176.5	0	0	111.1	Q44 R50	Q44-E48 WeakPolarHBondContact O-CB 3.32Å; Q44-E48 WeakPolarHBondContact O-CG 3.22Å; Q44-E48 PolarHBondContact O-N 2.95Å; E48-R50 PolarHBondContact O-N 2.77Å
49	E	82.9	Confident	83.4	Confident	101 Å²	101	117.8 Å²	117.8	47%	0.472	51%	0.512	S	S	.	.	H	α-helix	trans	-74.3	-7.2	176.3	-71.5	178.2	-175.9	0	0	113.3	K45 E47 E51 L52 R53	K45-E49 VanDerWaalsContact O-CB 3.24Å; K45-E49 WeakPolarHBondContact O-CB 3.38Å; K45-E49 VanDerWaalsContact O-CG 3.25Å; K45-E49 WeakPolarHBondContact O-CG 3.25Å; K45-E49 PolarHBondContact O-N 3.39Å; E47-E49 PolarHBondContact O-N 3.31Å; E49-E51 PolarHBondContact O-N 3.29Å; E49-L52 PolarHBondContact O-N 2.78Å; E49-R53 VanDerWaalsContact O-CB 3.28Å; E49-R53 WeakPolarHBondContact O-CB 3.21Å; E49-R53 WeakPolarHBondContact O-CG 3.42Å; E49-R53 PolarHBondContact O-N 3.41Å; E49-R53 PolarHBondContact O-NE 2.89Å; E49-R53 VanDerWaalsContact O-NE 3.1Å
50	R	82.8	Confident	83.2	Confident	116 Å²	116	118.1 Å²	118.1	44%	0.438	51%	0.509	S	S	.	.	H	α-helix	trans	-62.1	-46.6	-178.2	-173.3	-173.2	-74.9	-173.6	-0.9	110.7	W46 E47 E48 R53 K54	W46-R50 PolarHBondContact O-N 3.3Å; E47-R50 WeakPolarHBondContact O-CB 3.46Å; E47-R50 PolarHBondContact O-N 2.88Å; E48-R50 PolarHBondContact O-N 2.77Å; R50-R53 PolarHBondContact O-N 3.41Å; R50-K54 WeakPolarHBondContact O-CG 3.45Å; R50-K54 PolarHBondContact O-N 3.33Å
51	E	81.9	Confident	83.3	Confident	107 Å²	107	121.9 Å²	121.9	50%	0.5	52%	0.522	S	S	.	.	H	α-helix	trans	-70.4	-38.3	-179.8	-70.1	-53	133.3	0	0	111.8	E49 R53 K54 R55	E49-E51 PolarHBondContact O-N 3.29Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.27Å; E51-K54 PolarHBondContact O-N 3.36Å; E51-K54 WeakPolarHBondContact OE1-CD 3.46Å; E51-K54 IonicContact OE1-NZ 3.67Å; E51-K54 PolarHBondContact OE1-NZ 3.44Å; E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 PolarHBondContact O-N 3.48Å
52	L	83.9	Confident	83.4	Confident	79 Å²	79	123.8 Å²	123.8	41%	0.414	53%	0.528	S	S	.	.	H	α-helix	trans	-62.3	-40.3	172.9	-174.7	61.8	0	0	0	111.8	E49 R55 R56	E49-L52 PolarHBondContact O-N 2.78Å; L52-R55 PolarHBondContact O-N 2.73Å; L52-R56 WeakPolarHBondContact O-CB 3.2Å; L52-R56 WeakPolarHBondContact O-CG 3.37Å; L52-R56 PolarHBondContact O-N 2.75Å
53	R	80.1	Confident	83.3	Confident	64 Å²	64	122.3 Å²	122.3	24%	0.242	52%	0.524	C	S	.	.	H	α-helix	trans	-69	-37.7	175.9	-73.3	178.3	-63.1	160.2	-3.4	112.5	W46 E49 R50 E51 R57	W46-R53 VanDerWaalsContact CD2-NH1 3.33Å; W46-R53 VanDerWaalsContact CZ3-NH1 3.26Å; W46-R53 VanDerWaalsContact NE1-NH2 3.19Å; W46-R53 PolarHBondContact O-NH2 3.41Å; E49-R53 VanDerWaalsContact O-CB 3.28Å; E49-R53 WeakPolarHBondContact O-CB 3.21Å; E49-R53 WeakPolarHBondContact O-CG 3.42Å; E49-R53 PolarHBondContact O-N 3.41Å; E49-R53 PolarHBondContact O-NE 2.89Å; E49-R53 VanDerWaalsContact O-NE 3.1Å; R50-R53 PolarHBondContact O-N 3.41Å; E51-R53 VanDerWaalsContact C-N 3.33Å; E51-R53 PolarHBondContact O-N 3.27Å; R53-R57 VanDerWaalsContact O-CB 3.3Å; R53-R57 WeakPolarHBondContact O-CB 3.46Å; R53-R57 VanDerWaalsContact O-CG 3.25Å; R53-R57 WeakPolarHBondContact O-CG 3.32Å; R53-R57 PolarHBondContact O-N 3.23Å
54	K	84.1	Confident	83.1	Confident	99 Å²	99	125.1 Å²	125.1	43%	0.43	53%	0.53	S	S	.	.	H	α-helix	trans	-61.5	-44.8	171.7	-77.4	176.1	-177.9	172.3	0	110.7	R50 E51 R57 K58	R50-K54 WeakPolarHBondContact O-CG 3.45Å; R50-K54 PolarHBondContact O-N 3.33Å; E51-K54 PolarHBondContact O-N 3.36Å; E51-K54 WeakPolarHBondContact OE1-CD 3.46Å; E51-K54 IonicContact OE1-NZ 3.67Å; E51-K54 PolarHBondContact OE1-NZ 3.44Å; K54-R57 PolarHBondContact O-N 3.28Å; K54-K58 WeakPolarHBondContact O-CG 3.42Å; K54-K58 PolarHBondContact O-N 2.69Å
55	R	85.6	Confident	83.1	Confident	143 Å²	143	127.3 Å²	127.3	54%	0.54	54%	0.538	S	S	.	.	H	α-helix	trans	-63.1	-51.2	177.5	-157.1	-169.5	-39.8	179.8	7.8	111.9	E51 L52 R57 K58 E59	E51-R55 WeakPolarHBondContact O-CB 3.33Å; E51-R55 PolarHBondContact O-N 3.48Å; L52-R55 PolarHBondContact O-N 2.73Å; R55-R57 VanDerWaalsContact C-N 3.27Å; R55-R57 PolarHBondContact O-N 3.02Å; R55-K58 CarbonylContact O-C 3.58Å; R55-K58 WeakPolarHBondContact O-CA 3.48Å; R55-K58 WeakPolarHBondContact O-CB 3.37Å; R55-K58 PolarHBondContact O-N 3.17Å; R55-E59 WeakPolarHBondContact CG-OE1 3.33Å; R55-E59 PolarHBondContact O-N 3.32Å
56	R	86.6	Confident	83	Confident	160 Å²	160	126.4 Å²	126.4	60%	0.604	54%	0.538	S	S	*	.	H	α-helix	trans	-56.9	-37.1	173.7	-79.5	-177	165.7	-148.6	-3.2	113	L52 R60	L52-R56 WeakPolarHBondContact O-CB 3.2Å; L52-R56 WeakPolarHBondContact O-CG 3.37Å; L52-R56 PolarHBondContact O-N 2.75Å; R56-R60 VanDerWaalsContact O-CB 3.24Å; R56-R60 WeakPolarHBondContact O-CB 3.41Å; R56-R60 WeakPolarHBondContact O-CG 3.38Å; R56-R60 PolarHBondContact O-N 2.81Å
57	R	80.1	Confident	82.9	Confident	185 Å²	185	125.7 Å²	125.7	70%	0.698	54%	0.541	S	S	*	.	H	α-helix	trans	-67.9	-39.6	173.8	-79.8	177.1	178.1	-173	0.3	112	R53 K54 R55 K61	R53-R57 VanDerWaalsContact O-CB 3.3Å; R53-R57 WeakPolarHBondContact O-CB 3.46Å; R53-R57 VanDerWaalsContact O-CG 3.25Å; R53-R57 WeakPolarHBondContact O-CG 3.32Å; R53-R57 PolarHBondContact O-N 3.23Å; K54-R57 PolarHBondContact O-N 3.28Å; R55-R57 VanDerWaalsContact C-N 3.27Å; R55-R57 PolarHBondContact O-N 3.02Å; R57-K61 WeakPolarHBondContact O-CB 3.49Å; R57-K61 VanDerWaalsContact O-CG 3.31Å; R57-K61 WeakPolarHBondContact O-CG 3.38Å; R57-K61 PolarHBondContact O-N 2.89Å
58	K	87.1	Confident	82.5	Confident	148 Å²	148	129.9 Å²	129.9	64%	0.643	55%	0.553	S	S	*	*	H	α-helix	trans	-66.9	-47.5	175.4	-75.2	-179.8	178.8	-177.6	0	111.2	K54 R55 K61 Q62	K54-K58 WeakPolarHBondContact O-CG 3.42Å; K54-K58 PolarHBondContact O-N 2.69Å; R55-K58 CarbonylContact O-C 3.58Å; R55-K58 WeakPolarHBondContact O-CA 3.48Å; R55-K58 WeakPolarHBondContact O-CB 3.37Å; R55-K58 PolarHBondContact O-N 3.17Å; K58-K61 CarbonylContact O-C 3.59Å; K58-K61 WeakPolarHBondContact O-CB 3.48Å; K58-K61 PolarHBondContact O-N 3.36Å; K58-K61 VanDerWaalsContact O-N 3.13Å; K58-Q62 WeakPolarHBondContact O-CG 3.46Å; K58-Q62 PolarHBondContact O-N 2.85Å
59	E	87.1	Confident	82.1	Confident	90 Å²	90	127.6 Å²	127.6	42%	0.421	54%	0.542	S	S	.	.	H	α-helix	trans	-60.3	-47.1	175.9	-73.7	165.9	-169.9	0	0	111.4	R55 K61 Q62 Q63	R55-E59 WeakPolarHBondContact CG-OE1 3.33Å; R55-E59 PolarHBondContact O-N 3.32Å; E59-K61 VanDerWaalsContact C-N 3.29Å; E59-K61 PolarHBondContact O-N 2.78Å; E59-Q62 CarbonylContact O-C 3.6Å; E59-Q62 PolarHBondContact O-N 2.94Å; E59-Q62 VanDerWaalsContact O-N 3.12Å; E59-Q63 WeakPolarHBondContact O-CB 3.4Å; E59-Q63 WeakPolarHBondContact O-CG 3.32Å; E59-Q63 PolarHBondContact O-N 2.88Å
60	R	83.8	Confident	81.8	Confident	164 Å²	164	126.5 Å²	126.5	62%	0.619	54%	0.54	S	S	*	.	H	α-helix	trans	-60.5	-36.5	173.7	-83.3	-179.2	154.3	-133.8	-4.1	112.9	R56 R64	R56-R60 VanDerWaalsContact O-CB 3.24Å; R56-R60 WeakPolarHBondContact O-CB 3.41Å; R56-R60 WeakPolarHBondContact O-CG 3.38Å; R56-R60 PolarHBondContact O-N 2.81Å; R60-R64 WeakPolarHBondContact O-CB 2.95Å; R60-R64 VanDerWaalsContact O-CG 3.24Å; R60-R64 WeakPolarHBondContact O-CG 3.49Å; R60-R64 PolarHBondContact O-N 2.91Å
61	K	82.7	Confident	81	Confident	159 Å²	159	123.9 Å²	123.9	69%	0.691	54%	0.536	S	S	*	.	H	α-helix	trans	-67.3	-41.3	174.3	-82.3	-178	177.9	-171.4	0	111.2	R57 K58 E59 R64 K65	R57-K61 WeakPolarHBondContact O-CB 3.49Å; R57-K61 VanDerWaalsContact O-CG 3.31Å; R57-K61 WeakPolarHBondContact O-CG 3.38Å; R57-K61 PolarHBondContact O-N 2.89Å; K58-K61 CarbonylContact O-C 3.59Å; K58-K61 WeakPolarHBondContact O-CB 3.48Å; K58-K61 PolarHBondContact O-N 3.36Å; K58-K61 VanDerWaalsContact O-N 3.13Å; E59-K61 VanDerWaalsContact C-N 3.29Å; E59-K61 PolarHBondContact O-N 2.78Å; K61-R64 PolarHBondContact O-N 3.48Å; K61-K65 WeakPolarHBondContact O-CB 3.39Å; K61-K65 PolarHBondContact O-N 3.44Å
62	Q	85	Confident	80	Confident	133 Å²	133	125 Å²	125	62%	0.621	54%	0.542	S	S	*	.	H	α-helix	trans	-66.8	-45.8	176.6	-75.5	176.4	-16.5	0	0	111.4	K58 E59 R64 K65 L66	K58-Q62 WeakPolarHBondContact O-CG 3.46Å; K58-Q62 PolarHBondContact O-N 2.85Å; E59-Q62 CarbonylContact O-C 3.6Å; E59-Q62 PolarHBondContact O-N 2.94Å; E59-Q62 VanDerWaalsContact O-N 3.12Å; Q62-R64 VanDerWaalsContact C-N 3.34Å; Q62-R64 PolarHBondContact O-N 2.82Å; Q62-K65 CarbonylContact O-C 3.58Å; Q62-K65 WeakPolarHBondContact O-CA 3.11Å; Q62-K65 WeakPolarHBondContact O-CB 3.39Å; Q62-K65 PolarHBondContact O-N 3.21Å; Q62-L66 WeakPolarHBondContact O-CB 3.39Å; Q62-L66 PolarHBondContact O-N 3.5Å
63	Q	82.7	Confident	78.9	Confident	124 Å²	124	127.4 Å²	127.4	58%	0.579	55%	0.551	S	S	*	*	H	α-helix	trans	-58.3	-43.5	173.2	-75.7	178.3	-11.2	0	0	111.7	E59 K65 L66 Q67	E59-Q63 WeakPolarHBondContact O-CB 3.4Å; E59-Q63 WeakPolarHBondContact O-CG 3.32Å; E59-Q63 PolarHBondContact O-N 2.88Å; Q63-K65 VanDerWaalsContact C-N 3.32Å; Q63-K65 PolarHBondContact O-N 2.88Å; Q63-L66 PolarHBondContact O-N 3.06Å; Q63-Q67 WeakPolarHBondContact O-CB 3.36Å; Q63-Q67 WeakPolarHBondContact O-CG 3.25Å; Q63-Q67 PolarHBondContact O-N 2.92Å
64	R	79.7	Confident	77.9	Confident	161 Å²	161	131.7 Å²	131.7	61%	0.608	57%	0.574	S	S	*	*	H	α-helix	trans	-65.3	-33.7	173.6	-77.3	176.6	174.9	-161.5	-3	112.8	R60 K61 Q62 R68	R60-R64 WeakPolarHBondContact O-CB 2.95Å; R60-R64 VanDerWaalsContact O-CG 3.24Å; R60-R64 WeakPolarHBondContact O-CG 3.49Å; R60-R64 PolarHBondContact O-N 2.91Å; K61-R64 PolarHBondContact O-N 3.48Å; Q62-R64 VanDerWaalsContact C-N 3.34Å; Q62-R64 PolarHBondContact O-N 2.82Å; R64-R68 WeakPolarHBondContact O-CB 3.12Å; R64-R68 WeakPolarHBondContact O-CD 3.35Å; R64-R68 WeakPolarHBondContact O-CG 3.4Å; R64-R68 PolarHBondContact O-N 2.95Å
65	K	82.3	Confident	76.5	Confident	138 Å²	138	133 Å²	133	60%	0.6	59%	0.585	S	S	*	*	H	α-helix	trans	-70.5	-42.3	176.2	-170.7	-179.2	179.2	-174	0	110.8	K61 Q62 Q63 R68 Q69	K61-K65 WeakPolarHBondContact O-CB 3.39Å; K61-K65 PolarHBondContact O-N 3.44Å; Q62-K65 CarbonylContact O-C 3.58Å; Q62-K65 WeakPolarHBondContact O-CA 3.11Å; Q62-K65 WeakPolarHBondContact O-CB 3.39Å; Q62-K65 PolarHBondContact O-N 3.21Å; Q63-K65 VanDerWaalsContact C-N 3.32Å; Q63-K65 PolarHBondContact O-N 2.88Å; K65-R68 WeakPolarHBondContact O-CB 3.19Å; K65-R68 PolarHBondContact O-N 3.29Å; K65-Q69 PolarHBondContact O-N 3.47Å
66	L	81.8	Confident	74.8	Confident	99 Å²	99	136.3 Å²	136.3	52%	0.518	60%	0.598	S	S	.	*	H	α-helix	trans	-67.9	-44.1	177.2	-169.6	65.4	0	0	0	111.2	Q62 Q63 R68 Q69 N70	Q62-L66 WeakPolarHBondContact O-CB 3.39Å; Q62-L66 PolarHBondContact O-N 3.5Å; Q63-L66 PolarHBondContact O-N 3.06Å; L66-R68 VanDerWaalsContact C-N 3.29Å; L66-R68 PolarHBondContact O-N 3.49Å; L66-Q69 CarbonylContact O-C 3.54Å; L66-Q69 PolarHBondContact O-N 2.95Å; L66-Q69 VanDerWaalsContact O-N 3.07Å; L66-N70 PolarHBondContact O-N 3.46Å
67	Q	78.3	Confident	73	Confident	130 Å²	130	131.7 Å²	131.7	61%	0.607	60%	0.6	S	S	*	*	H	α-helix	trans	-57.1	-42.9	171.1	-81	178.4	-6.6	0	0	111.7	Q63 Q69 N70 T71	Q63-Q67 WeakPolarHBondContact O-CB 3.36Å; Q63-Q67 WeakPolarHBondContact O-CG 3.25Å; Q63-Q67 PolarHBondContact O-N 2.92Å; Q67-Q69 VanDerWaalsContact C-N 3.34Å; Q67-Q69 PolarHBondContact O-N 2.79Å; Q67-N70 PolarHBondContact O-N 3.44Å; Q67-T71 WeakPolarHBondContact O-CB 3.37Å; Q67-T71 PolarHBondContact O-N 3.38Å; Q67-T71 PolarHBondContact O-OG1 2.93Å
68	R	72.1	Confident	71.3	Confident	182 Å²	182	131.1 Å²	131.1	69%	0.687	61%	0.611	S	S	*	*	H	α-helix	trans	-63.7	-37.3	174.7	-76.6	171.5	177	-148.8	-2.1	112.8	R64 K65 L66 Q72	R64-R68 WeakPolarHBondContact O-CB 3.12Å; R64-R68 WeakPolarHBondContact O-CD 3.35Å; R64-R68 WeakPolarHBondContact O-CG 3.4Å; R64-R68 PolarHBondContact O-N 2.95Å; K65-R68 WeakPolarHBondContact O-CB 3.19Å; K65-R68 PolarHBondContact O-N 3.29Å; L66-R68 VanDerWaalsContact C-N 3.29Å; L66-R68 PolarHBondContact O-N 3.49Å; R68-Q72 VanDerWaalsContact O-CB 3.26Å; R68-Q72 WeakPolarHBondContact O-CB 3.38Å; R68-Q72 WeakPolarHBondContact O-CG 3.29Å; R68-Q72 PolarHBondContact O-N 3.05Å
69	Q	74.3	Confident	69.1	Low	98 Å²	98	127 Å²	127	46%	0.458	61%	0.611	S	S	.	*	H	α-helix	trans	-70	-43.7	176	-90.6	-179.1	-11.7	0	0	112.1	K65 L66 Q67 Q72 Q73	K65-Q69 PolarHBondContact O-N 3.47Å; L66-Q69 CarbonylContact O-C 3.54Å; L66-Q69 PolarHBondContact O-N 2.95Å; L66-Q69 VanDerWaalsContact O-N 3.07Å; Q67-Q69 VanDerWaalsContact C-N 3.34Å; Q67-Q69 PolarHBondContact O-N 2.79Å; Q69-Q72 CarbonylContact O-C 3.57Å; Q69-Q72 WeakPolarHBondContact O-CB 3.38Å; Q69-Q72 PolarHBondContact O-N 3.13Å; Q69-Q72 VanDerWaalsContact O-N 3.15Å; Q69-Q73 PolarHBondContact O-N 2.93Å
70	N	75.1	Confident	67	Low	78 Å²	78	127.7 Å²	127.7	42%	0.417	62%	0.623	S	S	.	*	H	α-helix	trans	-63.2	-47.8	175.9	-78.9	18.5	0	0	0	111.1	L66 Q67 Q72 Q73 E74	L66-N70 PolarHBondContact O-N 3.46Å; Q67-N70 PolarHBondContact O-N 3.44Å; N70-Q72 PolarHBondContact O-N 2.79Å; N70-Q73 PolarHBondContact O-N 2.78Å; N70-E74 WeakPolarHBondContact O-CG 3.37Å; N70-E74 PolarHBondContact O-N 2.71Å
71	T	66.6	Low	65.3	Low	60 Å²	60	125.5 Å²	125.5	37%	0.368	63%	0.633	S	S	.	*	H	α-helix	trans	-61.2	-30.4	173.7	-55.3	0	0	0	0	112.3	Q67 N75	Q67-T71 WeakPolarHBondContact O-CB 3.37Å; Q67-T71 PolarHBondContact O-N 3.38Å; Q67-T71 PolarHBondContact O-OG1 2.93Å; T71-N75 WeakPolarHBondContact O-CB 3.4Å; T71-N75 PolarHBondContact O-N 2.76Å
72	Q	60.9	Low	63.6	Low	131 Å²	131	120.6 Å²	120.6	61%	0.612	63%	0.627	S	S	*	*	H	α-helix	trans	-75.5	-32.2	173.7	-82	174.2	7.9	0	0	113.1	R68 Q69 N70	R68-Q72 VanDerWaalsContact O-CB 3.26Å; R68-Q72 WeakPolarHBondContact O-CB 3.38Å; R68-Q72 WeakPolarHBondContact O-CG 3.29Å; R68-Q72 PolarHBondContact O-N 3.05Å; Q69-Q72 CarbonylContact O-C 3.57Å; Q69-Q72 WeakPolarHBondContact O-CB 3.38Å; Q69-Q72 PolarHBondContact O-N 3.13Å; Q69-Q72 VanDerWaalsContact O-N 3.15Å; N70-Q72 PolarHBondContact O-N 2.79Å
73	Q	61.1	Low	61.6	Low	130 Å²	130	125.2 Å²	125.2	61%	0.607	64%	0.639	S	S	*	*	H	α-helix	trans	-74.7	-38.4	174.7	-92.9	-179.1	-13.4	0	0	111.9	Q69 N70 N75 R76	Q69-Q73 PolarHBondContact O-N 2.93Å; N70-Q73 PolarHBondContact O-N 2.78Å; Q73-N75 VanDerWaalsContact C-N 3.28Å; Q73-N75 PolarHBondContact O-N 3.44Å; Q73-R76 WeakPolarHBondContact O-CB 3.15Å; Q73-R76 PolarHBondContact O-N 3.42Å; Q73-R76 VanDerWaalsContact O-N 3.16Å
74	E	58.9	Low	60.1	Low	154 Å²	154	127.3 Å²	127.3	72%	0.72	65%	0.646	S	S	*	*	H	α-helix	trans	-64.1	-33.8	173.3	-73.5	175.3	165.6	0	0	111.7	N70 R76	N70-E74 WeakPolarHBondContact O-CG 3.37Å; N70-E74 PolarHBondContact O-N 2.71Å; E74-R76 VanDerWaalsContact C-N 3.29Å; E74-R76 PolarHBondContact O-N 2.75Å
75	N	54.3	Low	58.7	Low	126 Å²	126	128.2 Å²	128.2	67%	0.674	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	13.5	173.8	-97.4	34.5	0	0	0	114.7	T71 Q73 G77	T71-N75 WeakPolarHBondContact O-CB 3.4Å; T71-N75 PolarHBondContact O-N 2.76Å; Q73-N75 VanDerWaalsContact C-N 3.28Å; Q73-N75 PolarHBondContact O-N 3.44Å; N75-G77 VanDerWaalsContact C-N 3.27Å
76	R	51.5	Low	56.9	Low	212 Å²	212	127.4 Å²	127.4	80%	0.8	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.3	-2.1	174.4	-81.6	-174.4	170.2	-156.4	-4.3	114.2	Q73 E74	Q73-R76 WeakPolarHBondContact O-CB 3.15Å; Q73-R76 PolarHBondContact O-N 3.42Å; Q73-R76 VanDerWaalsContact O-N 3.16Å; E74-R76 VanDerWaalsContact C-N 3.29Å; E74-R76 PolarHBondContact O-N 2.75Å
77	G	47.5	Very low	55.3	Low	64 Å²	64	128.3 Å²	128.3	66%	0.66	67%	0.672	S	S	*	*	S	Bend	trans	-93.7	109	163.7	0	0	0	0	0	110.4	N75	N75-G77 VanDerWaalsContact C-N 3.27Å
78	D	44.1	Very low	54.3	Low	172 Å²	172	126.7 Å²	126.7	92%	0.92	67%	0.671	S	S	*	*	S	Bend	trans	54.4	110.2	171.8	-83.8	-25.8	0	0	0	120.1
79	G	41.4	Very low	53.9	Low	63 Å²	63	126.6 Å²	126.6	65%	0.649	68%	0.679	S	S	*	*	S	Bend	trans	125.7	149.3	152.8	0	0	0	0	0	117
80	P	43.9	Very low	53.9	Low	104 Å²	104	124.2 Å²	124.2	68%	0.675	68%	0.676	S	S	*	*			trans	-68.9	141.1	-160.2	28.2	-34.3	0	0	0	113.9
81	S	47.3	Very low	54.4	Low	117 Å²	117	124.3 Å²	124.3	82%	0.818	68%	0.679	S	S	*	*	S	Bend	trans	-54.5	140.3	-178.4	63	0	0	0	0	114.6
82	G	45.9	Very low	55.3	Low	56 Å²	56	126.1 Å²	126.1	58%	0.577	69%	0.692	S	S	*	*	S	Bend	trans	102.6	124.9	-177.4	0	0	0	0	0	108.6	K84	G82-K84 PolarHBondContact O-N 2.93Å
83	R	44.9	Very low	56.7	Low	230 Å²	230	120.4 Å²	120.4	87%	0.868	67%	0.666	S	S	*	*			trans	-60.7	80.7	168.4	-71.3	179	179.1	-176.7	-3.6	108.1	R85	R83-R85 VanDerWaalsContact C-N 3.31Å; R83-R85 PolarHBondContact O-N 2.81Å
84	K	49.8	Very low	58.2	Low	168 Å²	168	117.3 Å²	117.3	73%	0.73	66%	0.659	S	S	*	*			trans	-63.9	105.8	158.9	-67.3	-172.8	-173.2	-176.6	0	102.5	G82	G82-K84 PolarHBondContact O-N 2.93Å
85	R	50	Low	59.9	Low	180 Å²	180	110 Å²	110	68%	0.679	63%	0.625	S	S	*	*			trans	-48.8	138	160.1	-69.9	-178.1	178.9	-174.7	-2.9	105.7	R83 C87	R83-R85 VanDerWaalsContact C-N 3.31Å; R83-R85 PolarHBondContact O-N 2.81Å; R85-C87 PolarHBondContact O-N 2.9Å
86	P	45.5	Very low	61.9	Low	122 Å²	122	106.2 Å²	106.2	79%	0.792	60%	0.601	S	S	*	*			trans	-48.7	117.6	179.2	17.8	-28.4	0	0	0	107.4	T88	P86-T88 VanDerWaalsContact C-N 3.27Å; P86-T88 PolarHBondContact O-N 3.05Å; P86-T88 VanDerWaalsContact O-N 3.09Å
87	C	48.2	Very low	64	Low	118 Å²	118	96.1 Å²	96.1	80%	0.797	56%	0.563	S	S	*	*			trans	-76.3	95.6	171.8	-172	0	0	0	0	103.3	R85 E89	R85-C87 PolarHBondContact O-N 2.9Å; C87-E89 PolarHBondContact O-N 3.37Å
88	T	58	Low	66.4	Low	96 Å²	96	93 Å²	93	59%	0.589	53%	0.532	S	S	*	.			trans	-50.7	140	161.5	-45.1	0	0	0	0	106.9	P86 A90	P86-T88 VanDerWaalsContact C-N 3.27Å; P86-T88 PolarHBondContact O-N 3.05Å; P86-T88 VanDerWaalsContact O-N 3.09Å; T88-A90 PolarHBondContact O-N 3.49Å
89	E	62.1	Low	69	Low	179 Å²	179	84.9 Å²	84.9	84%	0.836	49%	0.488	S	S	*	.			trans	-55.2	106.7	176.3	-69	-172.1	167.8	0	0	108.7	C87 T91	C87-E89 PolarHBondContact O-N 3.37Å; E89-T91 PolarHBondContact O-N 3.17Å
90	A	74.8	Confident	71.6	Confident	48 Å²	48	81.9 Å²	81.9	40%	0.397	46%	0.457	S	S	.	.			trans	-79.8	118.5	-173.7	0	0	0	0	0	108.3	T88 P92 S130 P132	T88-A90 PolarHBondContact O-N 3.49Å; A90-P92 WeakPolarHBondContact O-CD 3.41Å; A90-S130 WeakPolarHBondContact CA-O 3.5Å; A90-P132 HydrophobicContact CB-CG 4.16Å
91	T	85.7	Confident	74.1	Confident	81 Å²	81	77.1 Å²	77.1	50%	0.497	43%	0.426	S	S	.	.			trans	-98.9	105.7	173.7	41.9	0	0	0	0	107.6	E89 S93 S130 H131	E89-T91 PolarHBondContact O-N 3.17Å; T91-S93 PolarHBondContact O-N 2.89Å; T91-S130 PolarHBondContact N-O 2.84Å; T91-S130 VanDerWaalsContact N-O 3.15Å; T91-H131 WeakPolarHBondContact O-CA 3.42Å; T91-H131 PolarHBondContact O-ND1 3.47Å; T91-H131 PolarHBondContact OG1-CE1 3.32Å; T91-H131 PolarHBondContact OG1-ND1 3.03Å
92	P	86.3	Confident	76.4	Confident	98 Å²	98	73.3 Å²	73.3	64%	0.636	40%	0.399	S	S	*	.			trans	-63.3	136.7	-173.1	25.7	-33.5	0	0	0	110.9	A90	A90-P92 WeakPolarHBondContact O-CD 3.41Å
93	S	89.4	Confident	78.7	Confident	10 Å²	10	70.7 Å²	70.7	7%	0.07	37%	0.372	C	S	.	.			trans	-79.6	146.7	171.8	-173.1	0	0	0	0	110.1	T91 L95 P132 Q134	T91-S93 PolarHBondContact O-N 2.89Å; S93-L95 WeakPolarHBondContact OG-CB 3.35Å; S93-L95 PolarHBondContact OG-N 3.19Å; S93-P132 PolarHBondContact N-O 3.4Å; S93-Q134 PolarHBondContact O-NE2 3.24Å
94	S	91.9	Very high	81	Confident	65 Å²	65	60.4 Å²	60.4	46%	0.455	34%	0.335	S	S	.	.			trans	-78.5	-10.9	170	55.4	0	0	0	0	112.8	R96 Q193	S94-R96 PolarHBondContact O-N 3.09Å; S94-Q193 CarbonylContact C-O 3.49Å; S94-Q193 WeakPolarHBondContact OG-CB 3.36Å; S94-Q193 PolarHBondContact OG-O 2.96Å
95	L	94.6	Very high	83.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	34%	0.338	C	S	.	.			trans	-61.5	131.9	-179.7	-171.9	144.5	0	0	0	111.2	S93 L97 V133 Q134 L191 Q193 Y197 I249 L253	S93-L95 WeakPolarHBondContact OG-CB 3.35Å; S93-L95 PolarHBondContact OG-N 3.19Å; L95-L97 HydrophobicContact CD2-CB 4.2Å; L95-V133 HydrophobicContact CB-CG1 4.43Å; L95-V133 HydrophobicContact CD2-CB 4.39Å; L95-V133 HydrophobicContact CD2-CG1 3.94Å; L95-Q134 PolarHBondContact O-N 2.66Å; L95-L191 HydrophobicContact CD1-CB 3.85Å; L95-L191 HydrophobicContact CD1-CD1 4.09Å; L95-L191 HydrophobicContact CD1-CG 4.49Å; L95-Q193 WeakPolarHBondContact CA-O 3.37Å; L95-Q193 PolarHBondContact N-O 3.42Å; L95-Y197 HydrophobicContact CD1-CD2 3.84Å; L95-Y197 HydrophobicContact CD1-CE2 3.71Å; L95-Y197 HydrophobicContact CD2-CD2 4.13Å; L95-Y197 HydrophobicContact CG-CD2 4.03Å; L95-Y197 HydrophobicContact CG-CE2 4.28Å; L95-I249 HydrophobicContact CD2-CG2 4.3Å; L95-L253 HydrophobicContact CD1-CD2 4.49Å
96	R	96.3	Very high	85.1	Confident	47 Å²	47	54.2 Å²	54.2	18%	0.177	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.7	176.7	-67.8	170.1	-76.6	172.4	-4.2	109.4	S94 L98 Q134 Y136 E176 K194 A196 Y197	S94-R96 PolarHBondContact O-N 3.09Å; R96-L98 HydrophobicContact CB-CD1 4.27Å; R96-Q134 HydrophobicContact CG-CB 3.95Å; R96-Q134 HydrophobicContact CG-CG 4.43Å; R96-Y136 HydrophobicContact CB-CD2 4.46Å; R96-Y136 HydrophobicContact CB-CE2 4.24Å; R96-Y136 HydrophobicContact CG-CE2 3.93Å; R96-E176 IonicContact CZ-OE2 2.94Å; R96-E176 IonicContact NH1-OE2 3.97Å; R96-E176 PolarHBondContact NH1-OE2 3.43Å; R96-E176 IonicContact NH2-OE1 3.95Å; R96-E176 PolarHBondContact NH2-OE1 3.46Å; R96-E176 IonicContact NH2-OE2 3.55Å; R96-E176 PolarHBondContact NH2-OE2 3.1Å; R96-K194 PolarHBondContact NH2-O 3.48Å; R96-A196 HydrophobicContact CB-CB 4.07Å; R96-A196 WeakPolarHBondContact O-CA 3.34Å; R96-Y197 PolarHBondContact O-N 3.18Å
97	L	97.4	Very high	87.4	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	117.1	178.7	-165.5	58.8	0	0	0	109.1	L95 V133 Q134 Y136 I199 F246 I249	L95-L97 HydrophobicContact CD2-CB 4.2Å; L97-V133 HydrophobicContact CB-CB 4.41Å; L97-V133 HydrophobicContact CB-CG2 3.83Å; L97-V133 HydrophobicContact CD2-CG2 4.14Å; L97-Q134 PolarHBondContact N-O 2.89Å; L97-Y136 PolarHBondContact O-N 2.82Å; L97-I199 HydrophobicContact CD1-CD1 3.89Å; L97-I199 HydrophobicContact CD1-CG1 4.17Å; L97-I199 HydrophobicContact CD2-CD1 4.25Å; L97-I199 HydrophobicContact CG-CD1 4.11Å; L97-F246 HydrophobicContact CB-CE2 4.29Å; L97-F246 HydrophobicContact CD2-CD1 4.34Å; L97-F246 HydrophobicContact CD2-CD2 3.34Å; L97-F246 HydrophobicContact CD2-CE1 4.38Å; L97-F246 HydrophobicContact CD2-CE2 3.4Å; L97-F246 HydrophobicContact CD2-CG 3.85Å; L97-F246 HydrophobicContact CD2-CZ 3.94Å; L97-F246 HydrophobicContact CG-CD2 3.94Å; L97-F246 HydrophobicContact CG-CE2 3.84Å; L97-I249 HydrophobicContact CD2-CB 4.17Å; L97-I249 HydrophobicContact CD2-CG2 4.01Å
98	L	97.6	Very high	89.6	Confident	0 Å²	0	49 Å²	49	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	137.9	-173.4	-60.9	82.7	0	0	0	109.8	R96 Y136 T138 V172 L177 A196 Y197 V198 I199	R96-L98 HydrophobicContact CB-CD1 4.27Å; L98-Y136 CarbonylContact C-O 3.6Å; L98-Y136 WeakPolarHBondContact CA-O 3.42Å; L98-Y136 HydrophobicContact CG-CG 4.3Å; L98-T138 HydrophobicContact CD2-CG2 4.09Å; L98-V172 HydrophobicContact CD2-CG2 3.95Å; L98-L177 HydrophobicContact CD2-CD2 4.44Å; L98-A196 HydrophobicContact CD1-CB 3.64Å; L98-Y197 PolarHBondContact N-O 2.86Å; L98-V198 HydrophobicContact CB-CG1 4.49Å; L98-V198 HydrophobicContact CB-CG2 4.23Å; L98-V198 HydrophobicContact CD1-CG2 4.47Å; L98-V198 CarbonylContact O-C 3.55Å; L98-I199 PolarHBondContact O-N 3.28Å
99	V	97.8	Very high	91.3	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	118.9	164.5	176.9	0	0	0	0	108.3	C101 F135 Y136 T138 I199 V242	V99-C101 PolarHBondContact O-N 2.83Å; V99-F135 HydrophobicContact CB-CE2 4.33Å; V99-F135 HydrophobicContact CG2-CE2 3.71Å; V99-F135 HydrophobicContact CG2-CZ 4.25Å; V99-Y136 PolarHBondContact N-O 2.94Å; V99-T138 PolarHBondContact O-N 3.43Å; V99-T138 PolarHBondContact O-OG1 3.35Å; V99-I199 WeakPolarHBondContact CA-O 3.21Å; V99-V242 HydrophobicContact CG1-CG1 4.24Å; V99-V242 HydrophobicContact CG2-CG1 4.17Å
100	D	97.1	Very high	92.8	Very high	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	107.7	176.7	173.9	20.6	0	0	0	110.4	S102 F103 S139 Y168 V198 I199 G201	D100-S102 WeakPolarHBondContact OD1-CB 3.39Å; D100-S102 PolarHBondContact OD1-N 3.28Å; D100-S102 PolarHBondContact OD1-OG 3.16Å; D100-S102 PolarHBondContact OD2-OG 3.27Å; D100-F103 HydrophobicContact CB-CE2 4.34Å; D100-F103 WeakPolarHBondContact OD2-CE2 3.15Å; D100-S139 PolarHBondContact OD1-OG 3.12Å; D100-Y168 HydrophobicContact CB-CD1 3.88Å; D100-Y168 HydrophobicContact CB-CE1 3.94Å; D100-Y168 VanDerWaalsContact CG-CE1 3.47Å; D100-Y168 WeakPolarHBondContact OD2-CE1 3.4Å; D100-V198 HydrophobicContact CB-CG1 3.89Å; D100-I199 PolarHBondContact N-O 3.09Å; D100-G201 WeakPolarHBondContact O-CA 3.42Å; D100-G201 PolarHBondContact O-N 3.25Å
101	C	95.9	Very high	93.8	Very high	5 Å²	5	45.2 Å²	45.2	3%	0.034	25%	0.246	C	C	.	.			trans	-93.7	16	178.7	-61	0	0	0	0	114.1	V99 F103 T138 L144	V99-C101 PolarHBondContact O-N 2.83Å; C101-F103 PolarHBondContact O-N 3.31Å; C101-F103 VanDerWaalsContact O-N 3.1Å; C101-T138 VanDerWaalsContact CB-O 3.3Å; C101-T138 WeakPolarHBondContact CB-O 3.44Å; C101-T138 PolarHBondContact N-O 3.09Å; C101-L144 HydrophobicContact CB-CD2 3.75Å; C101-L144 WeakPolarHBondContact SG-CD2 3.4Å
102	S	95.3	Very high	94.2	Very high	36 Å²	36	41.4 Å²	41.4	25%	0.252	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.1	-6.8	-179.3	66.8	0	0	0	0	114.8	D100 R215	D100-S102 WeakPolarHBondContact OD1-CB 3.39Å; D100-S102 PolarHBondContact OD1-N 3.28Å; D100-S102 PolarHBondContact OD1-OG 3.16Å; D100-S102 PolarHBondContact OD2-OG 3.27Å; S102-R215 PolarHBondContact OG-NH1 3.27Å
103	F	94.2	Very high	94.6	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.009	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.4	13.2	-177.6	-52.3	-87	0	0	0	114.3	D100 C101 N105 L106 Y179 L202 I211 R215	D100-F103 HydrophobicContact CB-CE2 4.34Å; D100-F103 WeakPolarHBondContact OD2-CE2 3.15Å; C101-F103 PolarHBondContact O-N 3.31Å; C101-F103 VanDerWaalsContact O-N 3.1Å; F103-N105 PolarHBondContact O-N 2.78Å; F103-N105 VanDerWaalsContact O-N 3.15Å; F103-L106 HydrophobicContact CB-CD1 4.4Å; F103-L106 HydrophobicContact CD1-CD1 3.93Å; F103-L106 PolarHBondContact O-N 3.43Å; F103-Y179 WeakPolarHBondContact CE2-OH 3.45Å; F103-Y179 WeakPolarHBondContact CZ-OH 3.44Å; F103-L202 HydrophobicContact CB-CB 4.23Å; F103-L202 HydrophobicContact CB-CD1 3.86Å; F103-L202 HydrophobicContact CB-CG 4.46Å; F103-L202 HydrophobicContact CD1-CD2 4.28Å; F103-L202 HydrophobicContact CD2-CB 4.2Å; F103-L202 HydrophobicContact CG-CB 4.18Å; F103-L202 HydrophobicContact CG-CD1 4.47Å; F103-L202 HydrophobicContact CG-CD2 4.45Å; F103-I211 HydrophobicContact CD1-CD1 4.29Å; F103-I211 HydrophobicContact CE1-CD1 4.23Å; F103-I211 HydrophobicContact CE1-CG1 4.24Å; F103-I211 HydrophobicContact CE1-CG2 4.22Å; F103-R215 VanDerWaalsContact CD1-CZ 3.48Å; F103-R215 VanDerWaalsContact CD1-NH1 3.27Å; F103-R215 VanDerWaalsContact CZ-NH1 3.32Å
104	D	92.7	Very high	94.9	Very high	14 Å²	14	45.3 Å²	45.3	8%	0.075	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-52.3	-39.7	-175.9	-169.1	76.5	0	0	0	113	L106 M107 Q143 L144	D104-L106 PolarHBondContact O-N 2.87Å; D104-M107 PolarHBondContact O-N 3.39Å; D104-M107 VanDerWaalsContact O-N 3.17Å; D104-Q143 PolarHBondContact O-NE2 3.34Å; D104-Q143 PolarHBondContact OD1-N 3.46Å; D104-Q143 WeakPolarHBondContact OD2-CB 3.49Å; D104-Q143 WeakPolarHBondContact OD2-CG 3.35Å; D104-Q143 PolarHBondContact OD2-N 2.9Å; D104-Q143 PolarHBondContact OD2-NE2 2.81Å; D104-L144 WeakPolarHBondContact OD1-CB 3.31Å; D104-L144 PolarHBondContact OD1-N 3.44Å
105	N	93.3	Very high	95.1	Very high	149 Å²	149	42.2 Å²	42.2	80%	0.797	20%	0.204	S	C	*	.	G	3₁₀ helix	trans	-67	-19.7	-179.9	-63.7	-29	0	0	0	114.2	F103	F103-N105 PolarHBondContact O-N 2.78Å; F103-N105 VanDerWaalsContact O-N 3.15Å
106	L	92.8	Very high	95.1	Very high	68 Å²	68	42.3 Å²	42.3	36%	0.356	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-89.5	-6.3	179.1	-57.1	179.2	0	0	0	112.5	F103 D104 L202 I211	F103-L106 HydrophobicContact CB-CD1 4.4Å; F103-L106 HydrophobicContact CD1-CD1 3.93Å; F103-L106 PolarHBondContact O-N 3.43Å; D104-L106 PolarHBondContact O-N 2.87Å; L106-L202 HydrophobicContact CB-CD1 4.32Å; L106-I211 HydrophobicContact CD1-CD1 3.3Å
107	M	93.7	Very high	95.1	Very high	8 Å²	8	46.8 Å²	46.8	4%	0.039	23%	0.225	C	C	.	.	S	Bend	trans	-109.3	138	-176.5	-70.7	-178.8	-70.4	0	0	111.7	D104 D111 V112 L115 Q143 L202 V203	D104-M107 PolarHBondContact O-N 3.39Å; D104-M107 VanDerWaalsContact O-N 3.17Å; M107-D111 HydrophobicContact CB-CB 4.29Å; M107-D111 HydrophobicContact CG-CB 4.46Å; M107-V112 HydrophobicContact CB-CG2 3.71Å; M107-V112 HydrophobicContact CE-CG2 4.41Å; M107-L115 HydrophobicContact CE-CD2 3.59Å; M107-L115 HydrophobicContact SD-CB 4.42Å; M107-L115 HydrophobicContact SD-CD2 4Å; M107-Q143 PolarHBondContact O-NE2 3.4Å; M107-L202 HydrophobicContact CG-CD1 3.7Å; M107-L202 HydrophobicContact SD-CD1 4.11Å; M107-V203 HydrophobicContact SD-CB 4.21Å; M107-V203 PolarHBondContact SD-N 3.5Å
108	L	94.2	Very high	95	Very high	122 Å²	122	48.3 Å²	48.3	64%	0.639	23%	0.232	S	C	*	.			trans	-71	154.1	165.4	-61	175.7	0	0	0	109.7	K110 D111 V112	L108-K110 PolarHBondContact O-N 3.48Å; L108-D111 WeakPolarHBondContact O-CA 3.3Å; L108-D111 PolarHBondContact O-N 3.35Å; L108-V112 PolarHBondContact O-N 3.05Å
109	I	93.6	Very high	94.9	Very high	70 Å²	70	48.3 Å²	48.3	36%	0.359	23%	0.232	S	C	.	.	H	α-helix	trans	-53.5	-29.1	177.7	-165.5	61.6	0	0	0	113.7	D111 R113 Q143	I109-D111 VanDerWaalsContact C-N 3.32Å; I109-R113 WeakPolarHBondContact O-CB 3.14Å; I109-R113 WeakPolarHBondContact O-CD 3.41Å; I109-R113 WeakPolarHBondContact O-CG 3.41Å; I109-R113 PolarHBondContact O-N 2.65Å; I109-R113 VanDerWaalsContact O-N 3.11Å; I109-Q143 HydrophobicContact CD1-CB 4.16Å
110	K	94.4	Very high	94.8	Very high	155 Å²	155	50.8 Å²	50.8	67%	0.674	24%	0.244	S	C	*	.	H	α-helix	trans	-67.1	-34	175.3	-69.2	-179.8	-176.2	172	0	112.1	L108 K114	L108-K110 PolarHBondContact O-N 3.48Å; K110-K114 WeakPolarHBondContact O-CG 3.5Å
111	D	95	Very high	94.7	Very high	20 Å²	20	55.2 Å²	55.2	11%	0.107	26%	0.261	C	S	.	.	H	α-helix	trans	-86	-37.4	-179.4	-61.5	-43.1	0	0	0	111.5	M107 L108 I109 R113 K114 L115 V203 H205	M107-D111 HydrophobicContact CB-CB 4.29Å; M107-D111 HydrophobicContact CG-CB 4.46Å; L108-D111 WeakPolarHBondContact O-CA 3.3Å; L108-D111 PolarHBondContact O-N 3.35Å; I109-D111 VanDerWaalsContact C-N 3.32Å; D111-R113 PolarHBondContact O-N 2.98Å; D111-K114 CarbonylContact O-C 3.59Å; D111-K114 WeakPolarHBondContact O-CA 3.15Å; D111-K114 VanDerWaalsContact O-CB 3.31Å; D111-K114 WeakPolarHBondContact O-CB 3.44Å; D111-K114 PolarHBondContact O-N 3.15Å; D111-K114 IonicContact OD1-NZ 3.33Å; D111-K114 PolarHBondContact OD1-NZ 3.38Å; D111-L115 PolarHBondContact O-N 3.19Å; D111-V203 HydrophobicContact CB-CB 4.26Å; D111-V203 HydrophobicContact CB-CG1 4.22Å; D111-V203 WeakPolarHBondContact CB-O 3.34Å; D111-H205 IonicContact OD1-NE2 3.38Å
112	V	95.3	Very high	94.7	Very high	0 Å²	0	55 Å²	55	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-53	-44.6	167.1	175.3	0	0	0	0	110.9	M107 L108 K114 L115 H116 Q143 L144	M107-V112 HydrophobicContact CB-CG2 3.71Å; M107-V112 HydrophobicContact CE-CG2 4.41Å; L108-V112 PolarHBondContact O-N 3.05Å; V112-K114 PolarHBondContact O-N 3.22Å; V112-L115 WeakPolarHBondContact O-CB 3.42Å; V112-L115 PolarHBondContact O-N 3.36Å; V112-H116 PolarHBondContact O-N 3.03Å; V112-Q143 HydrophobicContact CG1-CB 4.15Å; V112-Q143 HydrophobicContact CG2-CB 4.12Å; V112-L144 VanDerWaalsContact CG1-CA 3.48Å; V112-L144 HydrophobicContact CG1-CB 4.03Å; V112-L144 HydrophobicContact CG1-CD1 4.08Å
113	R	94.4	Very high	94.7	Very high	106 Å²	106	54.2 Å²	54.2	40%	0.4	25%	0.251	S	S	.	.	H	α-helix	trans	-64.2	-26.3	174.8	-72.8	168.6	176.9	177.8	5.3	113.6	I109 D111 K117	I109-R113 WeakPolarHBondContact O-CB 3.14Å; I109-R113 WeakPolarHBondContact O-CD 3.41Å; I109-R113 WeakPolarHBondContact O-CG 3.41Å; I109-R113 PolarHBondContact O-N 2.65Å; I109-R113 VanDerWaalsContact O-N 3.11Å; D111-R113 PolarHBondContact O-N 2.98Å; R113-K117 WeakPolarHBondContact O-CG 3.3Å; R113-K117 PolarHBondContact O-N 3.46Å
114	K	95.4	Very high	94.7	Very high	85 Å²	85	55.6 Å²	55.6	37%	0.37	26%	0.262	S	S	.	.	H	α-helix	trans	-76.6	-43.7	172.6	-64.8	-175.7	-166.9	84.5	0	110.2	K110 D111 V112 H116 K117 Q118 V203	K110-K114 WeakPolarHBondContact O-CG 3.5Å; D111-K114 CarbonylContact O-C 3.59Å; D111-K114 WeakPolarHBondContact O-CA 3.15Å; D111-K114 VanDerWaalsContact O-CB 3.31Å; D111-K114 WeakPolarHBondContact O-CB 3.44Å; D111-K114 PolarHBondContact O-N 3.15Å; D111-K114 IonicContact OD1-NZ 3.33Å; D111-K114 PolarHBondContact OD1-NZ 3.38Å; V112-K114 PolarHBondContact O-N 3.22Å; K114-H116 VanDerWaalsContact C-N 3.33Å; K114-H116 PolarHBondContact O-N 3.49Å; K114-K117 WeakPolarHBondContact O-CB 3.32Å; K114-K117 PolarHBondContact O-N 3.02Å; K114-Q118 WeakPolarHBondContact O-CG 3.2Å; K114-Q118 PolarHBondContact O-N 3.25Å; K114-V203 HydrophobicContact CB-CG1 4.2Å; K114-V203 HydrophobicContact CD-CG1 4.19Å
115	L	96.4	Very high	94.7	Very high	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-58.1	-45.9	175.5	178.8	62.7	0	0	0	111.2	M107 D111 V112 K117 Q118 I119 L144 G201 V203 V242	M107-L115 HydrophobicContact CE-CD2 3.59Å; M107-L115 HydrophobicContact SD-CB 4.42Å; M107-L115 HydrophobicContact SD-CD2 4Å; D111-L115 PolarHBondContact O-N 3.19Å; V112-L115 WeakPolarHBondContact O-CB 3.42Å; V112-L115 PolarHBondContact O-N 3.36Å; L115-K117 VanDerWaalsContact C-N 3.33Å; L115-K117 PolarHBondContact O-N 2.84Å; L115-Q118 CarbonylContact O-C 3.38Å; L115-Q118 WeakPolarHBondContact O-CA 3.5Å; L115-Q118 WeakPolarHBondContact O-CB 3.43Å; L115-Q118 PolarHBondContact O-N 3.05Å; L115-I119 HydrophobicContact CD1-CD1 4.27Å; L115-I119 HydrophobicContact CD1-CG1 4.44Å; L115-I119 HydrophobicContact CG-CD1 3.89Å; L115-I119 PolarHBondContact O-N 2.95Å; L115-L144 HydrophobicContact CD2-CD1 4.32Å; L115-L144 HydrophobicContact CD2-CD2 4.07Å; L115-L144 HydrophobicContact CG-CD1 4.42Å; L115-G201 WeakPolarHBondContact CD2-O 3.44Å; L115-V203 HydrophobicContact CB-CG2 3.88Å; L115-V203 HydrophobicContact CD1-CG2 4.28Å; L115-V242 HydrophobicContact CD1-CG2 3.91Å
116	H	95.4	Very high	94.8	Very high	2 Å²	2	49.8 Å²	49.8	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-54	-48.8	174.7	178.1	-167.7	0	0	0	111.5	V112 K114 Q118 I119 Q120 L144 S147 D152	V112-H116 PolarHBondContact O-N 3.03Å; K114-H116 VanDerWaalsContact C-N 3.33Å; K114-H116 PolarHBondContact O-N 3.49Å; H116-Q118 VanDerWaalsContact C-N 3.26Å; H116-Q118 PolarHBondContact O-N 2.89Å; H116-I119 PolarHBondContact O-N 3.31Å; H116-Q120 WeakPolarHBondContact O-CG 3.44Å; H116-Q120 PolarHBondContact O-N 3.47Å; H116-L144 HydrophobicContact CB-CD1 4.03Å; H116-S147 PolarHBondContact CE1-O 3.11Å; H116-S147 PolarHBondContact ND1-O 3.35Å; H116-D152 IonicContact CE1-OD2 3.68Å; H116-D152 PolarHBondContact CE1-OD2 3.45Å; H116-D152 IonicContact ND1-OD2 2.61Å; H116-D152 IonicContact NE2-OD2 3.15Å; H116-D152 PolarHBondContact NE2-OD2 3.15Å; H116-D152 VanDerWaalsContact NE2-OD2 3.17Å
117	K	95.1	Very high	94.7	Very high	141 Å²	141	54.4 Å²	54.4	61%	0.613	24%	0.243	S	C	*	.	H	α-helix	trans	-61	-34.5	175.6	-72.1	178.9	178.2	-176.8	0	113.3	R113 K114 L115 R121	R113-K117 WeakPolarHBondContact O-CG 3.3Å; R113-K117 PolarHBondContact O-N 3.46Å; K114-K117 WeakPolarHBondContact O-CB 3.32Å; K114-K117 PolarHBondContact O-N 3.02Å; L115-K117 VanDerWaalsContact C-N 3.33Å; L115-K117 PolarHBondContact O-N 2.84Å; K117-R121 WeakPolarHBondContact O-CB 3.32Å; K117-R121 PolarHBondContact O-N 3.32Å
118	Q	95.9	Very high	94.6	Very high	32 Å²	32	60.9 Å²	60.9	15%	0.15	27%	0.267	C	S	.	.	H	α-helix	trans	-68.1	-43.1	175.9	-69.3	176.6	14.2	0	0	111	K114 L115 H116 Q120 R121 C122 V242 N243	K114-Q118 WeakPolarHBondContact O-CG 3.2Å; K114-Q118 PolarHBondContact O-N 3.25Å; L115-Q118 CarbonylContact O-C 3.38Å; L115-Q118 WeakPolarHBondContact O-CA 3.5Å; L115-Q118 WeakPolarHBondContact O-CB 3.43Å; L115-Q118 PolarHBondContact O-N 3.05Å; H116-Q118 VanDerWaalsContact C-N 3.26Å; H116-Q118 PolarHBondContact O-N 2.89Å; Q118-Q120 PolarHBondContact O-N 3.01Å; Q118-R121 WeakPolarHBondContact O-CA 3.25Å; Q118-R121 WeakPolarHBondContact O-CB 3.3Å; Q118-R121 PolarHBondContact O-N 3.04Å; Q118-R121 VanDerWaalsContact O-N 3.11Å; Q118-C122 PolarHBondContact O-N 3.33Å; Q118-C122 PolarHBondContact O-SG 3.17Å; Q118-V242 HydrophobicContact CB-CB 4.46Å; Q118-N243 HydrophobicContact CB-CB 4.08Å; Q118-N243 HydrophobicContact CG-CB 4.31Å
119	I	95.7	Very high	94.4	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-60.4	-44.8	174.7	-69.3	157.2	0	0	0	111.1	L115 H116 R121 C122 Y123 L137 L144 W158	L115-I119 HydrophobicContact CD1-CD1 4.27Å; L115-I119 HydrophobicContact CD1-CG1 4.44Å; L115-I119 HydrophobicContact CG-CD1 3.89Å; L115-I119 PolarHBondContact O-N 2.95Å; H116-I119 PolarHBondContact O-N 3.31Å; I119-R121 VanDerWaalsContact C-N 3.25Å; I119-R121 PolarHBondContact O-N 3.24Å; I119-C122 WeakPolarHBondContact O-CB 3.37Å; I119-C122 PolarHBondContact O-N 2.95Å; I119-Y123 PolarHBondContact O-N 3.15Å; I119-L137 HydrophobicContact CB-CD1 4.43Å; I119-L137 HydrophobicContact CD1-CD1 3.83Å; I119-L137 HydrophobicContact CG1-CD1 4.02Å; I119-L137 HydrophobicContact CG2-CD1 3.52Å; I119-L144 HydrophobicContact CD1-CD1 4.13Å; I119-L144 HydrophobicContact CD1-CD2 3.93Å; I119-W158 HydrophobicContact CG2-CH2 4.3Å; I119-W158 HydrophobicContact CG2-CZ3 4.03Å
120	Q	94.6	Very high	94.2	Very high	51 Å²	51	53.5 Å²	53.5	24%	0.238	23%	0.233	C	C	.	.	H	α-helix	trans	-58.4	-39.7	174.8	-68.4	178	-59.4	0	0	112	H116 Q118 A124 D152 W158	H116-Q120 WeakPolarHBondContact O-CG 3.44Å; H116-Q120 PolarHBondContact O-N 3.47Å; Q118-Q120 PolarHBondContact O-N 3.01Å; Q120-A124 VanDerWaalsContact O-CB 3.3Å; Q120-A124 WeakPolarHBondContact O-CB 3.48Å; Q120-A124 PolarHBondContact O-N 2.78Å; Q120-D152 PolarHBondContact NE2-OD1 2.85Å; Q120-D152 PolarHBondContact NE2-OD2 2.85Å; Q120-W158 HydrophobicContact CB-CH2 4.47Å; Q120-W158 HydrophobicContact CG-CH2 3.95Å; Q120-W158 HydrophobicContact CG-CZ2 4.12Å
121	R	95	Very high	94.1	Very high	93 Å²	93	49 Å²	49	35%	0.351	21%	0.214	S	C	.	.	H	α-helix	trans	-64.8	-47.6	175.5	178	65.7	177	156.5	13	110.8	K117 Q118 I119 Y123 A124 E125 N243 E247	K117-R121 WeakPolarHBondContact O-CB 3.32Å; K117-R121 PolarHBondContact O-N 3.32Å; Q118-R121 WeakPolarHBondContact O-CA 3.25Å; Q118-R121 WeakPolarHBondContact O-CB 3.3Å; Q118-R121 PolarHBondContact O-N 3.04Å; Q118-R121 VanDerWaalsContact O-N 3.11Å; I119-R121 VanDerWaalsContact C-N 3.25Å; I119-R121 PolarHBondContact O-N 3.24Å; R121-Y123 VanDerWaalsContact C-N 3.34Å; R121-Y123 PolarHBondContact O-N 2.89Å; R121-A124 PolarHBondContact O-N 2.88Å; R121-E125 VanDerWaalsContact CZ-CG 3.43Å; R121-E125 IonicContact CZ-OE1 2.71Å; R121-E125 IonicContact CZ-OE2 2.76Å; R121-E125 IonicContact NH1-OE1 3.98Å; R121-E125 PolarHBondContact NH1-OE1 2.61Å; R121-E125 IonicContact NH1-OE2 2.7Å; R121-E125 PolarHBondContact NH1-OE2 3.25Å; R121-E125 IonicContact NH2-OE1 3.44Å; R121-E125 IonicContact NH2-OE2 3.85Å; R121-E125 PolarHBondContact NH2-OE2 3.1Å; R121-E125 WeakPolarHBondContact O-CG 3.41Å; R121-E125 PolarHBondContact O-N 2.97Å; R121-N243 HydrophobicContact CB-CB 4.24Å; R121-N243 HydrophobicContact CG-CB 4Å; R121-E247 VanDerWaalsContact CG-OE1 3.23Å; R121-E247 WeakPolarHBondContact CG-OE1 3.44Å; R121-E247 IonicContact CZ-OE1 3.17Å; R121-E247 IonicContact CZ-OE2 3.6Å; R121-E247 IonicContact NE-OE1 2.92Å; R121-E247 PolarHBondContact NE-OE1 2.94Å; R121-E247 VanDerWaalsContact NE-OE1 3.13Å; R121-E247 IonicContact NE-OE2 3.46Å; R121-E247 IonicContact NH2-OE1 4Å; R121-E247 IonicContact NH2-OE2 2.84Å; R121-E247 PolarHBondContact NH2-OE2 3.04Å
122	C	96.3	Very high	94.1	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-54.7	-49.9	175.6	-60.3	0	0	0	0	111.3	Q118 I119 A124 E125 N126 F135 F246	Q118-C122 PolarHBondContact O-N 3.33Å; Q118-C122 PolarHBondContact O-SG 3.17Å; I119-C122 WeakPolarHBondContact O-CB 3.37Å; I119-C122 PolarHBondContact O-N 2.95Å; C122-A124 PolarHBondContact O-N 2.76Å; C122-E125 PolarHBondContact O-N 3.49Å; C122-N126 WeakPolarHBondContact O-CB 3.29Å; C122-N126 PolarHBondContact O-N 2.89Å; C122-F135 HydrophobicContact CB-CE1 4.05Å; C122-F135 HydrophobicContact CB-CZ 4.03Å; C122-F246 HydrophobicContact CB-CB 4.29Å; C122-F246 HydrophobicContact CB-CD1 3.77Å; C122-F246 HydrophobicContact CB-CD2 3.87Å; C122-F246 HydrophobicContact CB-CE1 4Å; C122-F246 HydrophobicContact CB-CE2 4.1Å; C122-F246 HydrophobicContact CB-CG 3.71Å; C122-F246 HydrophobicContact CB-CZ 4.17Å; C122-F246 WeakPolarHBondContact O-CE1 3.49Å; C122-F246 VanDerWaalsContact SG-CB 3.57Å
123	Y	95.2	Very high	94.1	Very high	20 Å²	20	49.7 Å²	49.7	8%	0.078	22%	0.219	C	C	.	.	H	α-helix	trans	-60.3	-46.4	178.6	176.6	-108.9	0	0	0	112.4	I119 R121 E125 N126 R127 W158 K159 I161	I119-Y123 PolarHBondContact O-N 3.15Å; R121-Y123 VanDerWaalsContact C-N 3.34Å; R121-Y123 PolarHBondContact O-N 2.89Å; Y123-E125 VanDerWaalsContact C-N 3.32Å; Y123-E125 PolarHBondContact O-N 3.44Å; Y123-N126 PolarHBondContact O-N 3.39Å; Y123-R127 HydrophobicContact CE2-CG 4.16Å; Y123-R127 PolarHBondContact O-N 3.32Å; Y123-W158 AromaticContact CD1-CD2 3.62Å; Y123-W158 HydrophobicContact CD1-CD2 3.62Å; Y123-W158 AromaticContact CD1-CE2 3.72Å; Y123-W158 AromaticContact CD1-CE3 3.88Å; Y123-W158 HydrophobicContact CD1-CE3 3.88Å; Y123-W158 HydrophobicContact CD1-CG 4.06Å; Y123-W158 HydrophobicContact CD1-CH2 4.36Å; Y123-W158 HydrophobicContact CD1-CZ2 4.11Å; Y123-W158 HydrophobicContact CD1-CZ3 4.25Å; Y123-W158 HydrophobicContact CD2-CB 4.45Å; Y123-W158 HydrophobicContact CD2-CD2 4.09Å; Y123-W158 AromaticContact CD2-CE3 3.79Å; Y123-W158 HydrophobicContact CD2-CE3 3.79Å; Y123-W158 HydrophobicContact CD2-CG 4.4Å; Y123-W158 HydrophobicContact CD2-CZ3 4.42Å; Y123-W158 HydrophobicContact CE1-CB 4.16Å; Y123-W158 AromaticContact CE1-CD1 3.7Å; Y123-W158 AromaticContact CE1-CD2 3.66Å; Y123-W158 HydrophobicContact CE1-CD2 3.66Å; Y123-W158 AromaticContact CE1-CE2 3.87Å; Y123-W158 HydrophobicContact CE1-CE3 4.3Å; Y123-W158 AromaticContact CE1-CG 3.57Å; Y123-W158 HydrophobicContact CE1-CG 3.57Å; Y123-W158 AromaticContact CE1-NE1 3.85Å; Y123-W158 HydrophobicContact CE2-CB 3.74Å; Y123-W158 HydrophobicContact CE2-CD2 4.14Å; Y123-W158 HydrophobicContact CE2-CE3 4.22Å; Y123-W158 AromaticContact CE2-CG 3.96Å; Y123-W158 HydrophobicContact CE2-CG 3.96Å; Y123-W158 AromaticContact CG-CD2 3.83Å; Y123-W158 HydrophobicContact CG-CD2 3.83Å; Y123-W158 AromaticContact CG-CE3 3.6Å; Y123-W158 HydrophobicContact CG-CE3 3.6Å; Y123-W158 HydrophobicContact CG-CG 4.45Å; Y123-W158 HydrophobicContact CG-CH2 4.38Å; Y123-W158 AromaticContact CG-CZ3 3.9Å; Y123-W158 HydrophobicContact CG-CZ3 3.9Å; Y123-W158 AromaticContact CZ-CD1 3.96Å; Y123-W158 AromaticContact CZ-CD2 3.92Å; Y123-W158 AromaticContact CZ-CG 3.51Å; Y123-W158 WeakPolarHBondContact OH-CA 3.35Å; Y123-K159 VanDerWaalsContact CE2-O 3.29Å; Y123-K159 WeakPolarHBondContact CE2-O 3.23Å; Y123-K159 PolarHBondContact OH-N 2.88Å; Y123-K159 VanDerWaalsContact OH-N 3.1Å; Y123-K159 PolarHBondContact OH-O 3.34Å; Y123-I161 HydrophobicContact CD2-CB 4.4Å; Y123-I161 HydrophobicContact CD2-CD1 4.46Å; Y123-I161 HydrophobicContact CE2-CB 4.41Å; Y123-I161 HydrophobicContact CE2-CG2 4.28Å
124	A	93.8	Very high	94.1	Very high	31 Å²	31	48.5 Å²	48.5	26%	0.256	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-35.3	-179.5	0	0	0	0	0	113.1	Q120 R121 C122 R128	Q120-A124 VanDerWaalsContact O-CB 3.3Å; Q120-A124 WeakPolarHBondContact O-CB 3.48Å; Q120-A124 PolarHBondContact O-N 2.78Å; R121-A124 PolarHBondContact O-N 2.88Å; C122-A124 PolarHBondContact O-N 2.76Å; A124-R128 WeakPolarHBondContact O-CD 3.3Å; A124-R128 WeakPolarHBondContact O-CG 3.44Å
125	E	93.6	Very high	94.2	Very high	38 Å²	38	44.5 Å²	44.5	18%	0.178	20%	0.201	C	C	.	.	H	α-helix	trans	-79.4	-35.8	177.5	-62.8	-58.6	106.9	0	0	112	R121 C122 Y123 R127 R128 A129 E247 L250	R121-E125 VanDerWaalsContact CZ-CG 3.43Å; R121-E125 IonicContact CZ-OE1 2.71Å; R121-E125 IonicContact CZ-OE2 2.76Å; R121-E125 IonicContact NH1-OE1 3.98Å; R121-E125 PolarHBondContact NH1-OE1 2.61Å; R121-E125 IonicContact NH1-OE2 2.7Å; R121-E125 PolarHBondContact NH1-OE2 3.25Å; R121-E125 IonicContact NH2-OE1 3.44Å; R121-E125 IonicContact NH2-OE2 3.85Å; R121-E125 PolarHBondContact NH2-OE2 3.1Å; R121-E125 WeakPolarHBondContact O-CG 3.41Å; R121-E125 PolarHBondContact O-N 2.97Å; C122-E125 PolarHBondContact O-N 3.49Å; Y123-E125 VanDerWaalsContact C-N 3.32Å; Y123-E125 PolarHBondContact O-N 3.44Å; E125-R127 VanDerWaalsContact C-N 3.31Å; E125-R127 PolarHBondContact O-N 3.32Å; E125-R128 CarbonylContact O-C 3.59Å; E125-R128 WeakPolarHBondContact O-CA 3.46Å; E125-R128 PolarHBondContact O-N 2.97Å; E125-R128 IonicContact OE1-CZ 2.75Å; E125-R128 IonicContact OE1-NH1 3.7Å; E125-R128 PolarHBondContact OE1-NH1 3.08Å; E125-A129 PolarHBondContact O-N 3.21Å; E125-E247 HydrophobicContact CB-CG 4.36Å; E125-E247 HydrophobicContact CG-CG 4.17Å; E125-L250 HydrophobicContact CB-CD1 4.25Å
126	N	94.8	Very high	94.2	Very high	4 Å²	4	46.6 Å²	46.6	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-58.1	-43.8	174.4	-163.7	36.5	0	0	0	111.8	C122 Y123 R128 A129 P132 V133 F246	C122-N126 WeakPolarHBondContact O-CB 3.29Å; C122-N126 PolarHBondContact O-N 2.89Å; Y123-N126 PolarHBondContact O-N 3.39Å; N126-R128 PolarHBondContact O-N 2.96Å; N126-R128 VanDerWaalsContact O-N 3.13Å; N126-A129 WeakPolarHBondContact O-CB 3.46Å; N126-A129 PolarHBondContact O-N 3.45Å; N126-P132 WeakPolarHBondContact OD1-CA 3.37Å; N126-V133 PolarHBondContact ND2-O 3.06Å; N126-V133 WeakPolarHBondContact OD1-CG2 3.5Å; N126-V133 PolarHBondContact OD1-N 3.02Å; N126-F246 HydrophobicContact CB-CE1 3.96Å; N126-F246 HydrophobicContact CB-CZ 4.19Å
127	R	91.7	Very high	94.2	Very high	165 Å²	165	46.5 Å²	46.5	62%	0.623	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-12	176.6	-68.6	-148.5	-51.3	158.4	6.2	114.7	Y123 E125	Y123-R127 HydrophobicContact CE2-CG 4.16Å; Y123-R127 PolarHBondContact O-N 3.32Å; E125-R127 VanDerWaalsContact C-N 3.31Å; E125-R127 PolarHBondContact O-N 3.32Å
128	R	90	Very high	94.3	Very high	144 Å²	144	39.8 Å²	39.8	54%	0.543	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.2	-4.9	179	-67.3	172.3	180	160.2	1.7	112.2	A124 E125 N126	A124-R128 WeakPolarHBondContact O-CD 3.3Å; A124-R128 WeakPolarHBondContact O-CG 3.44Å; E125-R128 CarbonylContact O-C 3.59Å; E125-R128 WeakPolarHBondContact O-CA 3.46Å; E125-R128 PolarHBondContact O-N 2.97Å; E125-R128 IonicContact OE1-CZ 2.75Å; E125-R128 IonicContact OE1-NH1 3.7Å; E125-R128 PolarHBondContact OE1-NH1 3.08Å; N126-R128 PolarHBondContact O-N 2.96Å; N126-R128 VanDerWaalsContact O-N 3.13Å
129	A	90.5	Very high	94.3	Very high	15 Å²	15	39.2 Å²	39.2	12%	0.124	18%	0.179	C	C	.	.			trans	-71.3	146.9	-177.1	0	0	0	0	0	110.4	E125 N126 H131 P132 L250	E125-A129 PolarHBondContact O-N 3.21Å; N126-A129 WeakPolarHBondContact O-CB 3.46Å; N126-A129 PolarHBondContact O-N 3.45Å; A129-H131 PolarHBondContact O-N 3.14Å; A129-P132 WeakPolarHBondContact O-CD 3.43Å; A129-L250 HydrophobicContact CB-CD1 4.17Å; A129-L250 HydrophobicContact CB-CD2 3.97Å; A129-L250 HydrophobicContact CB-CG 4.48Å
130	S	90.3	Very high	94.1	Very high	22 Å²	22	39.9 Å²	39.9	15%	0.154	18%	0.182	C	C	.	.	S	Bend	trans	-62.6	-36.9	171.2	-57.3	0	0	0	0	110.9	A90 T91 E254	A90-S130 WeakPolarHBondContact CA-O 3.5Å; T91-S130 PolarHBondContact N-O 2.84Å; T91-S130 VanDerWaalsContact N-O 3.15Å; S130-E254 PolarHBondContact OG-OE1 3.45Å
131	H	92.2	Very high	93.9	Very high	61 Å²	61	38.8 Å²	38.8	28%	0.282	19%	0.185	S	C	.	.	S	Bend	trans	-122.4	84	173.3	-54.8	-61.2	0	0	0	111.3	T91 A129 V133 L253	T91-H131 WeakPolarHBondContact O-CA 3.42Å; T91-H131 PolarHBondContact O-ND1 3.47Å; T91-H131 PolarHBondContact OG1-CE1 3.32Å; T91-H131 PolarHBondContact OG1-ND1 3.03Å; A129-H131 PolarHBondContact O-N 3.14Å; H131-V133 PolarHBondContact O-N 3Å; H131-L253 HydrophobicContact CB-CB 4.29Å; H131-L253 PolarHBondContact CD2-O 3.46Å; H131-L253 VanDerWaalsContact CD2-O 3.24Å
132	P	93.8	Very high	93.8	Very high	29 Å²	29	36.5 Å²	36.5	19%	0.188	19%	0.19	C	C	.	.			trans	-59.4	135.3	176.2	-22.8	33.5	0	0	0	111.2	A90 S93 N126 A129	A90-P132 HydrophobicContact CB-CG 4.16Å; S93-P132 PolarHBondContact N-O 3.4Å; N126-P132 WeakPolarHBondContact OD1-CA 3.37Å; A129-P132 WeakPolarHBondContact O-CD 3.43Å
133	V	95.3	Very high	93.7	Very high	4 Å²	4	39.2 Å²	39.2	2%	0.024	20%	0.203	C	C	.	.			trans	-92.3	158.7	176.6	-61.9	0	0	0	0	111	L95 L97 N126 H131 F135 F246 L250 L253	L95-V133 HydrophobicContact CB-CG1 4.43Å; L95-V133 HydrophobicContact CD2-CB 4.39Å; L95-V133 HydrophobicContact CD2-CG1 3.94Å; L97-V133 HydrophobicContact CB-CB 4.41Å; L97-V133 HydrophobicContact CB-CG2 3.83Å; L97-V133 HydrophobicContact CD2-CG2 4.14Å; N126-V133 PolarHBondContact ND2-O 3.06Å; N126-V133 WeakPolarHBondContact OD1-CG2 3.5Å; N126-V133 PolarHBondContact OD1-N 3.02Å; H131-V133 PolarHBondContact O-N 3Å; V133-F135 PolarHBondContact O-N 2.9Å; V133-F246 HydrophobicContact CG2-CZ 3.97Å; V133-L250 HydrophobicContact CG1-CD2 3.93Å; V133-L250 HydrophobicContact CG2-CD2 4.09Å; V133-L253 HydrophobicContact CG1-CD1 3.39Å
134	Q	95.2	Very high	93.6	Very high	82 Å²	82	38.3 Å²	38.3	38%	0.383	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	97.3	169.8	-54.6	-61.1	-39.3	0	0	108.2	S93 L95 R96 L97 Y136	S93-Q134 PolarHBondContact O-NE2 3.24Å; L95-Q134 PolarHBondContact O-N 2.66Å; R96-Q134 HydrophobicContact CG-CB 3.95Å; R96-Q134 HydrophobicContact CG-CG 4.43Å; L97-Q134 PolarHBondContact N-O 2.89Å; Q134-Y136 HydrophobicContact CB-CE2 3.85Å; Q134-Y136 VanDerWaalsContact O-CD2 3.3Å; Q134-Y136 WeakPolarHBondContact O-CD2 3.41Å
135	F	96.6	Very high	93.6	Very high	1 Å²	1	40.8 Å²	40.8	0%	0.004	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	123	-173.9	-177.2	-161.4	0	0	0	111	V99 C122 V133 I161 T162 F246	V99-F135 HydrophobicContact CB-CE2 4.33Å; V99-F135 HydrophobicContact CG2-CE2 3.71Å; V99-F135 HydrophobicContact CG2-CZ 4.25Å; C122-F135 HydrophobicContact CB-CE1 4.05Å; C122-F135 HydrophobicContact CB-CZ 4.03Å; V133-F135 PolarHBondContact O-N 2.9Å; F135-I161 HydrophobicContact CB-CG1 4.39Å; F135-I161 HydrophobicContact CD1-CD1 3.62Å; F135-I161 HydrophobicContact CD1-CG1 3.86Å; F135-I161 HydrophobicContact CE1-CD1 3.58Å; F135-I161 HydrophobicContact CE1-CG1 4.32Å; F135-I161 HydrophobicContact CG-CD1 4.25Å; F135-I161 HydrophobicContact CG-CG1 4.1Å; F135-I161 HydrophobicContact CZ-CD1 4.16Å; F135-I161 WeakPolarHBondContact O-CA 3.36Å; F135-T162 PolarHBondContact O-N 2.88Å; F135-F246 HydrophobicContact CB-CZ 4.33Å; F135-F246 HydrophobicContact CD1-CE2 4.3Å; F135-F246 HydrophobicContact CD1-CZ 4.06Å; F135-F246 AromaticContact CD2-CE2 3.53Å; F135-F246 HydrophobicContact CD2-CE2 3.53Å; F135-F246 AromaticContact CD2-CZ 3.99Å; F135-F246 HydrophobicContact CD2-CZ 3.99Å; F135-F246 HydrophobicContact CE1-CE2 4.37Å; F135-F246 HydrophobicContact CE1-CZ 4.38Å; F135-F246 HydrophobicContact CE2-CD2 4.43Å; F135-F246 AromaticContact CE2-CE2 3.66Å; F135-F246 HydrophobicContact CE2-CE2 3.66Å; F135-F246 HydrophobicContact CE2-CZ 4.37Å; F135-F246 AromaticContact CG-CE2 3.91Å; F135-F246 HydrophobicContact CG-CE2 3.91Å; F135-F246 AromaticContact CG-CZ 3.87Å; F135-F246 HydrophobicContact CG-CZ 3.87Å; F135-F246 HydrophobicContact CZ-CE2 4.08Å
136	Y	96.7	Very high	93.6	Very high	44 Å²	44	44.6 Å²	44.6	17%	0.173	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	142.4	175.6	-69.7	-103.3	0	0	0	111.4	R96 L97 L98 V99 Q134 T162 V171	R96-Y136 HydrophobicContact CB-CD2 4.46Å; R96-Y136 HydrophobicContact CB-CE2 4.24Å; R96-Y136 HydrophobicContact CG-CE2 3.93Å; L97-Y136 PolarHBondContact O-N 2.82Å; L98-Y136 CarbonylContact C-O 3.6Å; L98-Y136 WeakPolarHBondContact CA-O 3.42Å; L98-Y136 HydrophobicContact CG-CG 4.3Å; V99-Y136 PolarHBondContact N-O 2.94Å; Q134-Y136 HydrophobicContact CB-CE2 3.85Å; Q134-Y136 VanDerWaalsContact O-CD2 3.3Å; Q134-Y136 WeakPolarHBondContact O-CD2 3.41Å; Y136-T162 CarbonylContact C-O 3.59Å; Y136-T162 VanDerWaalsContact CA-O 3.3Å; Y136-T162 WeakPolarHBondContact CA-O 3.39Å; Y136-T162 VanDerWaalsContact CD1-CB 3.48Å; Y136-T162 HydrophobicContact CD1-CG2 3.58Å; Y136-T162 HydrophobicContact CE1-CG2 3.47Å; Y136-T162 VanDerWaalsContact CE1-CG2 3.47Å; Y136-V171 HydrophobicContact CD1-CG1 4.16Å; Y136-V171 HydrophobicContact CE1-CG1 4.19Å
137	L	96.3	Very high	93.5	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	116.4	169	-165	143.4	0	0	0	107.7	I119 L140 T162 I163 K164	I119-L137 HydrophobicContact CB-CD1 4.43Å; I119-L137 HydrophobicContact CD1-CD1 3.83Å; I119-L137 HydrophobicContact CG1-CD1 4.02Å; I119-L137 HydrophobicContact CG2-CD1 3.52Å; L137-L140 HydrophobicContact CD2-CB 3.62Å; L137-L140 HydrophobicContact CD2-CD1 3.73Å; L137-L140 HydrophobicContact CD2-CD2 4.05Å; L137-L140 HydrophobicContact CD2-CG 3.96Å; L137-T162 PolarHBondContact N-O 3.42Å; L137-I163 HydrophobicContact CB-CG1 4.46Å; L137-I163 HydrophobicContact CD2-CG2 4.32Å; L137-K164 PolarHBondContact O-N 3Å
138	T	96.4	Very high	93.5	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	159.7	-170.1	57	0	0	0	0	110.8	L98 V99 C101 L140 K164 V171	L98-T138 HydrophobicContact CD2-CG2 4.09Å; V99-T138 PolarHBondContact O-N 3.43Å; V99-T138 PolarHBondContact O-OG1 3.35Å; C101-T138 VanDerWaalsContact CB-O 3.3Å; C101-T138 WeakPolarHBondContact CB-O 3.44Å; C101-T138 PolarHBondContact N-O 3.09Å; T138-L140 PolarHBondContact O-N 2.91Å; T138-K164 CarbonylContact C-O 3.57Å; T138-V171 HydrophobicContact CG2-CG2 4.43Å
139	S	95.5	Very high	93.6	Very high	19 Å²	19	32.5 Å²	32.5	13%	0.133	18%	0.181	C	C	.	.	S	Bend	trans	56.1	32.7	-176.7	-46.1	0	0	0	0	112.5	D100 G141 K164 A165 E166 H167	D100-S139 PolarHBondContact OD1-OG 3.12Å; S139-G141 PolarHBondContact O-N 3.2Å; S139-K164 PolarHBondContact N-O 3.5Å; S139-A165 WeakPolarHBondContact CA-O 3.46Å; S139-E166 PolarHBondContact N-O 3.36Å; S139-H167 PolarHBondContact OG-CD2 3.49Å
140	L	92.6	Very high	93.6	Very high	14 Å²	14	38.1 Å²	38.1	7%	0.073	20%	0.204	C	C	.	.			trans	-71.5	114.3	-179.4	-177.2	62.8	0	0	0	110.5	L137 T138 L144 K145 M148 W155 I163 K164	L137-L140 HydrophobicContact CD2-CB 3.62Å; L137-L140 HydrophobicContact CD2-CD1 3.73Å; L137-L140 HydrophobicContact CD2-CD2 4.05Å; L137-L140 HydrophobicContact CD2-CG 3.96Å; T138-L140 PolarHBondContact O-N 2.91Å; L140-L144 HydrophobicContact CD1-CB 4.46Å; L140-L144 HydrophobicContact CD1-CD2 3.86Å; L140-L144 HydrophobicContact CD1-CG 3.96Å; L140-K145 HydrophobicContact CD1-CB 4.19Å; L140-K145 HydrophobicContact CG-CB 4.2Å; L140-K145 HydrophobicContact CG-CG 4.47Å; L140-M148 HydrophobicContact CD1-SD 3.93Å; L140-M148 HydrophobicContact CD2-SD 4.47Å; L140-W155 HydrophobicContact CD2-CH2 4.18Å; L140-W155 HydrophobicContact CD2-CZ3 4.22Å; L140-I163 HydrophobicContact CB-CG2 4.33Å; L140-I163 HydrophobicContact CD2-CG2 3.37Å; L140-I163 HydrophobicContact CG-CG2 4.47Å; L140-K164 PolarHBondContact N-O 2.97Å; L140-K164 VanDerWaalsContact N-O 3.14Å
141	G	91.4	Very high	93.4	Very high	28 Å²	28	41.7 Å²	41.7	29%	0.289	22%	0.217	S	C	.	.			trans	-161.5	-162.7	175.3	0	0	0	0	0	112.6	S139 L144 K145	S139-G141 PolarHBondContact O-N 3.2Å; G141-L144 PolarHBondContact O-N 3.14Å; G141-K145 PolarHBondContact O-N 2.82Å; G141-K145 VanDerWaalsContact O-N 3.12Å
142	G	92.7	Very high	92.9	Very high	45 Å²	45	41 Å²	41	46%	0.464	22%	0.216	S	C	.	.	H	α-helix	trans	56	-139.8	167.3	0	0	0	0	0	115.3	Q146	G142-Q146 WeakPolarHBondContact O-CG 3.49Å; G142-Q146 PolarHBondContact O-N 2.89Å
143	Q	93.6	Very high	92.4	Very high	57 Å²	57	47.8 Å²	47.8	27%	0.266	24%	0.242	S	C	.	.	H	α-helix	trans	-68.2	-34	-177.4	-59.7	174.4	87.1	0	0	111.9	D104 M107 I109 V112 Q146 S147	D104-Q143 PolarHBondContact O-NE2 3.34Å; D104-Q143 PolarHBondContact OD1-N 3.46Å; D104-Q143 WeakPolarHBondContact OD2-CB 3.49Å; D104-Q143 WeakPolarHBondContact OD2-CG 3.35Å; D104-Q143 PolarHBondContact OD2-N 2.9Å; D104-Q143 PolarHBondContact OD2-NE2 2.81Å; M107-Q143 PolarHBondContact O-NE2 3.4Å; I109-Q143 HydrophobicContact CD1-CB 4.16Å; V112-Q143 HydrophobicContact CG1-CB 4.15Å; V112-Q143 HydrophobicContact CG2-CB 4.12Å; Q143-Q146 PolarHBondContact O-N 3.01Å; Q143-S147 WeakPolarHBondContact O-CB 3.31Å; Q143-S147 PolarHBondContact O-N 2.78Å
144	L	93.5	Very high	91.9	Very high	2 Å²	2	49.4 Å²	49.4	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-49.5	178.4	-179	62.4	0	0	0	111.6	C101 D104 V112 L115 H116 I119 L140 G141 Q146 S147 M148	C101-L144 HydrophobicContact CB-CD2 3.75Å; C101-L144 WeakPolarHBondContact SG-CD2 3.4Å; D104-L144 WeakPolarHBondContact OD1-CB 3.31Å; D104-L144 PolarHBondContact OD1-N 3.44Å; V112-L144 VanDerWaalsContact CG1-CA 3.48Å; V112-L144 HydrophobicContact CG1-CB 4.03Å; V112-L144 HydrophobicContact CG1-CD1 4.08Å; L115-L144 HydrophobicContact CD2-CD1 4.32Å; L115-L144 HydrophobicContact CD2-CD2 4.07Å; L115-L144 HydrophobicContact CG-CD1 4.42Å; H116-L144 HydrophobicContact CB-CD1 4.03Å; I119-L144 HydrophobicContact CD1-CD1 4.13Å; I119-L144 HydrophobicContact CD1-CD2 3.93Å; L140-L144 HydrophobicContact CD1-CB 4.46Å; L140-L144 HydrophobicContact CD1-CD2 3.86Å; L140-L144 HydrophobicContact CD1-CG 3.96Å; G141-L144 PolarHBondContact O-N 3.14Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; L144-Q146 PolarHBondContact O-N 3.49Å; L144-S147 PolarHBondContact O-N 2.96Å; L144-S147 VanDerWaalsContact O-N 3.14Å; L144-M148 HydrophobicContact CG-SD 4.34Å; L144-M148 WeakPolarHBondContact O-CG 3.48Å; L144-M148 PolarHBondContact O-N 3.29Å
145	K	93.4	Very high	91.4	Very high	83 Å²	83	46.9 Å²	46.9	36%	0.361	25%	0.247	S	C	.	.	H	α-helix	trans	-59.2	-45.7	177.8	-174.2	-178.8	178.8	-63.7	0	111.2	L140 G141 S147 M148 D149	L140-K145 HydrophobicContact CD1-CB 4.19Å; L140-K145 HydrophobicContact CG-CB 4.2Å; L140-K145 HydrophobicContact CG-CG 4.47Å; G141-K145 PolarHBondContact O-N 2.82Å; G141-K145 VanDerWaalsContact O-N 3.12Å; K145-S147 VanDerWaalsContact C-N 3.32Å; K145-S147 PolarHBondContact O-N 3.29Å; K145-M148 WeakPolarHBondContact O-CB 3.33Å; K145-M148 PolarHBondContact O-N 3.19Å; K145-M148 VanDerWaalsContact O-N 3.1Å; K145-D149 IonicContact NZ-OD2 2.9Å; K145-D149 PolarHBondContact NZ-OD2 2.98Å; K145-D149 PolarHBondContact O-N 2.86Å
146	Q	93.3	Very high	90.9	Very high	117 Å²	117	51.7 Å²	51.7	55%	0.547	28%	0.276	S	S	.	.	H	α-helix	trans	-58.7	-44.3	175.7	-67.4	171.7	16.6	0	0	111.5	G142 Q143 L144 M148 D149 E150	G142-Q146 WeakPolarHBondContact O-CG 3.49Å; G142-Q146 PolarHBondContact O-N 2.89Å; Q143-Q146 PolarHBondContact O-N 3.01Å; L144-Q146 VanDerWaalsContact C-N 3.33Å; L144-Q146 PolarHBondContact O-N 3.49Å; Q146-M148 VanDerWaalsContact C-N 3.27Å; Q146-M148 PolarHBondContact O-N 2.86Å; Q146-D149 PolarHBondContact O-N 2.96Å; Q146-E150 WeakPolarHBondContact O-CG 3.44Å; Q146-E150 PolarHBondContact O-N 2.87Å
147	S	92.9	Very high	90.5	Very high	2 Å²	2	55.7 Å²	55.7	1%	0.014	30%	0.3	C	S	.	.	H	α-helix	trans	-65.6	-28.5	177.5	-175	0	0	0	0	113.3	H116 Q143 L144 K145 K151	H116-S147 PolarHBondContact CE1-O 3.11Å; H116-S147 PolarHBondContact ND1-O 3.35Å; Q143-S147 WeakPolarHBondContact O-CB 3.31Å; Q143-S147 PolarHBondContact O-N 2.78Å; L144-S147 PolarHBondContact O-N 2.96Å; L144-S147 VanDerWaalsContact O-N 3.14Å; K145-S147 VanDerWaalsContact C-N 3.32Å; K145-S147 PolarHBondContact O-N 3.29Å; S147-K151 WeakPolarHBondContact O-CB 3.49Å; S147-K151 PolarHBondContact O-N 2.91Å
148	M	90.9	Very high	90.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-73.9	-46.3	174	-70.1	179	68.4	0	0	110.8	L140 L144 K145 Q146 E150 D152 W155	L140-M148 HydrophobicContact CD1-SD 3.93Å; L140-M148 HydrophobicContact CD2-SD 4.47Å; L144-M148 HydrophobicContact CG-SD 4.34Å; L144-M148 WeakPolarHBondContact O-CG 3.48Å; L144-M148 PolarHBondContact O-N 3.29Å; K145-M148 WeakPolarHBondContact O-CB 3.33Å; K145-M148 PolarHBondContact O-N 3.19Å; K145-M148 VanDerWaalsContact O-N 3.1Å; Q146-M148 VanDerWaalsContact C-N 3.27Å; Q146-M148 PolarHBondContact O-N 2.86Å; M148-E150 PolarHBondContact O-N 2.93Å; M148-D152 CarbonylContact O-C 3.59Å; M148-D152 VanDerWaalsContact O-C 3.28Å; M148-D152 WeakPolarHBondContact O-CA 3.48Å; M148-D152 PolarHBondContact O-N 3.47Å; M148-W155 HydrophobicContact CB-CG 4.25Å; M148-W155 HydrophobicContact CE-CB 3.88Å; M148-W155 HydrophobicContact CE-CD2 3.97Å; M148-W155 HydrophobicContact CE-CE3 4.08Å; M148-W155 HydrophobicContact CE-CG 3.91Å
149	D	91.7	Very high	89.8	Confident	58 Å²	58	65 Å²	65	31%	0.31	34%	0.339	S	S	.	.	H	α-helix	trans	-60.2	-41.1	178.7	-72.1	-27.5	0	0	0	112.6	K145 Q146 K153 W155	K145-D149 IonicContact NZ-OD2 2.9Å; K145-D149 PolarHBondContact NZ-OD2 2.98Å; K145-D149 PolarHBondContact O-N 2.86Å; Q146-D149 PolarHBondContact O-N 2.96Å; D149-K153 WeakPolarHBondContact O-CG 3.41Å; D149-W155 VanDerWaalsContact OD1-CE2 3.3Å; D149-W155 VanDerWaalsContact OD1-CZ2 3.28Å; D149-W155 WeakPolarHBondContact OD1-CZ2 3.5Å; D149-W155 PolarHBondContact OD1-NE1 3.34Å
150	E	90.5	Very high	89.4	Confident	132 Å²	132	70.2 Å²	70.2	62%	0.617	37%	0.366	S	S	*	.	H	α-helix	trans	-70.9	-45.8	-179.1	-74.3	177.2	179.4	0	0	113.3	Q146 M148	Q146-E150 WeakPolarHBondContact O-CG 3.44Å; Q146-E150 PolarHBondContact O-N 2.87Å; M148-E150 PolarHBondContact O-N 2.93Å
151	K	86.6	Confident	89.4	Confident	97 Å²	97	70.6 Å²	70.6	42%	0.422	37%	0.368	S	S	.	.	H	α-helix	trans	-94.6	-31.6	-168.4	-66.3	-172.6	178.9	-177.6	0	113.4	S147	S147-K151 WeakPolarHBondContact O-CB 3.49Å; S147-K151 PolarHBondContact O-N 2.91Å
152	D	82.8	Confident	89.6	Confident	48 Å²	48	71.4 Å²	71.4	26%	0.257	37%	0.367	S	S	.	.			trans	-136.1	57.5	-166.3	-74.4	-72.6	0	0	0	110.7	H116 Q120 M148 G154 W155	H116-D152 IonicContact CE1-OD2 3.68Å; H116-D152 PolarHBondContact CE1-OD2 3.45Å; H116-D152 IonicContact ND1-OD2 2.61Å; H116-D152 IonicContact NE2-OD2 3.15Å; H116-D152 PolarHBondContact NE2-OD2 3.15Å; H116-D152 VanDerWaalsContact NE2-OD2 3.17Å; Q120-D152 PolarHBondContact NE2-OD1 2.85Å; Q120-D152 PolarHBondContact NE2-OD2 2.85Å; M148-D152 CarbonylContact O-C 3.59Å; M148-D152 VanDerWaalsContact O-C 3.28Å; M148-D152 WeakPolarHBondContact O-CA 3.48Å; M148-D152 PolarHBondContact O-N 3.47Å; D152-G154 PolarHBondContact O-N 3.44Å; D152-W155 WeakPolarHBondContact O-CB 3.43Å; D152-W155 PolarHBondContact O-N 2.85Å
153	K	82.9	Confident	89.7	Confident	171 Å²	171	71.5 Å²	71.5	74%	0.743	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-47.8	-20.1	177.1	-63.2	-177.2	-179.9	-173.7	0	115	D149 W155	D149-K153 WeakPolarHBondContact O-CG 3.41Å; K153-W155 VanDerWaalsContact C-N 3.34Å
154	G	84	Confident	89.7	Confident	37 Å²	37	72.7 Å²	72.7	38%	0.381	36%	0.361	S	S	.	.	G	3₁₀ helix	trans	-81.6	0.5	174.5	0	0	0	0	0	115.7	D152 V156 N157 W158	D152-G154 PolarHBondContact O-N 3.44Å; G154-V156 PolarHBondContact O-N 2.99Å; G154-N157 PolarHBondContact O-N 3.18Å; G154-W158 VanDerWaalsContact O-CD1 3.28Å
155	W	85.2	Confident	89.7	Confident	30 Å²	30	76.2 Å²	76.2	11%	0.114	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-62	-30.7	178.2	74.8	-102.2	0	0	0	112.2	L140 M148 D149 D152 K153 N157 W158 I163	L140-W155 HydrophobicContact CD2-CH2 4.18Å; L140-W155 HydrophobicContact CD2-CZ3 4.22Å; M148-W155 HydrophobicContact CB-CG 4.25Å; M148-W155 HydrophobicContact CE-CB 3.88Å; M148-W155 HydrophobicContact CE-CD2 3.97Å; M148-W155 HydrophobicContact CE-CE3 4.08Å; M148-W155 HydrophobicContact CE-CG 3.91Å; D149-W155 VanDerWaalsContact OD1-CE2 3.3Å; D149-W155 VanDerWaalsContact OD1-CZ2 3.28Å; D149-W155 WeakPolarHBondContact OD1-CZ2 3.5Å; D149-W155 PolarHBondContact OD1-NE1 3.34Å; D152-W155 WeakPolarHBondContact O-CB 3.43Å; D152-W155 PolarHBondContact O-N 2.85Å; K153-W155 VanDerWaalsContact C-N 3.34Å; W155-N157 PolarHBondContact O-N 3.11Å; W155-W158 HydrophobicContact CB-CD2 4.46Å; W155-W158 HydrophobicContact CB-CZ2 4.37Å; W155-W158 WeakPolarHBondContact O-CB 3.41Å; W155-W158 PolarHBondContact O-N 3.18Å; W155-W158 VanDerWaalsContact O-N 3.15Å; W155-I163 HydrophobicContact CE3-CD1 3.52Å; W155-I163 HydrophobicContact CZ3-CD1 3.63Å; W155-I163 HydrophobicContact CZ3-CG2 4.08Å
156	V	86.5	Confident	89.9	Confident	101 Å²	101	76.4 Å²	76.4	61%	0.612	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-62.6	-26.7	174.1	-174.5	0	0	0	0	112.2	G154 W158	G154-V156 PolarHBondContact O-N 2.99Å; V156-W158 VanDerWaalsContact C-N 3.34Å
157	N	88.6	Confident	90	Very high	129 Å²	129	73.1 Å²	73.1	69%	0.69	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-94.1	9.6	-179.3	-61.4	-28.3	0	0	0	112.7	G154 W155 K159	G154-N157 PolarHBondContact O-N 3.18Å; W155-N157 PolarHBondContact O-N 3.11Å; N157-K159 PolarHBondContact O-N 3.46Å
158	W	89.4	Confident	90.1	Very high	45 Å²	45	73 Å²	73	17%	0.17	38%	0.376	C	S	.	.			trans	-67.6	131.1	175.5	-72.1	7.8	0	0	0	109.8	I119 Q120 Y123 G154 W155 V156 I161	I119-W158 HydrophobicContact CG2-CH2 4.3Å; I119-W158 HydrophobicContact CG2-CZ3 4.03Å; Q120-W158 HydrophobicContact CB-CH2 4.47Å; Q120-W158 HydrophobicContact CG-CH2 3.95Å; Q120-W158 HydrophobicContact CG-CZ2 4.12Å; Y123-W158 AromaticContact CD1-CD2 3.62Å; Y123-W158 HydrophobicContact CD1-CD2 3.62Å; Y123-W158 AromaticContact CD1-CE2 3.72Å; Y123-W158 AromaticContact CD1-CE3 3.88Å; Y123-W158 HydrophobicContact CD1-CE3 3.88Å; Y123-W158 HydrophobicContact CD1-CG 4.06Å; Y123-W158 HydrophobicContact CD1-CH2 4.36Å; Y123-W158 HydrophobicContact CD1-CZ2 4.11Å; Y123-W158 HydrophobicContact CD1-CZ3 4.25Å; Y123-W158 HydrophobicContact CD2-CB 4.45Å; Y123-W158 HydrophobicContact CD2-CD2 4.09Å; Y123-W158 AromaticContact CD2-CE3 3.79Å; Y123-W158 HydrophobicContact CD2-CE3 3.79Å; Y123-W158 HydrophobicContact CD2-CG 4.4Å; Y123-W158 HydrophobicContact CD2-CZ3 4.42Å; Y123-W158 HydrophobicContact CE1-CB 4.16Å; Y123-W158 AromaticContact CE1-CD1 3.7Å; Y123-W158 AromaticContact CE1-CD2 3.66Å; Y123-W158 HydrophobicContact CE1-CD2 3.66Å; Y123-W158 AromaticContact CE1-CE2 3.87Å; Y123-W158 HydrophobicContact CE1-CE3 4.3Å; Y123-W158 AromaticContact CE1-CG 3.57Å; Y123-W158 HydrophobicContact CE1-CG 3.57Å; Y123-W158 AromaticContact CE1-NE1 3.85Å; Y123-W158 HydrophobicContact CE2-CB 3.74Å; Y123-W158 HydrophobicContact CE2-CD2 4.14Å; Y123-W158 HydrophobicContact CE2-CE3 4.22Å; Y123-W158 AromaticContact CE2-CG 3.96Å; Y123-W158 HydrophobicContact CE2-CG 3.96Å; Y123-W158 AromaticContact CG-CD2 3.83Å; Y123-W158 HydrophobicContact CG-CD2 3.83Å; Y123-W158 AromaticContact CG-CE3 3.6Å; Y123-W158 HydrophobicContact CG-CE3 3.6Å; Y123-W158 HydrophobicContact CG-CG 4.45Å; Y123-W158 HydrophobicContact CG-CH2 4.38Å; Y123-W158 AromaticContact CG-CZ3 3.9Å; Y123-W158 HydrophobicContact CG-CZ3 3.9Å; Y123-W158 AromaticContact CZ-CD1 3.96Å; Y123-W158 AromaticContact CZ-CD2 3.92Å; Y123-W158 AromaticContact CZ-CG 3.51Å; Y123-W158 WeakPolarHBondContact OH-CA 3.35Å; G154-W158 VanDerWaalsContact O-CD1 3.28Å; W155-W158 HydrophobicContact CB-CD2 4.46Å; W155-W158 HydrophobicContact CB-CZ2 4.37Å; W155-W158 WeakPolarHBondContact O-CB 3.41Å; W155-W158 PolarHBondContact O-N 3.18Å; W155-W158 VanDerWaalsContact O-N 3.15Å; V156-W158 VanDerWaalsContact C-N 3.34Å; W158-I161 HydrophobicContact CB-CG2 3.49Å; W158-I161 VanDerWaalsContact CB-CG2 3.49Å; W158-I161 HydrophobicContact CE3-CD1 3.85Å; W158-I161 HydrophobicContact CE3-CG2 4.35Å; W158-I161 HydrophobicContact CZ3-CD1 4.2Å
159	K	87.9	Confident	90.2	Very high	149 Å²	149	75.9 Å²	75.9	65%	0.648	40%	0.396	S	S	*	.	S	Bend	trans	-98.3	153.5	178.6	-62	-172.2	178.1	-170.7	0	108.8	Y123 N157 I161	Y123-K159 VanDerWaalsContact CE2-O 3.29Å; Y123-K159 WeakPolarHBondContact CE2-O 3.23Å; Y123-K159 PolarHBondContact OH-N 2.88Å; Y123-K159 VanDerWaalsContact OH-N 3.1Å; Y123-K159 PolarHBondContact OH-O 3.34Å; N157-K159 PolarHBondContact O-N 3.46Å; K159-I161 PolarHBondContact O-N 3.46Å
160	D	87.1	Confident	90.3	Very high	129 Å²	129	80 Å²	80	69%	0.69	41%	0.413	S	S	*	.	S	Bend	trans	61.7	30.1	174.3	-39.6	-51.4	0	0	0	113
161	I	93.1	Very high	90.4	Very high	22 Å²	22	75.9 Å²	75.9	11%	0.113	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.5	135.5	170.8	-170.4	175.7	0	0	0	109.6	Y123 F135 W158 K159 I163	Y123-I161 HydrophobicContact CD2-CB 4.4Å; Y123-I161 HydrophobicContact CD2-CD1 4.46Å; Y123-I161 HydrophobicContact CE2-CB 4.41Å; Y123-I161 HydrophobicContact CE2-CG2 4.28Å; F135-I161 HydrophobicContact CB-CG1 4.39Å; F135-I161 HydrophobicContact CD1-CD1 3.62Å; F135-I161 HydrophobicContact CD1-CG1 3.86Å; F135-I161 HydrophobicContact CE1-CD1 3.58Å; F135-I161 HydrophobicContact CE1-CG1 4.32Å; F135-I161 HydrophobicContact CG-CD1 4.25Å; F135-I161 HydrophobicContact CG-CG1 4.1Å; F135-I161 HydrophobicContact CZ-CD1 4.16Å; F135-I161 WeakPolarHBondContact O-CA 3.36Å; W158-I161 HydrophobicContact CB-CG2 3.49Å; W158-I161 VanDerWaalsContact CB-CG2 3.49Å; W158-I161 HydrophobicContact CE3-CD1 3.85Å; W158-I161 HydrophobicContact CE3-CG2 4.35Å; W158-I161 HydrophobicContact CZ3-CD1 4.2Å; K159-I161 PolarHBondContact O-N 3.46Å; I161-I163 HydrophobicContact CD1-CD1 4.4Å; I161-I163 HydrophobicContact CD1-CG1 4.12Å; I161-I163 HydrophobicContact CG1-CG1 4.1Å; I161-I163 HydrophobicContact CG2-CD1 4.25Å; I161-I163 HydrophobicContact CG2-CG1 4.26Å
162	T	94.3	Very high	90.8	Very high	46 Å²	46	71.7 Å²	71.7	28%	0.282	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	107.3	176.2	-58.5	0	0	0	0	109.4	F135 Y136 L137 K164	F135-T162 PolarHBondContact O-N 2.88Å; Y136-T162 CarbonylContact C-O 3.59Å; Y136-T162 VanDerWaalsContact CA-O 3.3Å; Y136-T162 WeakPolarHBondContact CA-O 3.39Å; Y136-T162 VanDerWaalsContact CD1-CB 3.48Å; Y136-T162 HydrophobicContact CD1-CG2 3.58Å; Y136-T162 HydrophobicContact CE1-CG2 3.47Å; Y136-T162 VanDerWaalsContact CE1-CG2 3.47Å; L137-T162 PolarHBondContact N-O 3.42Å; T162-K164 HydrophobicContact CG2-CD 4.37Å; T162-K164 HydrophobicContact CG2-CG 3.98Å
163	I	94.4	Very high	91.4	Very high	47 Å²	47	72.2 Å²	72.2	24%	0.241	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	123.6	179.9	-56.1	175.4	0	0	0	108.6	L137 L140 W155 I161	L137-I163 HydrophobicContact CB-CG1 4.46Å; L137-I163 HydrophobicContact CD2-CG2 4.32Å; L140-I163 HydrophobicContact CB-CG2 4.33Å; L140-I163 HydrophobicContact CD2-CG2 3.37Å; L140-I163 HydrophobicContact CG-CG2 4.47Å; W155-I163 HydrophobicContact CE3-CD1 3.52Å; W155-I163 HydrophobicContact CZ3-CD1 3.63Å; W155-I163 HydrophobicContact CZ3-CG2 4.08Å; I161-I163 HydrophobicContact CD1-CD1 4.4Å; I161-I163 HydrophobicContact CD1-CG1 4.12Å; I161-I163 HydrophobicContact CG1-CG1 4.1Å; I161-I163 HydrophobicContact CG2-CD1 4.25Å; I161-I163 HydrophobicContact CG2-CG1 4.26Å
164	K	94.3	Very high	91.9	Very high	82 Å²	82	69.6 Å²	69.6	36%	0.357	38%	0.379	S	S	.	.			trans	-129.9	138.8	-175.4	-66.7	-63.4	-176.6	175.7	0	110.5	L137 T138 S139 L140 T162 E166 V171	L137-K164 PolarHBondContact O-N 3Å; T138-K164 CarbonylContact C-O 3.57Å; S139-K164 PolarHBondContact N-O 3.5Å; L140-K164 PolarHBondContact N-O 2.97Å; L140-K164 VanDerWaalsContact N-O 3.14Å; T162-K164 HydrophobicContact CG2-CD 4.37Å; T162-K164 HydrophobicContact CG2-CG 3.98Å; K164-E166 VanDerWaalsContact C-N 3.35Å; K164-E166 WeakPolarHBondContact CA-OE2 3.41Å; K164-E166 VanDerWaalsContact CB-OE2 3.29Å; K164-E166 WeakPolarHBondContact CB-OE2 3.49Å; K164-E166 WeakPolarHBondContact CD-OE2 3.29Å; K164-V171 HydrophobicContact CB-CG2 4.19Å; K164-V171 HydrophobicContact CG-CG1 4.49Å; K164-V171 HydrophobicContact CG-CG2 4.18Å
165	A	94.7	Very high	92.4	Very high	75 Å²	75	74.3 Å²	74.3	62%	0.62	40%	0.396	S	S	*	.	S	Bend	trans	-82.9	-24	173.7	0	0	0	0	0	110.9	S139	S139-A165 WeakPolarHBondContact CA-O 3.46Å
166	E	95.9	Very high	92.9	Very high	88 Å²	88	76.1 Å²	76.1	41%	0.411	41%	0.405	S	S	.	.	S	Bend	trans	-69.4	153.6	179.4	-54.2	86.8	165.2	0	0	111.6	S139 K164 E170 V171	S139-E166 PolarHBondContact N-O 3.36Å; K164-E166 VanDerWaalsContact C-N 3.35Å; K164-E166 WeakPolarHBondContact CA-OE2 3.41Å; K164-E166 VanDerWaalsContact CB-OE2 3.29Å; K164-E166 WeakPolarHBondContact CB-OE2 3.49Å; K164-E166 WeakPolarHBondContact CD-OE2 3.29Å; E166-E170 HydrophobicContact CB-CB 4.49Å; E166-V171 HydrophobicContact CB-CG2 4.19Å
167	H	95.4	Very high	93.4	Very high	47 Å²	47	71.4 Å²	71.4	22%	0.218	38%	0.377	C	S	.	.			trans	-70.2	148.4	176.9	-171.5	-107	0	0	0	110.7	S139 S169 E170 V171	S139-H167 PolarHBondContact OG-CD2 3.49Å; H167-S169 WeakPolarHBondContact ND1-CB 3.48Å; H167-S169 PolarHBondContact ND1-N 3.15Å; H167-S169 PolarHBondContact ND1-OG 2.92Å; H167-S169 PolarHBondContact O-N 3.38Å; H167-E170 PolarHBondContact O-N 2.94Å; H167-V171 PolarHBondContact O-N 2.99Å
168	Y	95.2	Very high	93.8	Very high	1 Å²	1	66.3 Å²	66.3	0%	0.004	35%	0.35	C	S	.	.	H	α-helix	trans	-59.3	-24.6	-176.1	59	-97.4	0	0	0	113.8	D100 E170 V171 V172 L177 Y179 V198 L219 I221	D100-Y168 HydrophobicContact CB-CD1 3.88Å; D100-Y168 HydrophobicContact CB-CE1 3.94Å; D100-Y168 VanDerWaalsContact CG-CE1 3.47Å; D100-Y168 WeakPolarHBondContact OD2-CE1 3.4Å; Y168-E170 PolarHBondContact O-N 3.13Å; Y168-V171 PolarHBondContact O-N 2.84Å; Y168-V172 PolarHBondContact O-N 3.46Å; Y168-V172 VanDerWaalsContact O-N 3.13Å; Y168-L177 HydrophobicContact CD2-CD1 3.93Å; Y168-L177 HydrophobicContact CD2-CD2 4.24Å; Y168-L177 HydrophobicContact CE2-CD1 4.39Å; Y168-Y179 HydrophobicContact CE1-CE2 4.27Å; Y168-V198 HydrophobicContact CD1-CG1 4.32Å; Y168-V198 HydrophobicContact CD2-CG2 4.32Å; Y168-V198 HydrophobicContact CE1-CG1 4.42Å; Y168-L219 HydrophobicContact CE2-CD1 4.25Å; Y168-L219 WeakPolarHBondContact OH-CD1 3.31Å; Y168-I221 HydrophobicContact CE2-CD1 3.99Å
169	S	93.9	Very high	94.2	Very high	60 Å²	60	64.2 Å²	64.2	42%	0.42	34%	0.342	S	S	.	.	H	α-helix	trans	-66.5	-22.5	175	60.6	0	0	0	0	114	H167	H167-S169 WeakPolarHBondContact ND1-CB 3.48Å; H167-S169 PolarHBondContact ND1-N 3.15Å; H167-S169 PolarHBondContact ND1-OG 2.92Å; H167-S169 PolarHBondContact O-N 3.38Å
170	E	93.9	Very high	94.7	Very high	143 Å²	143	57.8 Å²	57.8	67%	0.668	32%	0.315	S	S	*	.	H	α-helix	trans	-91.6	-22.5	177.7	-64	170.4	-144	0	0	111.6	E166 H167 Y168	E166-E170 HydrophobicContact CB-CB 4.49Å; H167-E170 PolarHBondContact O-N 2.94Å; Y168-E170 PolarHBondContact O-N 3.13Å
171	V	92.9	Very high	95.1	Very high	47 Å²	47	52.1 Å²	52.1	29%	0.285	29%	0.285	S	S	.	.	H	α-helix	trans	-88.4	-32.8	-176.2	-178.1	0	0	0	0	111.8	Y136 T138 K164 E166 H167 Y168	Y136-V171 HydrophobicContact CD1-CG1 4.16Å; Y136-V171 HydrophobicContact CE1-CG1 4.19Å; T138-V171 HydrophobicContact CG2-CG2 4.43Å; K164-V171 HydrophobicContact CB-CG2 4.19Å; K164-V171 HydrophobicContact CG-CG1 4.49Å; K164-V171 HydrophobicContact CG-CG2 4.18Å; E166-V171 HydrophobicContact CB-CG2 4.19Å; H167-V171 PolarHBondContact O-N 2.99Å; Y168-V171 PolarHBondContact O-N 2.84Å
172	V	94.4	Very high	95	Very high	9 Å²	9	53 Å²	53	6%	0.055	29%	0.293	C	S	.	.	S	Bend	trans	-130.8	142.1	-175.2	-178.3	0	0	0	0	110.4	L98 Y168 E176 L177 A196	L98-V172 HydrophobicContact CD2-CG2 3.95Å; Y168-V172 PolarHBondContact O-N 3.46Å; Y168-V172 VanDerWaalsContact O-N 3.13Å; V172-E176 HydrophobicContact CG1-CB 4.04Å; V172-L177 HydrophobicContact CB-CD2 3.95Å; V172-L177 HydrophobicContact CB-CG 4.2Å; V172-L177 HydrophobicContact CG1-CD2 3.98Å; V172-L177 HydrophobicContact CG1-CG 4.02Å; V172-A196 HydrophobicContact CG1-CB 3.69Å; V172-A196 HydrophobicContact CG2-CB 4.49Å
173	A	94.9	Very high	95	Very high	58 Å²	58	54.1 Å²	54.1	48%	0.479	30%	0.297	S	S	.	.			trans	-60.3	138	177.1	0	0	0	0	0	111.5	D175 E176	A173-D175 VanDerWaalsContact C-N 3.25Å; A173-D175 PolarHBondContact O-N 2.84Å; A173-E176 HydrophobicContact CB-CG 4.25Å; A173-E176 PolarHBondContact O-N 2.89Å
174	K	94.2	Very high	95	Very high	116 Å²	116	51.9 Å²	51.9	50%	0.504	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-52	-42.2	-175.7	-170.4	-179.3	171.5	169	0	113.3	E176 L177 L219 G220 I221	K174-E176 PolarHBondContact O-N 3.4Å; K174-L177 PolarHBondContact O-N 2.95Å; K174-L219 WeakPolarHBondContact CE-O 3.3Å; K174-L219 PolarHBondContact NZ-O 3.48Å; K174-G220 WeakPolarHBondContact CE-O 3.18Å; K174-I221 HydrophobicContact CG-CG2 3.77Å
175	D	93.9	Very high	95	Very high	136 Å²	136	52 Å²	52	73%	0.727	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-71.2	-17.7	-175.5	-58.3	-30.6	0	0	0	113.2	A173 K195	A173-D175 VanDerWaalsContact C-N 3.25Å; A173-D175 PolarHBondContact O-N 2.84Å; D175-K195 PolarHBondContact O-NZ 3.37Å
176	E	95.6	Very high	95.1	Very high	68 Å²	68	52.4 Å²	52.4	32%	0.318	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-90.5	-14.9	178.6	-57.2	-175.4	145.2	0	0	112.3	R96 V172 A173 K174 K195 A196	R96-E176 IonicContact CZ-OE2 2.94Å; R96-E176 IonicContact NH1-OE2 3.97Å; R96-E176 PolarHBondContact NH1-OE2 3.43Å; R96-E176 IonicContact NH2-OE1 3.95Å; R96-E176 PolarHBondContact NH2-OE1 3.46Å; R96-E176 IonicContact NH2-OE2 3.55Å; R96-E176 PolarHBondContact NH2-OE2 3.1Å; V172-E176 HydrophobicContact CG1-CB 4.04Å; A173-E176 HydrophobicContact CB-CG 4.25Å; A173-E176 PolarHBondContact O-N 2.89Å; K174-E176 PolarHBondContact O-N 3.4Å; E176-K195 WeakPolarHBondContact O-CA 3.38Å; E176-K195 WeakPolarHBondContact O-CD 3.45Å; E176-A196 PolarHBondContact O-N 3.14Å
177	L	97.1	Very high	95	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	131	-173.5	-73.4	168.6	0	0	0	112.6	L98 Y168 V172 K174 A196 V198 I221 G222	L98-L177 HydrophobicContact CD2-CD2 4.44Å; Y168-L177 HydrophobicContact CD2-CD1 3.93Å; Y168-L177 HydrophobicContact CD2-CD2 4.24Å; Y168-L177 HydrophobicContact CE2-CD1 4.39Å; V172-L177 HydrophobicContact CB-CD2 3.95Å; V172-L177 HydrophobicContact CB-CG 4.2Å; V172-L177 HydrophobicContact CG1-CD2 3.98Å; V172-L177 HydrophobicContact CG1-CG 4.02Å; K174-L177 PolarHBondContact O-N 2.95Å; L177-A196 WeakPolarHBondContact CA-O 3.48Å; L177-A196 HydrophobicContact CD2-CB 4.02Å; L177-V198 HydrophobicContact CD2-CG2 3.65Å; L177-I221 HydrophobicContact CB-CB 4.34Å; L177-I221 HydrophobicContact CB-CG2 4.21Å; L177-I221 HydrophobicContact CD1-CG2 4.34Å; L177-G222 PolarHBondContact O-N 3.33Å
178	V	97.7	Very high	95	Very high	22 Å²	22	49.5 Å²	49.5	13%	0.133	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	112.7	171	-177	0	0	0	0	109.5	K195 A196 Y197 V198 G222 A224	V178-K195 HydrophobicContact CG2-CB 4.43Å; V178-K195 HydrophobicContact CG2-CD 4.45Å; V178-K195 HydrophobicContact CG2-CG 4.46Å; V178-A196 PolarHBondContact N-O 3.33Å; V178-Y197 HydrophobicContact CB-CD1 3.87Å; V178-Y197 HydrophobicContact CB-CE1 3.96Å; V178-Y197 HydrophobicContact CG1-CD1 4.01Å; V178-Y197 HydrophobicContact CG1-CE1 3.95Å; V178-Y197 HydrophobicContact CG2-CE1 4.39Å; V178-Y197 CarbonylContact O-C 3.5Å; V178-Y197 VanDerWaalsContact O-CA 3.32Å; V178-Y197 WeakPolarHBondContact O-CA 3.3Å; V178-V198 PolarHBondContact O-N 2.9Å; V178-G222 CarbonylContact C-O 3.59Å; V178-G222 WeakPolarHBondContact CA-O 3.24Å; V178-A224 HydrophobicContact CG1-CB 4.25Å
179	Y	98.1	Very high	94.8	Very high	0 Å²	0	57 Å²	57	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	119.8	178.3	-151.8	-62	0	0	0	111.2	F103 Y168 T181 V198 G200 S212 A216 I221 G222 H223 A224	F103-Y179 WeakPolarHBondContact CE2-OH 3.45Å; F103-Y179 WeakPolarHBondContact CZ-OH 3.44Å; Y168-Y179 HydrophobicContact CE1-CE2 4.27Å; Y179-T181 PolarHBondContact O-N 3.47Å; Y179-V198 HydrophobicContact CD2-CB 3.96Å; Y179-V198 HydrophobicContact CD2-CG1 3.84Å; Y179-V198 HydrophobicContact CE2-CB 4.3Å; Y179-V198 HydrophobicContact CE2-CG1 3.67Å; Y179-V198 HydrophobicContact CG-CB 4.2Å; Y179-V198 HydrophobicContact CG-CG1 4.44Å; Y179-G200 WeakPolarHBondContact OH-CA 3.38Å; Y179-S212 VanDerWaalsContact CE1-CB 3.42Å; Y179-A216 HydrophobicContact CD2-CB 4.35Å; Y179-A216 HydrophobicContact CG-CB 4.07Å; Y179-I221 HydrophobicContact CD2-CD1 3.97Å; Y179-I221 HydrophobicContact CG-CD1 4.47Å; Y179-G222 PolarHBondContact N-O 3.25Å; Y179-H223 CarbonylContact O-C 3.53Å; Y179-H223 VanDerWaalsContact O-CA 3.25Å; Y179-H223 WeakPolarHBondContact O-CA 3.32Å; Y179-A224 PolarHBondContact O-N 3.37Å
180	L	97.3	Very high	94.8	Very high	15 Å²	15	61.4 Å²	61.4	8%	0.079	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	114.6	176	-63.1	178.5	0	0	0	110.5	Y197 V198 I199 A224 V245 I249	L180-Y197 HydrophobicContact CD1-CD1 4.38Å; L180-Y197 HydrophobicContact CD2-CD1 3.89Å; L180-Y197 HydrophobicContact CG-CD1 4.17Å; L180-V198 WeakPolarHBondContact CB-O 3.37Å; L180-V198 PolarHBondContact N-O 3.24Å; L180-I199 HydrophobicContact CD1-CG1 4.26Å; L180-A224 CarbonylContact C-O 3.59Å; L180-A224 VanDerWaalsContact CA-O 3.32Å; L180-A224 WeakPolarHBondContact CA-O 3.46Å; L180-V245 HydrophobicContact CD1-CG1 4.07Å; L180-I249 HydrophobicContact CD1-CD1 4.22Å; L180-I249 HydrophobicContact CD1-CG1 4.48Å
181	T	95.4	Very high	94.8	Very high	9 Å²	9	55.4 Å²	55.4	6%	0.055	30%	0.3	C	S	.	.			trans	-145.8	138.5	-179.8	179.9	0	0	0	0	111.3	Y179 D183 S184 S212 Y213 H223 A224 Q225	Y179-T181 PolarHBondContact O-N 3.47Å; T181-D183 PolarHBondContact O-N 3.29Å; T181-D183 PolarHBondContact OG1-N 3.28Å; T181-S184 PolarHBondContact O-N 2.96Å; T181-S212 PolarHBondContact OG1-OG 3.3Å; T181-Y213 HydrophobicContact CG2-CD2 4.12Å; T181-Y213 HydrophobicContact CG2-CG 4.41Å; T181-H223 HydrophobicContact CG2-CB 4.47Å; T181-A224 PolarHBondContact N-O 3.17Å; T181-Q225 VanDerWaalsContact O-CA 3.22Å; T181-Q225 WeakPolarHBondContact O-CA 3.33Å; T181-Q225 WeakPolarHBondContact O-CB 3.47Å
182	S	92.5	Very high	94.9	Very high	40 Å²	40	56.7 Å²	56.7	28%	0.28	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-19.5	179.8	49.2	0	0	0	0	113.9
183	D	92.9	Very high	94.8	Very high	70 Å²	70	61.3 Å²	61.3	37%	0.374	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-2.9	-176.5	-57.7	-55.8	0	0	0	112.5	T181 G210 Y213	T181-D183 PolarHBondContact O-N 3.29Å; T181-D183 PolarHBondContact OG1-N 3.28Å; D183-G210 VanDerWaalsContact OD2-CA 3.25Å; D183-G210 WeakPolarHBondContact OD2-CA 3.5Å; D183-G210 PolarHBondContact OD2-N 2.99Å; D183-Y213 HydrophobicContact CB-CD1 4.38Å; D183-Y213 HydrophobicContact CB-CG 4.34Å
184	S	95	Very high	94.7	Very high	1 Å²	1	66 Å²	66	1%	0.007	34%	0.336	C	S	.	.			trans	-70.6	134.6	177.6	167.9	0	0	0	0	111.1	T181 N186 H223 A224 Q225	T181-S184 PolarHBondContact O-N 2.96Å; S184-N186 VanDerWaalsContact C-N 3.28Å; S184-N186 PolarHBondContact O-N 3.34Å; S184-N186 PolarHBondContact OG-N 2.92Å; S184-N186 VanDerWaalsContact OG-N 3.15Å; S184-N186 PolarHBondContact OG-O 3.17Å; S184-H223 PolarHBondContact OG-ND1 3.48Å; S184-H223 PolarHBondContact OG-O 3.44Å; S184-A224 VanDerWaalsContact OG-CA 3.3Å; S184-A224 WeakPolarHBondContact OG-CA 3.36Å; S184-A224 PolarHBondContact OG-N 3.33Å; S184-Q225 PolarHBondContact O-NE2 2.95Å
185	P	94.1	Very high	94.7	Very high	83 Å²	83	63.7 Å²	63.7	54%	0.539	33%	0.325	S	S	.	.	S	Bend	trans	-67.9	-28.7	173.1	28.6	-34.5	0	0	0	112.5	Y213	P185-Y213 WeakPolarHBondContact CD-OH 3.43Å
186	N	96.3	Very high	94.9	Very high	85 Å²	85	57.2 Å²	57.2	46%	0.455	29%	0.291	S	S	.	.	S	Bend	trans	-75.8	135.8	-179.8	-51	-33.3	0	0	0	110.4	S184 H223 A224 Q225	S184-N186 VanDerWaalsContact C-N 3.28Å; S184-N186 PolarHBondContact O-N 3.34Å; S184-N186 PolarHBondContact OG-N 2.92Å; S184-N186 VanDerWaalsContact OG-N 3.15Å; S184-N186 PolarHBondContact OG-O 3.17Å; N186-H223 WeakPolarHBondContact CB-O 3.39Å; N186-H223 PolarHBondContact ND2-CE1 3.02Å; N186-H223 PolarHBondContact ND2-ND1 3.49Å; N186-H223 PolarHBondContact ND2-O 3.19Å; N186-A224 HydrophobicContact CB-CB 4.47Å; N186-A224 CarbonylContact O-C 3.28Å; N186-A224 VanDerWaalsContact O-CA 3.31Å; N186-A224 WeakPolarHBondContact O-CA 3.38Å; N186-Q225 WeakPolarHBondContact O-CG 3.05Å; N186-Q225 PolarHBondContact O-N 2.82Å
187	V	95.3	Very high	95	Very high	63 Å²	63	54.3 Å²	54.3	38%	0.382	28%	0.277	S	S	.	.	B	Isolated β-bridge	trans	-105.4	133	177.6	-177.3	0	0	0	0	109.2	E189 Q225 P227	V187-E189 PolarHBondContact O-N 3.06Å; V187-Q225 HydrophobicContact CB-CG 4.46Å; V187-Q225 HydrophobicContact CG2-CG 3.93Å; V187-P227 HydrophobicContact CG1-CB 3.65Å
188	V	94.7	Very high	95	Very high	11 Å²	11	54.2 Å²	54.2	7%	0.067	28%	0.276	C	S	.	.			trans	-74.7	122.6	171.4	141.5	0	0	0	0	109.2	L191 Y197 A224 Q225 P227 W258	V188-L191 HydrophobicContact CG1-CD2 3.99Å; V188-Y197 HydrophobicContact CG2-CE1 4.29Å; V188-A224 HydrophobicContact CB-CB 4.26Å; V188-A224 HydrophobicContact CG2-CB 3.51Å; V188-Q225 PolarHBondContact N-O 2.77Å; V188-P227 WeakPolarHBondContact O-CD 3.37Å; V188-P227 WeakPolarHBondContact O-CG 3.28Å; V188-W258 HydrophobicContact CG1-CH2 3.79Å; V188-W258 HydrophobicContact CG1-CZ2 3.3Å
189	E	91.6	Very high	95	Very high	158 Å²	158	53.4 Å²	53.4	74%	0.738	27%	0.271	S	S	*	.			trans	-96.7	-45.4	174.6	-63.9	-176.5	170	0	0	110.8	V187 W258	V187-E189 PolarHBondContact O-N 3.06Å; E189-W258 PolarHBondContact O-NE1 2.97Å
190	E	93.4	Very high	95	Very high	152 Å²	152	54.2 Å²	54.2	71%	0.71	28%	0.28	S	S	*	.	S	Bend	trans	-135.3	156.9	177.4	-64.9	-172.7	172.1	0	0	111
191	L	94.1	Very high	94.9	Very high	18 Å²	18	53.5 Å²	53.5	9%	0.094	28%	0.276	C	S	.	.			trans	-96.2	116.7	174.7	-63.8	-177.9	0	0	0	110.3	L95 V188 Q193 Y197 I249 Y252 W258	L95-L191 HydrophobicContact CD1-CB 3.85Å; L95-L191 HydrophobicContact CD1-CD1 4.09Å; L95-L191 HydrophobicContact CD1-CG 4.49Å; V188-L191 HydrophobicContact CG1-CD2 3.99Å; L191-Q193 PolarHBondContact O-N 3.42Å; L191-Y197 WeakPolarHBondContact CA-OH 3.49Å; L191-Y197 HydrophobicContact CB-CE2 4.33Å; L191-Y197 HydrophobicContact CD2-CD1 4.32Å; L191-Y197 HydrophobicContact CD2-CD2 4.4Å; L191-Y197 HydrophobicContact CD2-CE1 3.79Å; L191-Y197 HydrophobicContact CD2-CE2 3.9Å; L191-I249 HydrophobicContact CD1-CD1 3.73Å; L191-I249 HydrophobicContact CD1-CG2 3.77Å; L191-I249 HydrophobicContact CD2-CD1 3.98Å; L191-I249 HydrophobicContact CG-CD1 4.47Å; L191-Y252 HydrophobicContact CB-CD1 4.41Å; L191-Y252 HydrophobicContact CB-CE1 4.15Å; L191-Y252 HydrophobicContact CD1-CD1 3.58Å; L191-Y252 HydrophobicContact CD1-CE1 4.14Å; L191-Y252 HydrophobicContact CD1-CG 4.42Å; L191-Y252 HydrophobicContact CG-CD1 3.86Å; L191-Y252 HydrophobicContact CG-CE1 3.92Å; L191-W258 HydrophobicContact CD1-CH2 4.23Å; L191-W258 HydrophobicContact CD2-CH2 4.03Å; L191-W258 HydrophobicContact CD2-CZ2 4.15Å; L191-W258 HydrophobicContact CG-CH2 4.05Å; L191-W258 HydrophobicContact CG-CZ2 4Å
192	D	93.8	Very high	94.9	Very high	73 Å²	73	54.5 Å²	54.5	39%	0.39	28%	0.281	S	S	.	.			trans	-78.2	117.6	170.9	-179.6	-2.8	0	0	0	109.1	K194 K195 Y197	D192-K194 PolarHBondContact O-N 3.13Å; D192-K194 VanDerWaalsContact O-N 3.17Å; D192-K194 WeakPolarHBondContact OD1-CB 3.39Å; D192-K194 PolarHBondContact OD1-N 3.26Å; D192-K195 HydrophobicContact CB-CB 4.24Å; D192-K195 HydrophobicContact CB-CG 3.69Å; D192-K195 PolarHBondContact O-N 3.2Å; D192-K195 WeakPolarHBondContact OD2-CG 3.33Å; D192-Y197 PolarHBondContact N-OH 2.92Å
193	Q	91.9	Very high	95	Very high	106 Å²	106	53.3 Å²	53.3	50%	0.495	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-19.5	-178.8	-56.2	-175.3	12.8	0	0	113.1	S94 L95 L191	S94-Q193 CarbonylContact C-O 3.49Å; S94-Q193 WeakPolarHBondContact OG-CB 3.36Å; S94-Q193 PolarHBondContact OG-O 2.96Å; L95-Q193 WeakPolarHBondContact CA-O 3.37Å; L95-Q193 PolarHBondContact N-O 3.42Å; L191-Q193 PolarHBondContact O-N 3.42Å
194	K	93	Very high	94.8	Very high	158 Å²	158	51.1 Å²	51.1	69%	0.687	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81	-20.6	175.9	-62.5	179.7	-177.1	176.8	0	112.5	R96 D192	R96-K194 PolarHBondContact NH2-O 3.48Å; D192-K194 PolarHBondContact O-N 3.13Å; D192-K194 VanDerWaalsContact O-N 3.17Å; D192-K194 WeakPolarHBondContact OD1-CB 3.39Å; D192-K194 PolarHBondContact OD1-N 3.26Å
195	K	95.5	Very high	94.4	Very high	66 Å²	66	56.6 Å²	56.6	29%	0.287	29%	0.285	S	S	.	.	S	Bend	trans	-81	164.3	-178	-64.8	-66.7	-173.4	-176	0	112.2	D175 E176 V178 D192 Y197	D175-K195 PolarHBondContact O-NZ 3.37Å; E176-K195 WeakPolarHBondContact O-CA 3.38Å; E176-K195 WeakPolarHBondContact O-CD 3.45Å; V178-K195 HydrophobicContact CG2-CB 4.43Å; V178-K195 HydrophobicContact CG2-CD 4.45Å; V178-K195 HydrophobicContact CG2-CG 4.46Å; D192-K195 HydrophobicContact CB-CB 4.24Å; D192-K195 HydrophobicContact CB-CG 3.69Å; D192-K195 PolarHBondContact O-N 3.2Å; D192-K195 WeakPolarHBondContact OD2-CG 3.33Å; K195-Y197 HydrophobicContact CB-CE2 3.95Å
196	A	97.1	Very high	94	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.5	178	0	0	0	0	0	109.1	R96 L98 V172 E176 L177 V178	R96-A196 HydrophobicContact CB-CB 4.07Å; R96-A196 WeakPolarHBondContact O-CA 3.34Å; L98-A196 HydrophobicContact CD1-CB 3.64Å; V172-A196 HydrophobicContact CG1-CB 3.69Å; V172-A196 HydrophobicContact CG2-CB 4.49Å; E176-A196 PolarHBondContact O-N 3.14Å; L177-A196 WeakPolarHBondContact CA-O 3.48Å; L177-A196 HydrophobicContact CD2-CB 4.02Å; V178-A196 PolarHBondContact N-O 3.33Å
197	Y	97.9	Very high	93.6	Very high	8 Å²	8	57.1 Å²	57.1	3%	0.031	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	128.4	-178	-67.5	-86	0	0	0	110.4	L95 R96 L98 V178 L180 V188 L191 D192 K195	L95-Y197 HydrophobicContact CD1-CD2 3.84Å; L95-Y197 HydrophobicContact CD1-CE2 3.71Å; L95-Y197 HydrophobicContact CD2-CD2 4.13Å; L95-Y197 HydrophobicContact CG-CD2 4.03Å; L95-Y197 HydrophobicContact CG-CE2 4.28Å; R96-Y197 PolarHBondContact O-N 3.18Å; L98-Y197 PolarHBondContact N-O 2.86Å; V178-Y197 HydrophobicContact CB-CD1 3.87Å; V178-Y197 HydrophobicContact CB-CE1 3.96Å; V178-Y197 HydrophobicContact CG1-CD1 4.01Å; V178-Y197 HydrophobicContact CG1-CE1 3.95Å; V178-Y197 HydrophobicContact CG2-CE1 4.39Å; V178-Y197 CarbonylContact O-C 3.5Å; V178-Y197 VanDerWaalsContact O-CA 3.32Å; V178-Y197 WeakPolarHBondContact O-CA 3.3Å; L180-Y197 HydrophobicContact CD1-CD1 4.38Å; L180-Y197 HydrophobicContact CD2-CD1 3.89Å; L180-Y197 HydrophobicContact CG-CD1 4.17Å; V188-Y197 HydrophobicContact CG2-CE1 4.29Å; L191-Y197 WeakPolarHBondContact CA-OH 3.49Å; L191-Y197 HydrophobicContact CB-CE2 4.33Å; L191-Y197 HydrophobicContact CD2-CD1 4.32Å; L191-Y197 HydrophobicContact CD2-CD2 4.4Å; L191-Y197 HydrophobicContact CD2-CE1 3.79Å; L191-Y197 HydrophobicContact CD2-CE2 3.9Å; D192-Y197 PolarHBondContact N-OH 2.92Å; K195-Y197 HydrophobicContact CB-CE2 3.95Å
198	V	98	Very high	93.2	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	129.6	-178.1	-172.8	0	0	0	0	110.3	L98 D100 Y168 L177 V178 Y179 L180	L98-V198 HydrophobicContact CB-CG1 4.49Å; L98-V198 HydrophobicContact CB-CG2 4.23Å; L98-V198 HydrophobicContact CD1-CG2 4.47Å; L98-V198 CarbonylContact O-C 3.55Å; D100-V198 HydrophobicContact CB-CG1 3.89Å; Y168-V198 HydrophobicContact CD1-CG1 4.32Å; Y168-V198 HydrophobicContact CD2-CG2 4.32Å; Y168-V198 HydrophobicContact CE1-CG1 4.42Å; L177-V198 HydrophobicContact CD2-CG2 3.65Å; V178-V198 PolarHBondContact O-N 2.9Å; Y179-V198 HydrophobicContact CD2-CB 3.96Å; Y179-V198 HydrophobicContact CD2-CG1 3.84Å; Y179-V198 HydrophobicContact CE2-CB 4.3Å; Y179-V198 HydrophobicContact CE2-CG1 3.67Å; Y179-V198 HydrophobicContact CG-CB 4.2Å; Y179-V198 HydrophobicContact CG-CG1 4.44Å; L180-V198 WeakPolarHBondContact CB-O 3.37Å; L180-V198 PolarHBondContact N-O 3.24Å
199	I	97.9	Very high	93	Very high	6 Å²	6	64.6 Å²	64.6	3%	0.031	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	127.8	173.3	-55	171.9	0	0	0	108.1	L97 L98 V99 D100 L180 G201 V242 V245 F246	L97-I199 HydrophobicContact CD1-CD1 3.89Å; L97-I199 HydrophobicContact CD1-CG1 4.17Å; L97-I199 HydrophobicContact CD2-CD1 4.25Å; L97-I199 HydrophobicContact CG-CD1 4.11Å; L98-I199 PolarHBondContact O-N 3.28Å; V99-I199 WeakPolarHBondContact CA-O 3.21Å; D100-I199 PolarHBondContact N-O 3.09Å; L180-I199 HydrophobicContact CD1-CG1 4.26Å; I199-G201 PolarHBondContact O-N 2.7Å; I199-V242 HydrophobicContact CG2-CB 4.47Å; I199-V242 HydrophobicContact CG2-CG1 3.92Å; I199-V245 HydrophobicContact CD1-CB 4.17Å; I199-V245 HydrophobicContact CD1-CG1 3.7Å; I199-V245 HydrophobicContact CG1-CG1 3.86Å; I199-V245 HydrophobicContact CG2-CB 4.35Å; I199-V245 HydrophobicContact CG2-CG1 4.31Å; I199-F246 HydrophobicContact CD1-CB 4.14Å; I199-F246 HydrophobicContact CD1-CD2 4.14Å
200	G	96.7	Very high	93	Very high	17 Å²	17	57.5 Å²	57.5	18%	0.175	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	115.8	174.1	0	0	0	0	0	111.7	Y179 L202 V242	Y179-G200 WeakPolarHBondContact OH-CA 3.38Å; G200-L202 PolarHBondContact O-N 3.09Å; G200-V242 WeakPolarHBondContact O-CG2 3.45Å
201	G	95.8	Very high	93	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.247	C	C	.	.			trans	-75.5	62.3	173.5	0	0	0	0	0	111.6	D100 L115 I199	D100-G201 WeakPolarHBondContact O-CA 3.42Å; D100-G201 PolarHBondContact O-N 3.25Å; L115-G201 WeakPolarHBondContact CD2-O 3.44Å; I199-G201 PolarHBondContact O-N 2.7Å
202	L	95.1	Very high	93	Very high	29 Å²	29	51.7 Å²	51.7	15%	0.152	25%	0.25	C	S	.	.			trans	-126.6	129.6	-176.1	-179.9	57.2	0	0	0	110.6	F103 L106 M107 G200 D204 I211	F103-L202 HydrophobicContact CB-CB 4.23Å; F103-L202 HydrophobicContact CB-CD1 3.86Å; F103-L202 HydrophobicContact CB-CG 4.46Å; F103-L202 HydrophobicContact CD1-CD2 4.28Å; F103-L202 HydrophobicContact CD2-CB 4.2Å; F103-L202 HydrophobicContact CG-CB 4.18Å; F103-L202 HydrophobicContact CG-CD1 4.47Å; F103-L202 HydrophobicContact CG-CD2 4.45Å; L106-L202 HydrophobicContact CB-CD1 4.32Å; M107-L202 HydrophobicContact CG-CD1 3.7Å; M107-L202 HydrophobicContact SD-CD1 4.11Å; G200-L202 PolarHBondContact O-N 3.09Å; L202-D204 HydrophobicContact CD1-CB 3.89Å; L202-D204 HydrophobicContact CD2-CB 4.18Å; L202-D204 HydrophobicContact CG-CB 3.87Å; L202-I211 HydrophobicContact CD2-CG2 3.82Å
203	V	94.1	Very high	93.2	Very high	15 Å²	15	50.5 Å²	50.5	9%	0.091	24%	0.241	C	C	.	.			trans	-120.6	91.4	170.4	-178.2	0	0	0	0	108.1	M107 D111 K114 L115	M107-V203 HydrophobicContact SD-CB 4.21Å; M107-V203 PolarHBondContact SD-N 3.5Å; D111-V203 HydrophobicContact CB-CB 4.26Å; D111-V203 HydrophobicContact CB-CG1 4.22Å; D111-V203 WeakPolarHBondContact CB-O 3.34Å; K114-V203 HydrophobicContact CB-CG1 4.2Å; K114-V203 HydrophobicContact CD-CG1 4.19Å; L115-V203 HydrophobicContact CB-CG2 3.88Å; L115-V203 HydrophobicContact CD1-CG2 4.28Å
204	D	90.3	Very high	93.4	Very high	25 Å²	25	50.7 Å²	50.7	13%	0.134	24%	0.242	C	C	.	.	S	Bend	trans	-122.8	6.1	-173.4	75.1	-32.5	0	0	0	112.6	L202 N206 H207 H208	L202-D204 HydrophobicContact CD1-CB 3.89Å; L202-D204 HydrophobicContact CD2-CB 4.18Å; L202-D204 HydrophobicContact CG-CB 3.87Å; D204-N206 VanDerWaalsContact CG-N 3.32Å; D204-N206 PolarHBondContact O-N 2.82Å; D204-N206 VanDerWaalsContact O-N 3.09Å; D204-N206 WeakPolarHBondContact OD1-CA 3.05Å; D204-N206 PolarHBondContact OD1-N 2.98Å; D204-N206 WeakPolarHBondContact OD2-CA 3.28Å; D204-N206 PolarHBondContact OD2-N 3.44Å; D204-H207 PolarHBondContact O-N 3.31Å; D204-H207 PolarHBondContact O-ND1 2.93Å; D204-H207 PolarHBondContact OD2-N 2.96Å; D204-H208 IonicContact OD2-CD2 3.19Å; D204-H208 PolarHBondContact OD2-N 3.12Å
205	H	86.1	Confident	93.5	Very high	115 Å²	115	46.4 Å²	46.4	53%	0.532	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	55.1	25.2	-172	-61.3	-78.9	0	0	0	114.2	D111	D111-H205 IonicContact OD1-NE2 3.38Å
206	N	85.1	Confident	93.5	Very high	29 Å²	29	43.3 Å²	43.3	16%	0.155	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.4	43.5	-176.7	-167.1	71	0	0	0	113.6	D204 V239	D204-N206 VanDerWaalsContact CG-N 3.32Å; D204-N206 PolarHBondContact O-N 2.82Å; D204-N206 VanDerWaalsContact O-N 3.09Å; D204-N206 WeakPolarHBondContact OD1-CA 3.05Å; D204-N206 PolarHBondContact OD1-N 2.98Å; D204-N206 WeakPolarHBondContact OD2-CA 3.28Å; D204-N206 PolarHBondContact OD2-N 3.44Å; N206-V239 WeakPolarHBondContact OD1-CG2 3.46Å
207	H	88.2	Confident	93.4	Very high	150 Å²	150	49 Å²	49	69%	0.694	23%	0.233	S	C	*	.			trans	-79.4	-38.9	169.7	-74.5	80.4	0	0	0	110.8	D204 K209	D204-H207 PolarHBondContact O-N 3.31Å; D204-H207 PolarHBondContact O-ND1 2.93Å; D204-H207 PolarHBondContact OD2-N 2.96Å; H207-K209 PolarHBondContact O-N 2.75Å
208	H	87.9	Confident	93.3	Very high	80 Å²	80	56.1 Å²	56.1	37%	0.37	27%	0.266	S	S	.	.	S	Bend	trans	-95.4	73.9	178.7	-61.7	-80.7	0	0	0	110.7	D204 I211	D204-H208 IonicContact OD2-CD2 3.19Å; D204-H208 PolarHBondContact OD2-N 3.12Å; H208-I211 HydrophobicContact CB-CB 4.12Å; H208-I211 HydrophobicContact CB-CD1 4.23Å; H208-I211 HydrophobicContact CB-CG2 3.95Å; H208-I211 WeakPolarHBondContact O-CG2 3.44Å
209	K	89.6	Confident	93.2	Very high	152 Å²	152	59.5 Å²	59.5	66%	0.661	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	138.7	177.5	-61.1	-179.9	-175.4	174.9	0	110.5	H207 I211	H207-K209 PolarHBondContact O-N 2.75Å; K209-I211 PolarHBondContact O-N 2.76Å; K209-I211 VanDerWaalsContact O-N 3.16Å
210	G	91.4	Very high	93	Very high	8 Å²	8	61.4 Å²	61.4	8%	0.082	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	74.7	-6.6	174.3	0	0	0	0	0	116	D183 S212 Y213 E214	D183-G210 VanDerWaalsContact OD2-CA 3.25Å; D183-G210 WeakPolarHBondContact OD2-CA 3.5Å; D183-G210 PolarHBondContact OD2-N 2.99Å; G210-S212 VanDerWaalsContact C-N 3.33Å; G210-S212 PolarHBondContact O-N 3.41Å; G210-Y213 CarbonylContact O-C 3.49Å; G210-Y213 WeakPolarHBondContact O-CA 3.33Å; G210-Y213 WeakPolarHBondContact O-CB 3.46Å; G210-Y213 PolarHBondContact O-N 2.89Å; G210-E214 WeakPolarHBondContact O-CG 3.44Å; G210-E214 PolarHBondContact O-N 3.33Å
211	I	94.2	Very high	93.1	Very high	26 Å²	26	61.2 Å²	61.2	13%	0.133	30%	0.3	C	S	.	.	H	α-helix	trans	-59.8	-39.9	-170.5	-165.6	172.5	0	0	0	113.8	F103 L106 L202 H208 K209 Y213 R215	F103-I211 HydrophobicContact CD1-CD1 4.29Å; F103-I211 HydrophobicContact CE1-CD1 4.23Å; F103-I211 HydrophobicContact CE1-CG1 4.24Å; F103-I211 HydrophobicContact CE1-CG2 4.22Å; L106-I211 HydrophobicContact CD1-CD1 3.3Å; L202-I211 HydrophobicContact CD2-CG2 3.82Å; H208-I211 HydrophobicContact CB-CB 4.12Å; H208-I211 HydrophobicContact CB-CD1 4.23Å; H208-I211 HydrophobicContact CB-CG2 3.95Å; H208-I211 WeakPolarHBondContact O-CG2 3.44Å; K209-I211 PolarHBondContact O-N 2.76Å; K209-I211 VanDerWaalsContact O-N 3.16Å; I211-Y213 VanDerWaalsContact C-N 3.34Å; I211-R215 WeakPolarHBondContact O-CB 3.25Å; I211-R215 WeakPolarHBondContact O-CG 3.39Å; I211-R215 PolarHBondContact O-N 3.15Å; I211-R215 VanDerWaalsContact O-N 3.13Å
212	S	94.3	Very high	93.1	Very high	22 Å²	22	63 Å²	63	15%	0.154	32%	0.318	C	S	.	.	H	α-helix	trans	-70.1	-34.1	176.6	45.8	0	0	0	0	112.1	Y179 T181 G210 A216	Y179-S212 VanDerWaalsContact CE1-CB 3.42Å; T181-S212 PolarHBondContact OG1-OG 3.3Å; G210-S212 VanDerWaalsContact C-N 3.33Å; G210-S212 PolarHBondContact O-N 3.41Å; S212-A216 WeakPolarHBondContact O-CB 3.25Å; S212-A216 PolarHBondContact O-N 3.02Å; S212-A216 VanDerWaalsContact O-N 3.11Å
213	Y	96.3	Very high	93.2	Very high	49 Å²	49	63.1 Å²	63.1	19%	0.192	32%	0.318	C	S	.	.	H	α-helix	trans	-71.6	-44.7	177.7	172.2	-120.6	0	0	0	111.7	T181 D183 P185 G210 I211 A216 K217 H223	T181-Y213 HydrophobicContact CG2-CD2 4.12Å; T181-Y213 HydrophobicContact CG2-CG 4.41Å; D183-Y213 HydrophobicContact CB-CD1 4.38Å; D183-Y213 HydrophobicContact CB-CG 4.34Å; P185-Y213 WeakPolarHBondContact CD-OH 3.43Å; G210-Y213 CarbonylContact O-C 3.49Å; G210-Y213 WeakPolarHBondContact O-CA 3.33Å; G210-Y213 WeakPolarHBondContact O-CB 3.46Å; G210-Y213 PolarHBondContact O-N 2.89Å; I211-Y213 VanDerWaalsContact C-N 3.34Å; Y213-A216 PolarHBondContact O-N 3.1Å; Y213-K217 HydrophobicContact CD1-CD 4.37Å; Y213-K217 HydrophobicContact CD2-CD 4.32Å; Y213-K217 HydrophobicContact CD2-CG 4.35Å; Y213-K217 HydrophobicContact CE1-CD 3.79Å; Y213-K217 HydrophobicContact CE2-CD 3.69Å; Y213-K217 HydrophobicContact CE2-CG 3.97Å; Y213-K217 VanDerWaalsContact CZ-CD 3.43Å; Y213-K217 WeakPolarHBondContact O-CG 3.18Å; Y213-K217 PolarHBondContact O-N 2.75Å; Y213-H223 AromaticContact CE2-CE1 3.54Å; Y213-H223 AromaticContact CE2-ND1 3.67Å; Y213-H223 AromaticContact CE2-NE2 3.84Å
214	E	96.4	Very high	93.4	Very high	110 Å²	110	62.8 Å²	62.8	51%	0.514	32%	0.316	S	S	.	.	H	α-helix	trans	-59.1	-48.8	175.4	-71.7	172.7	178.3	0	0	110.9	G210 A216 K217 E218	G210-E214 WeakPolarHBondContact O-CG 3.44Å; G210-E214 PolarHBondContact O-N 3.33Å; E214-A216 VanDerWaalsContact C-N 3.34Å; E214-A216 PolarHBondContact O-N 2.79Å; E214-K217 WeakPolarHBondContact O-CB 3.49Å; E214-K217 PolarHBondContact O-N 2.78Å; E214-K217 VanDerWaalsContact O-N 3.13Å; E214-E218 WeakPolarHBondContact O-CG 3.25Å; E214-E218 PolarHBondContact O-N 3.48Å
215	R	94.6	Very high	93.6	Very high	68 Å²	68	63.4 Å²	63.4	26%	0.257	32%	0.319	S	S	.	.	H	α-helix	trans	-58.6	-42.8	175.7	-75.5	-178.5	178.7	-162.1	-1.3	113.1	S102 F103 I211 K217 E218 L219	S102-R215 PolarHBondContact OG-NH1 3.27Å; F103-R215 VanDerWaalsContact CD1-CZ 3.48Å; F103-R215 VanDerWaalsContact CD1-NH1 3.27Å; F103-R215 VanDerWaalsContact CZ-NH1 3.32Å; I211-R215 WeakPolarHBondContact O-CB 3.25Å; I211-R215 WeakPolarHBondContact O-CG 3.39Å; I211-R215 PolarHBondContact O-N 3.15Å; I211-R215 VanDerWaalsContact O-N 3.13Å; R215-K217 VanDerWaalsContact C-N 3.31Å; R215-K217 PolarHBondContact O-N 3.44Å; R215-E218 PolarHBondContact O-N 3.38Å; R215-L219 WeakPolarHBondContact O-CB 3.42Å; R215-L219 WeakPolarHBondContact O-CG 3.29Å; R215-L219 PolarHBondContact O-N 2.92Å
216	A	96	Very high	94	Very high	0 Å²	0	58.6 Å²	58.6	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-63.3	-38.9	178	0	0	0	0	0	111.8	Y179 S212 Y213 E214 G220 I221 H223	Y179-A216 HydrophobicContact CD2-CB 4.35Å; Y179-A216 HydrophobicContact CG-CB 4.07Å; S212-A216 WeakPolarHBondContact O-CB 3.25Å; S212-A216 PolarHBondContact O-N 3.02Å; S212-A216 VanDerWaalsContact O-N 3.11Å; Y213-A216 PolarHBondContact O-N 3.1Å; E214-A216 VanDerWaalsContact C-N 3.34Å; E214-A216 PolarHBondContact O-N 2.79Å; A216-G220 PolarHBondContact O-N 3.31Å; A216-I221 HydrophobicContact CB-CD1 4.15Å; A216-I221 HydrophobicContact CB-CG1 3.89Å; A216-I221 WeakPolarHBondContact O-CG1 3.24Å; A216-I221 PolarHBondContact O-N 2.9Å; A216-H223 HydrophobicContact CB-CB 4.01Å
217	K	96.4	Very high	94.3	Very high	121 Å²	121	57.4 Å²	57.4	53%	0.526	29%	0.291	S	S	.	.	H	α-helix	trans	-67.6	-44.5	175.1	-75.6	-176.4	64.5	178.5	0	112.8	Y213 E214 R215 L219 G220	Y213-K217 HydrophobicContact CD1-CD 4.37Å; Y213-K217 HydrophobicContact CD2-CD 4.32Å; Y213-K217 HydrophobicContact CD2-CG 4.35Å; Y213-K217 HydrophobicContact CE1-CD 3.79Å; Y213-K217 HydrophobicContact CE2-CD 3.69Å; Y213-K217 HydrophobicContact CE2-CG 3.97Å; Y213-K217 VanDerWaalsContact CZ-CD 3.43Å; Y213-K217 WeakPolarHBondContact O-CG 3.18Å; Y213-K217 PolarHBondContact O-N 2.75Å; E214-K217 WeakPolarHBondContact O-CB 3.49Å; E214-K217 PolarHBondContact O-N 2.78Å; E214-K217 VanDerWaalsContact O-N 3.13Å; R215-K217 VanDerWaalsContact C-N 3.31Å; R215-K217 PolarHBondContact O-N 3.44Å; K217-L219 VanDerWaalsContact C-N 3.3Å; K217-L219 PolarHBondContact O-N 3.04Å; K217-G220 WeakPolarHBondContact O-CA 3.4Å; K217-G220 PolarHBondContact O-N 2.95Å
218	E	95.9	Very high	94.2	Very high	157 Å²	157	50.8 Å²	50.8	73%	0.734	26%	0.26	S	S	*	.	H	α-helix	trans	-59.9	-41.9	177.8	-74	171.5	177.4	0	0	111.5	E214 R215 G220	E214-E218 WeakPolarHBondContact O-CG 3.25Å; E214-E218 PolarHBondContact O-N 3.48Å; R215-E218 PolarHBondContact O-N 3.38Å; E218-G220 PolarHBondContact O-N 2.93Å
219	L	94.2	Very high	93.7	Very high	70 Å²	70	49.4 Å²	49.4	37%	0.366	26%	0.26	S	S	.	.	H	α-helix	trans	-76.3	-12.5	175.6	-65.5	173	0	0	0	112.8	Y168 K174 R215 K217 I221	Y168-L219 HydrophobicContact CE2-CD1 4.25Å; Y168-L219 WeakPolarHBondContact OH-CD1 3.31Å; K174-L219 WeakPolarHBondContact CE-O 3.3Å; K174-L219 PolarHBondContact NZ-O 3.48Å; R215-L219 WeakPolarHBondContact O-CB 3.42Å; R215-L219 WeakPolarHBondContact O-CG 3.29Å; R215-L219 PolarHBondContact O-N 2.92Å; K217-L219 VanDerWaalsContact C-N 3.3Å; K217-L219 PolarHBondContact O-N 3.04Å; L219-I221 VanDerWaalsContact C-N 3.32Å; L219-I221 HydrophobicContact CB-CG1 4.4Å; L219-I221 HydrophobicContact CB-CG2 4.35Å; L219-I221 PolarHBondContact O-N 2.96Å
220	G	95.4	Very high	93.1	Very high	46 Å²	46	45.1 Å²	45.1	47%	0.474	25%	0.249	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.1	37.7	-177.8	0	0	0	0	0	113.1	K174 A216 K217 E218	K174-G220 WeakPolarHBondContact CE-O 3.18Å; A216-G220 PolarHBondContact O-N 3.31Å; K217-G220 WeakPolarHBondContact O-CA 3.4Å; K217-G220 PolarHBondContact O-N 2.95Å; E218-G220 PolarHBondContact O-N 2.93Å
221	I	96.8	Very high	92.2	Very high	14 Å²	14	46.9 Å²	46.9	7%	0.072	26%	0.255	C	S	.	.			trans	-95.3	160.3	174.8	56.6	172.3	0	0	0	110.5	Y168 K174 L177 Y179 A216 L219	Y168-I221 HydrophobicContact CE2-CD1 3.99Å; K174-I221 HydrophobicContact CG-CG2 3.77Å; L177-I221 HydrophobicContact CB-CB 4.34Å; L177-I221 HydrophobicContact CB-CG2 4.21Å; L177-I221 HydrophobicContact CD1-CG2 4.34Å; Y179-I221 HydrophobicContact CD2-CD1 3.97Å; Y179-I221 HydrophobicContact CG-CD1 4.47Å; A216-I221 HydrophobicContact CB-CD1 4.15Å; A216-I221 HydrophobicContact CB-CG1 3.89Å; A216-I221 WeakPolarHBondContact O-CG1 3.24Å; A216-I221 PolarHBondContact O-N 2.9Å; L219-I221 VanDerWaalsContact C-N 3.32Å; L219-I221 HydrophobicContact CB-CG1 4.4Å; L219-I221 HydrophobicContact CB-CG2 4.35Å; L219-I221 PolarHBondContact O-N 2.96Å
222	G	96.7	Very high	91	Very high	38 Å²	38	45.9 Å²	45.9	39%	0.392	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.6	144.3	172.4	0	0	0	0	0	110.7	L177 V178 Y179	L177-G222 PolarHBondContact O-N 3.33Å; V178-G222 CarbonylContact C-O 3.59Å; V178-G222 WeakPolarHBondContact CA-O 3.24Å; Y179-G222 PolarHBondContact N-O 3.25Å
223	H	97.5	Very high	89.8	Confident	31 Å²	31	51.9 Å²	51.9	14%	0.144	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	145.4	175.3	57.9	70.6	0	0	0	110.5	Y179 T181 S184 N186 Y213 A216	Y179-H223 CarbonylContact O-C 3.53Å; Y179-H223 VanDerWaalsContact O-CA 3.25Å; Y179-H223 WeakPolarHBondContact O-CA 3.32Å; T181-H223 HydrophobicContact CG2-CB 4.47Å; S184-H223 PolarHBondContact OG-ND1 3.48Å; S184-H223 PolarHBondContact OG-O 3.44Å; N186-H223 WeakPolarHBondContact CB-O 3.39Å; N186-H223 PolarHBondContact ND2-CE1 3.02Å; N186-H223 PolarHBondContact ND2-ND1 3.49Å; N186-H223 PolarHBondContact ND2-O 3.19Å; Y213-H223 AromaticContact CE2-CE1 3.54Å; Y213-H223 AromaticContact CE2-ND1 3.67Å; Y213-H223 AromaticContact CE2-NE2 3.84Å; A216-H223 HydrophobicContact CB-CB 4.01Å
224	A	97.1	Very high	88.5	Confident	7 Å²	7	50.8 Å²	50.8	6%	0.058	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.3	154.3	179.5	0	0	0	0	0	112.5	V178 Y179 L180 T181 S184 N186 V188	V178-A224 HydrophobicContact CG1-CB 4.25Å; Y179-A224 PolarHBondContact O-N 3.37Å; L180-A224 CarbonylContact C-O 3.59Å; L180-A224 VanDerWaalsContact CA-O 3.32Å; L180-A224 WeakPolarHBondContact CA-O 3.46Å; T181-A224 PolarHBondContact N-O 3.17Å; S184-A224 VanDerWaalsContact OG-CA 3.3Å; S184-A224 WeakPolarHBondContact OG-CA 3.36Å; S184-A224 PolarHBondContact OG-N 3.33Å; N186-A224 HydrophobicContact CB-CB 4.47Å; N186-A224 CarbonylContact O-C 3.28Å; N186-A224 VanDerWaalsContact O-CA 3.31Å; N186-A224 WeakPolarHBondContact O-CA 3.38Å; V188-A224 HydrophobicContact CB-CB 4.26Å; V188-A224 HydrophobicContact CG2-CB 3.51Å
225	Q	95.7	Very high	87	Confident	38 Å²	38	53.6 Å²	53.6	18%	0.178	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-99.8	153.8	168.9	74.4	176.5	-69.6	0	0	110.5	T181 S184 N186 V187 V188	T181-Q225 VanDerWaalsContact O-CA 3.22Å; T181-Q225 WeakPolarHBondContact O-CA 3.33Å; T181-Q225 WeakPolarHBondContact O-CB 3.47Å; S184-Q225 PolarHBondContact O-NE2 2.95Å; N186-Q225 WeakPolarHBondContact O-CG 3.05Å; N186-Q225 PolarHBondContact O-N 2.82Å; V187-Q225 HydrophobicContact CB-CG 4.46Å; V187-Q225 HydrophobicContact CG2-CG 3.93Å; V188-Q225 PolarHBondContact N-O 2.77Å
226	L	94.3	Very high	85.8	Confident	14 Å²	14	52.9 Å²	52.9	7%	0.073	29%	0.294	C	S	.	.			trans	-69	148	170.3	-65.3	179.1	0	0	0	110.5	L228 L240 V245 I248 I249 W258 F262	L226-L228 HydrophobicContact CB-CG 4.22Å; L226-L228 PolarHBondContact O-N 3.1Å; L226-L240 HydrophobicContact CD1-CD1 4.44Å; L226-V245 HydrophobicContact CD1-CG1 4.25Å; L226-I248 HydrophobicContact CD1-CD1 4.38Å; L226-I248 HydrophobicContact CD1-CG2 4.28Å; L226-I249 HydrophobicContact CD2-CD1 4.23Å; L226-W258 HydrophobicContact CD2-CH2 3.88Å; L226-W258 HydrophobicContact CD2-CZ3 3.75Å; L226-F262 HydrophobicContact CB-CE1 4.38Å; L226-F262 HydrophobicContact CB-CZ 4.22Å; L226-F262 HydrophobicContact CD1-CE1 4.34Å
227	P	91.3	Very high	85	Confident	5 Å²	5	61.3 Å²	61.3	3%	0.032	33%	0.326	C	S	.	.	S	Bend	trans	-74.8	45.8	-176.8	31.1	-36.1	0	0	0	113.4	V187 V188 S229 S230 F231 W258 F262	V187-P227 HydrophobicContact CG1-CB 3.65Å; V188-P227 WeakPolarHBondContact O-CD 3.37Å; V188-P227 WeakPolarHBondContact O-CG 3.28Å; P227-S229 VanDerWaalsContact C-N 3.35Å; P227-S229 PolarHBondContact O-N 2.63Å; P227-S230 PolarHBondContact O-N 2.66Å; P227-F231 HydrophobicContact CB-CD2 4.37Å; P227-F231 HydrophobicContact CB-CE2 4.04Å; P227-F231 HydrophobicContact CG-CE2 4.22Å; P227-F231 WeakPolarHBondContact O-CD2 3.16Å; P227-W258 HydrophobicContact CG-CB 4.04Å; P227-W258 HydrophobicContact CG-CD2 3.58Å; P227-W258 HydrophobicContact CG-CE3 4.13Å; P227-W258 HydrophobicContact CG-CG 3.5Å; P227-F262 HydrophobicContact CG-CE2 4.24Å; P227-F262 HydrophobicContact CG-CZ 4.15Å
228	L	85.6	Confident	84.2	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.052	32%	0.322	C	S	.	.	H	α-helix	trans	-64.8	-36.4	-176.6	-72.6	167.4	0	0	0	112.7	L226 S230 F231 V232 M234 L240 F262 L266	L226-L228 HydrophobicContact CB-CG 4.22Å; L226-L228 PolarHBondContact O-N 3.1Å; L228-S230 PolarHBondContact O-N 2.93Å; L228-F231 PolarHBondContact O-N 2.84Å; L228-V232 HydrophobicContact CD2-CG2 4.42Å; L228-V232 WeakPolarHBondContact O-CA 3.28Å; L228-V232 WeakPolarHBondContact O-CB 3.42Å; L228-V232 PolarHBondContact O-N 3.08Å; L228-M234 HydrophobicContact CD1-CE 4.34Å; L228-M234 HydrophobicContact CD2-CE 4.41Å; L228-L240 HydrophobicContact CD1-CD1 3.91Å; L228-L240 HydrophobicContact CD1-CG 4.17Å; L228-L240 HydrophobicContact CD2-CD1 4.24Å; L228-F262 HydrophobicContact CD2-CD1 3.53Å; L228-F262 HydrophobicContact CD2-CD2 4.34Å; L228-F262 HydrophobicContact CD2-CE1 3.33Å; L228-F262 HydrophobicContact CD2-CE2 4.18Å; L228-F262 HydrophobicContact CD2-CG 4.06Å; L228-F262 HydrophobicContact CD2-CZ 3.7Å; L228-F262 HydrophobicContact CG-CE1 4.01Å; L228-F262 HydrophobicContact CG-CZ 4.05Å; L228-L266 HydrophobicContact CD2-CD1 4.2Å
229	S	79	Confident	83.9	Confident	51 Å²	51	55.6 Å²	55.6	36%	0.357	30%	0.303	S	S	.	.	H	α-helix	trans	-62.6	-31.3	-178.7	43.1	0	0	0	0	113.4	P227 I275	P227-S229 VanDerWaalsContact C-N 3.35Å; P227-S229 PolarHBondContact O-N 2.63Å; S229-I275 WeakPolarHBondContact O-CD1 3.47Å
230	S	76.9	Confident	83.7	Confident	63 Å²	63	53.5 Å²	53.5	44%	0.441	29%	0.292	S	S	.	.	H	α-helix	trans	-77.6	-27.4	-175.1	-50.1	0	0	0	0	112.3	P227 L228	P227-S230 PolarHBondContact O-N 2.66Å; L228-S230 PolarHBondContact O-N 2.93Å
231	F	71.6	Confident	83.6	Confident	45 Å²	45	52.6 Å²	52.6	20%	0.197	28%	0.28	C	S	.	.	H	α-helix	trans	-120.8	-17.5	-170.5	-55.9	-69.3	0	0	0	114	P227 L228 W258 Q259 F262	P227-F231 HydrophobicContact CB-CD2 4.37Å; P227-F231 HydrophobicContact CB-CE2 4.04Å; P227-F231 HydrophobicContact CG-CE2 4.22Å; P227-F231 WeakPolarHBondContact O-CD2 3.16Å; L228-F231 PolarHBondContact O-N 2.84Å; F231-W258 HydrophobicContact CD2-CB 3.96Å; F231-W258 HydrophobicContact CE2-CB 3.71Å; F231-W258 HydrophobicContact CE2-CG 4.42Å; F231-W258 HydrophobicContact CZ-CB 4.42Å; F231-Q259 HydrophobicContact CB-CB 4.36Å; F231-Q259 HydrophobicContact CB-CG 4.47Å; F231-Q259 HydrophobicContact CD1-CB 3.85Å; F231-Q259 HydrophobicContact CD1-CG 4.33Å; F231-Q259 HydrophobicContact CE1-CB 4.42Å; F231-Q259 HydrophobicContact CG-CB 4.15Å; F231-F262 HydrophobicContact CB-CD2 4.11Å; F231-F262 HydrophobicContact CB-CE2 4.46Å; F231-F262 HydrophobicContact CD2-CD2 4.3Å; F231-F262 AromaticContact CD2-CE2 3.92Å; F231-F262 HydrophobicContact CD2-CE2 3.92Å
232	V	69.9	Low	83.6	Confident	4 Å²	4	52.1 Å²	52.1	2%	0.024	28%	0.278	C	S	.	.			trans	-135.2	108.6	-169.5	-165.8	0	0	0	0	111.5	L228 M234 F262 L266 A272	L228-V232 HydrophobicContact CD2-CG2 4.42Å; L228-V232 WeakPolarHBondContact O-CA 3.28Å; L228-V232 WeakPolarHBondContact O-CB 3.42Å; L228-V232 PolarHBondContact O-N 3.08Å; V232-M234 HydrophobicContact CG1-CG 3.52Å; V232-M234 HydrophobicContact CG1-SD 4.25Å; V232-M234 PolarHBondContact O-N 2.97Å; V232-F262 HydrophobicContact CG2-CB 3.87Å; V232-F262 HydrophobicContact CG2-CD2 3.92Å; V232-F262 HydrophobicContact CG2-CG 4.03Å; V232-L266 HydrophobicContact CG1-CD1 4.44Å; V232-L266 HydrophobicContact CG2-CD1 4.46Å; V232-A272 HydrophobicContact CG1-CB 3.52Å
233	K	68.8	Low	83.5	Confident	149 Å²	149	51.3 Å²	51.3	65%	0.648	26%	0.264	S	S	*	.			trans	-82.8	96.4	168.4	-168.3	173.9	-177.1	175.8	0	110.2	I273	K233-I273 PolarHBondContact N-O 3.22Å
234	M	68.1	Low	83.4	Confident	25 Å²	25	51.6 Å²	51.6	12%	0.123	27%	0.266	C	S	.	.			trans	-97.9	132.6	175.3	-65.9	-170.5	-78.7	0	0	111.6	L228 V232 S236 K238 K270	L228-M234 HydrophobicContact CD1-CE 4.34Å; L228-M234 HydrophobicContact CD2-CE 4.41Å; V232-M234 HydrophobicContact CG1-CG 3.52Å; V232-M234 HydrophobicContact CG1-SD 4.25Å; V232-M234 PolarHBondContact O-N 2.97Å; M234-S236 PolarHBondContact O-N 2.97Å; M234-K238 HydrophobicContact CE-CG 4.4Å; M234-K270 HydrophobicContact SD-CB 4.4Å; M234-K270 HydrophobicContact SD-CD 4.44Å
235	N	65.4	Low	83.3	Confident	169 Å²	169	52.2 Å²	52.2	90%	0.904	27%	0.269	S	S	*	.	S	Bend	trans	-74.1	-6.5	165.8	-75.7	-3.3	0	0	0	112.7
236	S	70.3	Confident	83.4	Confident	54 Å²	54	50.4 Å²	50.4	38%	0.378	26%	0.26	S	S	.	.	S	Bend	trans	-107.7	167.5	-179.7	72.6	0	0	0	0	111.4	M234	M234-S236 PolarHBondContact O-N 2.97Å
237	R	77.2	Confident	83.5	Confident	177 Å²	177	51 Å²	51	67%	0.668	26%	0.262	S	S	*	.			trans	-57.2	141.6	-179.8	-61.2	176.4	-172.3	149.1	1.9	110.9	V239	R237-V239 PolarHBondContact O-N 3.26Å
238	K	81.6	Confident	83.7	Confident	104 Å²	104	50.8 Å²	50.8	45%	0.452	26%	0.261	S	S	.	.	S	Bend	trans	-75.7	15.3	178.4	-63.3	-179.2	178.3	176.9	0	114.2	M234	M234-K238 HydrophobicContact CE-CG 4.4Å
239	V	87.9	Confident	84.2	Confident	53 Å²	53	50.3 Å²	50.3	32%	0.321	26%	0.258	S	S	.	.	P	Polyproline II helix	trans	-95	121	179.6	-174.2	0	0	0	0	108.9	N206 R237	N206-V239 WeakPolarHBondContact OD1-CG2 3.46Å; R237-V239 PolarHBondContact O-N 3.26Å
240	L	91.3	Very high	84.9	Confident	27 Å²	27	48.5 Å²	48.5	14%	0.141	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-100.7	159.7	-177.8	-60.4	-175.7	0	0	0	111.1	L226 L228 H244 V245 I248 L266	L226-L240 HydrophobicContact CD1-CD1 4.44Å; L228-L240 HydrophobicContact CD1-CD1 3.91Å; L228-L240 HydrophobicContact CD1-CG 4.17Å; L228-L240 HydrophobicContact CD2-CD1 4.24Å; L240-H244 HydrophobicContact CB-CB 4.34Å; L240-V245 HydrophobicContact CB-CG2 3.83Å; L240-I248 HydrophobicContact CD1-CD1 3.49Å; L240-I248 VanDerWaalsContact CD1-CD1 3.49Å; L240-L266 HydrophobicContact CD1-CD2 4.12Å; L240-L266 HydrophobicContact CD2-CD2 3.67Å
241	A	93.4	Very high	85.8	Confident	27 Å²	27	45.8 Å²	45.8	22%	0.223	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-79.1	157.2	173.5	0	0	0	0	0	110	N243 H244 V245	A241-N243 VanDerWaalsContact C-N 3.3Å; A241-N243 PolarHBondContact O-N 3.05Å; A241-H244 WeakPolarHBondContact CB-ND1 3.35Å; A241-H244 WeakPolarHBondContact O-CB 3.24Å; A241-H244 PolarHBondContact O-N 2.88Å; A241-V245 PolarHBondContact O-N 2.74Å; A241-V245 VanDerWaalsContact O-N 3.08Å
242	V	95.8	Very high	86.9	Confident	4 Å²	4	45 Å²	45	2%	0.024	22%	0.223	C	C	.	.	H	α-helix	trans	-51.8	-48.5	-177.9	-178.3	0	0	0	0	111.6	V99 L115 Q118 I199 G200 H244 V245 F246	V99-V242 HydrophobicContact CG1-CG1 4.24Å; V99-V242 HydrophobicContact CG2-CG1 4.17Å; L115-V242 HydrophobicContact CD1-CG2 3.91Å; Q118-V242 HydrophobicContact CB-CB 4.46Å; I199-V242 HydrophobicContact CG2-CB 4.47Å; I199-V242 HydrophobicContact CG2-CG1 3.92Å; G200-V242 WeakPolarHBondContact O-CG2 3.45Å; V242-H244 VanDerWaalsContact C-N 3.33Å; V242-H244 PolarHBondContact O-N 3.04Å; V242-V245 PolarHBondContact O-N 2.83Å; V242-F246 WeakPolarHBondContact O-CB 3.34Å; V242-F246 PolarHBondContact O-N 2.66Å
243	N	95.6	Very high	88	Confident	21 Å²	21	46.4 Å²	46.4	11%	0.112	23%	0.229	C	C	.	.	H	α-helix	trans	-65.3	-34	179.7	74	-73.9	0	0	0	113.1	Q118 R121 A241 F246 E247	Q118-N243 HydrophobicContact CB-CB 4.08Å; Q118-N243 HydrophobicContact CG-CB 4.31Å; R121-N243 HydrophobicContact CB-CB 4.24Å; R121-N243 HydrophobicContact CG-CB 4Å; A241-N243 VanDerWaalsContact C-N 3.3Å; A241-N243 PolarHBondContact O-N 3.05Å; N243-F246 PolarHBondContact O-N 2.98Å; N243-E247 PolarHBondContact ND2-OE1 3.01Å; N243-E247 VanDerWaalsContact O-CB 3.25Å; N243-E247 WeakPolarHBondContact O-CB 3.4Å; N243-E247 WeakPolarHBondContact O-CG 3.5Å; N243-E247 PolarHBondContact O-N 3.46Å
244	H	94.4	Very high	89.1	Confident	37 Å²	37	44.4 Å²	44.4	17%	0.171	22%	0.222	C	C	.	.	H	α-helix	trans	-69.2	-41.8	178	-63.2	128.4	0	0	0	111	L240 A241 V242 F246 E247 I248 V265	L240-H244 HydrophobicContact CB-CB 4.34Å; A241-H244 WeakPolarHBondContact CB-ND1 3.35Å; A241-H244 WeakPolarHBondContact O-CB 3.24Å; A241-H244 PolarHBondContact O-N 2.88Å; V242-H244 VanDerWaalsContact C-N 3.33Å; V242-H244 PolarHBondContact O-N 3.04Å; H244-F246 VanDerWaalsContact C-N 3.32Å; H244-E247 PolarHBondContact O-N 3.06Å; H244-I248 WeakPolarHBondContact O-CB 3.16Å; H244-I248 VanDerWaalsContact O-CD1 3.29Å; H244-I248 WeakPolarHBondContact O-CD1 3.42Å; H244-I248 WeakPolarHBondContact O-CG1 3.45Å; H244-I248 PolarHBondContact O-N 3.02Å; H244-V265 HydrophobicContact CB-CG1 4.28Å
245	V	95.8	Very high	90.1	Very high	20 Å²	20	47 Å²	47	12%	0.121	23%	0.233	C	C	.	.	H	α-helix	trans	-60.2	-47	175.1	178	0	0	0	0	109.7	L180 I199 L226 L240 A241 V242 I248 I249	L180-V245 HydrophobicContact CD1-CG1 4.07Å; I199-V245 HydrophobicContact CD1-CB 4.17Å; I199-V245 HydrophobicContact CD1-CG1 3.7Å; I199-V245 HydrophobicContact CG1-CG1 3.86Å; I199-V245 HydrophobicContact CG2-CB 4.35Å; I199-V245 HydrophobicContact CG2-CG1 4.31Å; L226-V245 HydrophobicContact CD1-CG1 4.25Å; L240-V245 HydrophobicContact CB-CG2 3.83Å; A241-V245 PolarHBondContact O-N 2.74Å; A241-V245 VanDerWaalsContact O-N 3.08Å; V242-V245 PolarHBondContact O-N 2.83Å; V245-I248 PolarHBondContact O-N 3.13Å; V245-I249 WeakPolarHBondContact O-CG1 3.48Å; V245-I249 PolarHBondContact O-N 3.33Å; V245-I249 VanDerWaalsContact O-N 3.09Å
246	F	97.1	Very high	91.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-60.1	-49.3	177.9	-163.2	-78	0	0	0	112.6	L97 C122 N126 V133 F135 I199 V242 N243 H244 I248 I249 L250	L97-F246 HydrophobicContact CB-CE2 4.29Å; L97-F246 HydrophobicContact CD2-CD1 4.34Å; L97-F246 HydrophobicContact CD2-CD2 3.34Å; L97-F246 HydrophobicContact CD2-CE1 4.38Å; L97-F246 HydrophobicContact CD2-CE2 3.4Å; L97-F246 HydrophobicContact CD2-CG 3.85Å; L97-F246 HydrophobicContact CD2-CZ 3.94Å; L97-F246 HydrophobicContact CG-CD2 3.94Å; L97-F246 HydrophobicContact CG-CE2 3.84Å; C122-F246 HydrophobicContact CB-CB 4.29Å; C122-F246 HydrophobicContact CB-CD1 3.77Å; C122-F246 HydrophobicContact CB-CD2 3.87Å; C122-F246 HydrophobicContact CB-CE1 4Å; C122-F246 HydrophobicContact CB-CE2 4.1Å; C122-F246 HydrophobicContact CB-CG 3.71Å; C122-F246 HydrophobicContact CB-CZ 4.17Å; C122-F246 WeakPolarHBondContact O-CE1 3.49Å; C122-F246 VanDerWaalsContact SG-CB 3.57Å; N126-F246 HydrophobicContact CB-CE1 3.96Å; N126-F246 HydrophobicContact CB-CZ 4.19Å; V133-F246 HydrophobicContact CG2-CZ 3.97Å; F135-F246 HydrophobicContact CB-CZ 4.33Å; F135-F246 HydrophobicContact CD1-CE2 4.3Å; F135-F246 HydrophobicContact CD1-CZ 4.06Å; F135-F246 AromaticContact CD2-CE2 3.53Å; F135-F246 HydrophobicContact CD2-CE2 3.53Å; F135-F246 AromaticContact CD2-CZ 3.99Å; F135-F246 HydrophobicContact CD2-CZ 3.99Å; F135-F246 HydrophobicContact CE1-CE2 4.37Å; F135-F246 HydrophobicContact CE1-CZ 4.38Å; F135-F246 HydrophobicContact CE2-CD2 4.43Å; F135-F246 AromaticContact CE2-CE2 3.66Å; F135-F246 HydrophobicContact CE2-CE2 3.66Å; F135-F246 HydrophobicContact CE2-CZ 4.37Å; F135-F246 AromaticContact CG-CE2 3.91Å; F135-F246 HydrophobicContact CG-CE2 3.91Å; F135-F246 AromaticContact CG-CZ 3.87Å; F135-F246 HydrophobicContact CG-CZ 3.87Å; F135-F246 HydrophobicContact CZ-CE2 4.08Å; I199-F246 HydrophobicContact CD1-CB 4.14Å; I199-F246 HydrophobicContact CD1-CD2 4.14Å; V242-F246 WeakPolarHBondContact O-CB 3.34Å; V242-F246 PolarHBondContact O-N 2.66Å; N243-F246 PolarHBondContact O-N 2.98Å; H244-F246 VanDerWaalsContact C-N 3.32Å; F246-I248 VanDerWaalsContact C-N 3.3Å; F246-I248 PolarHBondContact O-N 3.41Å; F246-I249 PolarHBondContact O-N 3.02Å; F246-L250 HydrophobicContact CD1-CD1 3.85Å; F246-L250 HydrophobicContact CD1-CG 4.17Å; F246-L250 HydrophobicContact CE1-CD1 3.7Å; F246-L250 HydrophobicContact CE1-CD2 4.42Å; F246-L250 HydrophobicContact CE1-CG 4.08Å; F246-L250 PolarHBondContact O-N 3.29Å; F246-L250 VanDerWaalsContact O-N 3.14Å
247	E	95.9	Very high	92.4	Very high	26 Å²	26	41 Å²	41	12%	0.121	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-35.6	178.2	-73.7	173.5	-121.4	0	0	111.5	R121 E125 N243 H244 L250 A251 V265	R121-E247 VanDerWaalsContact CG-OE1 3.23Å; R121-E247 WeakPolarHBondContact CG-OE1 3.44Å; R121-E247 IonicContact CZ-OE1 3.17Å; R121-E247 IonicContact CZ-OE2 3.6Å; R121-E247 IonicContact NE-OE1 2.92Å; R121-E247 PolarHBondContact NE-OE1 2.94Å; R121-E247 VanDerWaalsContact NE-OE1 3.13Å; R121-E247 IonicContact NE-OE2 3.46Å; R121-E247 IonicContact NH2-OE1 4Å; R121-E247 IonicContact NH2-OE2 2.84Å; R121-E247 PolarHBondContact NH2-OE2 3.04Å; E125-E247 HydrophobicContact CB-CG 4.36Å; E125-E247 HydrophobicContact CG-CG 4.17Å; N243-E247 PolarHBondContact ND2-OE1 3.01Å; N243-E247 VanDerWaalsContact O-CB 3.25Å; N243-E247 WeakPolarHBondContact O-CB 3.4Å; N243-E247 WeakPolarHBondContact O-CG 3.5Å; N243-E247 PolarHBondContact O-N 3.46Å; H244-E247 PolarHBondContact O-N 3.06Å; E247-L250 PolarHBondContact O-N 3.37Å; E247-A251 WeakPolarHBondContact O-CB 3.47Å; E247-A251 PolarHBondContact O-N 3.44Å; E247-V265 HydrophobicContact CB-CB 4.4Å; E247-V265 HydrophobicContact CB-CG1 3.57Å; E247-V265 HydrophobicContact CB-CG2 3.88Å
248	I	95.6	Very high	93	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-64.5	-44.4	175.4	-74.6	160	0	0	0	111	L226 L240 H244 V245 F246 L250 A251 Y252 W258 A261 F262 V265 L266	L226-I248 HydrophobicContact CD1-CD1 4.38Å; L226-I248 HydrophobicContact CD1-CG2 4.28Å; L240-I248 HydrophobicContact CD1-CD1 3.49Å; L240-I248 VanDerWaalsContact CD1-CD1 3.49Å; H244-I248 WeakPolarHBondContact O-CB 3.16Å; H244-I248 VanDerWaalsContact O-CD1 3.29Å; H244-I248 WeakPolarHBondContact O-CD1 3.42Å; H244-I248 WeakPolarHBondContact O-CG1 3.45Å; H244-I248 PolarHBondContact O-N 3.02Å; V245-I248 PolarHBondContact O-N 3.13Å; F246-I248 VanDerWaalsContact C-N 3.3Å; F246-I248 PolarHBondContact O-N 3.41Å; I248-L250 VanDerWaalsContact C-N 3.33Å; I248-L250 PolarHBondContact O-N 2.86Å; I248-A251 PolarHBondContact O-N 3.27Å; I248-Y252 WeakPolarHBondContact O-CB 3.26Å; I248-Y252 PolarHBondContact O-N 3.49Å; I248-W258 HydrophobicContact CG2-CE3 4.16Å; I248-W258 HydrophobicContact CG2-CZ3 3.82Å; I248-A261 HydrophobicContact CG2-CB 4.35Å; I248-F262 HydrophobicContact CD1-CD1 3.73Å; I248-F262 HydrophobicContact CD1-CE1 3.95Å; I248-F262 HydrophobicContact CG1-CD1 4.04Å; I248-F262 HydrophobicContact CG1-CE1 4.41Å; I248-F262 HydrophobicContact CG2-CD1 3.94Å; I248-F262 HydrophobicContact CG2-CE1 3.68Å; I248-V265 HydrophobicContact CG1-CB 3.83Å; I248-V265 HydrophobicContact CG1-CG1 3.92Å; I248-V265 HydrophobicContact CG1-CG2 4.14Å; I248-L266 HydrophobicContact CD1-CD2 4.3Å
249	I	96	Very high	93.4	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61	-44.5	178.5	-64.8	-63.8	0	0	0	110.5	L95 L97 L180 L191 L226 V245 F246 Y252 L253 W258	L95-I249 HydrophobicContact CD2-CG2 4.3Å; L97-I249 HydrophobicContact CD2-CB 4.17Å; L97-I249 HydrophobicContact CD2-CG2 4.01Å; L180-I249 HydrophobicContact CD1-CD1 4.22Å; L180-I249 HydrophobicContact CD1-CG1 4.48Å; L191-I249 HydrophobicContact CD1-CD1 3.73Å; L191-I249 HydrophobicContact CD1-CG2 3.77Å; L191-I249 HydrophobicContact CD2-CD1 3.98Å; L191-I249 HydrophobicContact CG-CD1 4.47Å; L226-I249 HydrophobicContact CD2-CD1 4.23Å; V245-I249 WeakPolarHBondContact O-CG1 3.48Å; V245-I249 PolarHBondContact O-N 3.33Å; V245-I249 VanDerWaalsContact O-N 3.09Å; F246-I249 PolarHBondContact O-N 3.02Å; I249-Y252 PolarHBondContact O-N 2.88Å; I249-L253 HydrophobicContact CG2-CD1 4.48Å; I249-L253 WeakPolarHBondContact O-CG 3.38Å; I249-L253 PolarHBondContact O-N 2.91Å; I249-W258 HydrophobicContact CD1-CH2 4.01Å; I249-W258 HydrophobicContact CD1-CZ3 4.36Å
250	L	95.1	Very high	93.4	Very high	13 Å²	13	33.9 Å²	33.9	7%	0.068	19%	0.185	C	C	.	.	H	α-helix	trans	-61.3	-45.7	175.4	-67.7	179.1	0	0	0	112.4	E125 A129 V133 F246 E247 I248 Y252 L253 E254	E125-L250 HydrophobicContact CB-CD1 4.25Å; A129-L250 HydrophobicContact CB-CD1 4.17Å; A129-L250 HydrophobicContact CB-CD2 3.97Å; A129-L250 HydrophobicContact CB-CG 4.48Å; V133-L250 HydrophobicContact CG1-CD2 3.93Å; V133-L250 HydrophobicContact CG2-CD2 4.09Å; F246-L250 HydrophobicContact CD1-CD1 3.85Å; F246-L250 HydrophobicContact CD1-CG 4.17Å; F246-L250 HydrophobicContact CE1-CD1 3.7Å; F246-L250 HydrophobicContact CE1-CD2 4.42Å; F246-L250 HydrophobicContact CE1-CG 4.08Å; F246-L250 PolarHBondContact O-N 3.29Å; F246-L250 VanDerWaalsContact O-N 3.14Å; E247-L250 PolarHBondContact O-N 3.37Å; I248-L250 VanDerWaalsContact C-N 3.33Å; I248-L250 PolarHBondContact O-N 2.86Å; L250-Y252 VanDerWaalsContact C-N 3.29Å; L250-Y252 PolarHBondContact O-N 3.45Å; L250-L253 PolarHBondContact O-N 3.33Å; L250-E254 PolarHBondContact O-N 2.85Å; L250-E254 VanDerWaalsContact O-N 3.09Å
251	A	94.4	Very high	93.5	Very high	7 Å²	7	32.6 Å²	32.6	6%	0.058	18%	0.178	C	C	.	.	H	α-helix	trans	-66	-33.1	179	0	0	0	0	0	112.1	E247 I248 E254 K255 A261 V265	E247-A251 WeakPolarHBondContact O-CB 3.47Å; E247-A251 PolarHBondContact O-N 3.44Å; I248-A251 PolarHBondContact O-N 3.27Å; A251-E254 PolarHBondContact O-N 3.35Å; A251-K255 VanDerWaalsContact O-CB 3.3Å; A251-K255 WeakPolarHBondContact O-CB 3.4Å; A251-K255 VanDerWaalsContact O-CG 3.32Å; A251-K255 WeakPolarHBondContact O-CG 3.43Å; A251-K255 PolarHBondContact O-N 2.9Å; A251-A261 HydrophobicContact CB-CB 3.86Å; A251-V265 HydrophobicContact CB-CG2 4.11Å
252	Y	94.7	Very high	93.3	Very high	29 Å²	29	31.3 Å²	31.3	11%	0.114	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-43.9	173.5	179.4	-95.2	0	0	0	111.4	L191 I248 I249 L250 E254 K255 G256 W258	L191-Y252 HydrophobicContact CB-CD1 4.41Å; L191-Y252 HydrophobicContact CB-CE1 4.15Å; L191-Y252 HydrophobicContact CD1-CD1 3.58Å; L191-Y252 HydrophobicContact CD1-CE1 4.14Å; L191-Y252 HydrophobicContact CD1-CG 4.42Å; L191-Y252 HydrophobicContact CG-CD1 3.86Å; L191-Y252 HydrophobicContact CG-CE1 3.92Å; I248-Y252 WeakPolarHBondContact O-CB 3.26Å; I248-Y252 PolarHBondContact O-N 3.49Å; I249-Y252 PolarHBondContact O-N 2.88Å; L250-Y252 VanDerWaalsContact C-N 3.29Å; L250-Y252 PolarHBondContact O-N 3.45Å; Y252-E254 PolarHBondContact O-N 3.49Å; Y252-K255 PolarHBondContact O-N 2.92Å; Y252-G256 WeakPolarHBondContact O-CA 3.43Å; Y252-G256 PolarHBondContact O-N 3.24Å; Y252-W258 HydrophobicContact CD1-CH2 4.38Å; Y252-W258 HydrophobicContact CD1-CZ2 4.17Å; Y252-W258 HydrophobicContact CD2-CB 4.47Å; Y252-W258 AromaticContact CD2-CD2 3.46Å; Y252-W258 HydrophobicContact CD2-CD2 3.46Å; Y252-W258 VanDerWaalsContact CD2-CD2 3.46Å; Y252-W258 AromaticContact CD2-CE2 3.53Å; Y252-W258 AromaticContact CD2-CE3 3.84Å; Y252-W258 HydrophobicContact CD2-CE3 3.84Å; Y252-W258 AromaticContact CD2-CG 3.78Å; Y252-W258 HydrophobicContact CD2-CG 3.78Å; Y252-W258 HydrophobicContact CD2-CH2 4.29Å; Y252-W258 AromaticContact CD2-CZ2 3.95Å; Y252-W258 HydrophobicContact CD2-CZ2 3.95Å; Y252-W258 HydrophobicContact CD2-CZ3 4.24Å; Y252-W258 AromaticContact CD2-NE1 3.87Å; Y252-W258 HydrophobicContact CE1-CZ2 4.18Å; Y252-W258 AromaticContact CE2-CD1 3.46Å; Y252-W258 VanDerWaalsContact CE2-CD1 3.46Å; Y252-W258 AromaticContact CE2-CD2 3.68Å; Y252-W258 HydrophobicContact CE2-CD2 3.68Å; Y252-W258 AromaticContact CE2-CE2 3.38Å; Y252-W258 HydrophobicContact CE2-CE3 4.49Å; Y252-W258 AromaticContact CE2-CG 3.71Å; Y252-W258 HydrophobicContact CE2-CG 3.71Å; Y252-W258 AromaticContact CE2-CZ2 3.96Å; Y252-W258 HydrophobicContact CE2-CZ2 3.96Å; Y252-W258 AromaticContact CE2-NE1 3.25Å; Y252-W258 HydrophobicContact CG-CD2 4.2Å; Y252-W258 HydrophobicContact CG-CE3 4.23Å; Y252-W258 HydrophobicContact CG-CH2 4.09Å; Y252-W258 HydrophobicContact CG-CZ2 4.04Å; Y252-W258 HydrophobicContact CG-CZ3 4.18Å; Y252-W258 AromaticContact CZ-CE2 3.85Å; Y252-W258 AromaticContact CZ-NE1 3.66Å
253	L	93	Very high	92.9	Very high	32 Å²	32	35.3 Å²	35.3	17%	0.168	19%	0.185	C	C	.	.	H	α-helix	trans	-61.9	-34	176.3	-70.6	173	0	0	0	112.4	L95 H131 V133 I249 L250	L95-L253 HydrophobicContact CD1-CD2 4.49Å; H131-L253 HydrophobicContact CB-CB 4.29Å; H131-L253 PolarHBondContact CD2-O 3.46Å; H131-L253 VanDerWaalsContact CD2-O 3.24Å; V133-L253 HydrophobicContact CG1-CD1 3.39Å; I249-L253 HydrophobicContact CG2-CD1 4.48Å; I249-L253 WeakPolarHBondContact O-CG 3.38Å; I249-L253 PolarHBondContact O-N 2.91Å; L250-L253 PolarHBondContact O-N 3.33Å
254	E	91.6	Very high	92.5	Very high	107 Å²	107	38.3 Å²	38.3	50%	0.5	20%	0.204	S	C	.	.	H	α-helix	trans	-74.9	-37.9	177.1	179.9	171	-150.5	0	0	113.4	S130 L250 A251 Y252	S130-E254 PolarHBondContact OG-OE1 3.45Å; L250-E254 PolarHBondContact O-N 2.85Å; L250-E254 VanDerWaalsContact O-N 3.09Å; A251-E254 PolarHBondContact O-N 3.35Å; Y252-E254 PolarHBondContact O-N 3.49Å
255	K	91.2	Very high	92.2	Very high	81 Å²	81	37.5 Å²	37.5	35%	0.352	20%	0.201	S	C	.	.	H	α-helix	trans	-106.7	-19.4	-167.9	-62.6	176.7	160.4	-137	0	114.5	A251 Y252 S257 E260 T264	A251-K255 VanDerWaalsContact O-CB 3.3Å; A251-K255 WeakPolarHBondContact O-CB 3.4Å; A251-K255 VanDerWaalsContact O-CG 3.32Å; A251-K255 WeakPolarHBondContact O-CG 3.43Å; A251-K255 PolarHBondContact O-N 2.9Å; Y252-K255 PolarHBondContact O-N 2.92Å; K255-S257 PolarHBondContact O-N 2.83Å; K255-S257 VanDerWaalsContact O-N 3.16Å; K255-E260 HydrophobicContact CB-CB 4.47Å; K255-E260 HydrophobicContact CD-CB 3.68Å; K255-E260 WeakPolarHBondContact CD-OE2 3.45Å; K255-E260 IonicContact NZ-OE2 3.13Å; K255-E260 PolarHBondContact NZ-OE2 2.81Å; K255-E260 VanDerWaalsContact NZ-OE2 3.15Å; K255-T264 WeakPolarHBondContact CE-OG1 3.47Å; K255-T264 PolarHBondContact NZ-OG1 2.93Å
256	G	90	Very high	91.5	Very high	56 Å²	56	37 Å²	37	58%	0.577	20%	0.198	S	C	*	.	S	Bend	trans	66	8.5	-173.1	0	0	0	0	0	114.8	Y252	Y252-G256 WeakPolarHBondContact O-CA 3.43Å; Y252-G256 PolarHBondContact O-N 3.24Å
257	S	92.1	Very high	90.1	Very high	39 Å²	39	38.8 Å²	38.8	27%	0.273	21%	0.209	S	C	.	.			trans	-132.3	123	-176.7	175	0	0	0	0	112	K255 Q259 E260 A261	K255-S257 PolarHBondContact O-N 2.83Å; K255-S257 VanDerWaalsContact O-N 3.16Å; S257-Q259 VanDerWaalsContact C-N 3.33Å; S257-Q259 PolarHBondContact O-N 3.45Å; S257-E260 PolarHBondContact O-N 3.26Å; S257-A261 WeakPolarHBondContact O-CB 3.41Å; S257-A261 PolarHBondContact O-N 3.37Å
258	W	91.4	Very high	88.5	Confident	15 Å²	15	46.6 Å²	46.6	6%	0.057	25%	0.246	C	C	.	.	H	α-helix	trans	-61	-41.8	176.1	-74.8	112.1	0	0	0	112.4	V188 E189 L191 L226 P227 F231 I248 I249 Y252 E260 A261 F262	V188-W258 HydrophobicContact CG1-CH2 3.79Å; V188-W258 HydrophobicContact CG1-CZ2 3.3Å; E189-W258 PolarHBondContact O-NE1 2.97Å; L191-W258 HydrophobicContact CD1-CH2 4.23Å; L191-W258 HydrophobicContact CD2-CH2 4.03Å; L191-W258 HydrophobicContact CD2-CZ2 4.15Å; L191-W258 HydrophobicContact CG-CH2 4.05Å; L191-W258 HydrophobicContact CG-CZ2 4Å; L226-W258 HydrophobicContact CD2-CH2 3.88Å; L226-W258 HydrophobicContact CD2-CZ3 3.75Å; P227-W258 HydrophobicContact CG-CB 4.04Å; P227-W258 HydrophobicContact CG-CD2 3.58Å; P227-W258 HydrophobicContact CG-CE3 4.13Å; P227-W258 HydrophobicContact CG-CG 3.5Å; F231-W258 HydrophobicContact CD2-CB 3.96Å; F231-W258 HydrophobicContact CE2-CB 3.71Å; F231-W258 HydrophobicContact CE2-CG 4.42Å; F231-W258 HydrophobicContact CZ-CB 4.42Å; I248-W258 HydrophobicContact CG2-CE3 4.16Å; I248-W258 HydrophobicContact CG2-CZ3 3.82Å; I249-W258 HydrophobicContact CD1-CH2 4.01Å; I249-W258 HydrophobicContact CD1-CZ3 4.36Å; Y252-W258 HydrophobicContact CD1-CH2 4.38Å; Y252-W258 HydrophobicContact CD1-CZ2 4.17Å; Y252-W258 HydrophobicContact CD2-CB 4.47Å; Y252-W258 AromaticContact CD2-CD2 3.46Å; Y252-W258 HydrophobicContact CD2-CD2 3.46Å; Y252-W258 VanDerWaalsContact CD2-CD2 3.46Å; Y252-W258 AromaticContact CD2-CE2 3.53Å; Y252-W258 AromaticContact CD2-CE3 3.84Å; Y252-W258 HydrophobicContact CD2-CE3 3.84Å; Y252-W258 AromaticContact CD2-CG 3.78Å; Y252-W258 HydrophobicContact CD2-CG 3.78Å; Y252-W258 HydrophobicContact CD2-CH2 4.29Å; Y252-W258 AromaticContact CD2-CZ2 3.95Å; Y252-W258 HydrophobicContact CD2-CZ2 3.95Å; Y252-W258 HydrophobicContact CD2-CZ3 4.24Å; Y252-W258 AromaticContact CD2-NE1 3.87Å; Y252-W258 HydrophobicContact CE1-CZ2 4.18Å; Y252-W258 AromaticContact CE2-CD1 3.46Å; Y252-W258 VanDerWaalsContact CE2-CD1 3.46Å; Y252-W258 AromaticContact CE2-CD2 3.68Å; Y252-W258 HydrophobicContact CE2-CD2 3.68Å; Y252-W258 AromaticContact CE2-CE2 3.38Å; Y252-W258 HydrophobicContact CE2-CE3 4.49Å; Y252-W258 AromaticContact CE2-CG 3.71Å; Y252-W258 HydrophobicContact CE2-CG 3.71Å; Y252-W258 AromaticContact CE2-CZ2 3.96Å; Y252-W258 HydrophobicContact CE2-CZ2 3.96Å; Y252-W258 AromaticContact CE2-NE1 3.25Å; Y252-W258 HydrophobicContact CG-CD2 4.2Å; Y252-W258 HydrophobicContact CG-CE3 4.23Å; Y252-W258 HydrophobicContact CG-CH2 4.09Å; Y252-W258 HydrophobicContact CG-CZ2 4.04Å; Y252-W258 HydrophobicContact CG-CZ3 4.18Å; Y252-W258 AromaticContact CZ-CE2 3.85Å; Y252-W258 AromaticContact CZ-NE1 3.66Å; W258-E260 PolarHBondContact O-N 3Å; W258-A261 PolarHBondContact O-N 3.15Å; W258-F262 HydrophobicContact CB-CD2 4.36Å; W258-F262 HydrophobicContact CB-CE2 3.84Å; W258-F262 HydrophobicContact CB-CZ 4.46Å; W258-F262 HydrophobicContact CE3-CE1 4.31Å; W258-F262 HydrophobicContact CE3-CE2 4.36Å; W258-F262 AromaticContact CE3-CZ 3.85Å; W258-F262 HydrophobicContact CE3-CZ 3.85Å; W258-F262 WeakPolarHBondContact O-CD2 3.47Å; W258-F262 VanDerWaalsContact O-CG 3.25Å; W258-F262 WeakPolarHBondContact O-CG 3.47Å; W258-F262 PolarHBondContact O-N 3.25Å
259	Q	88.6	Confident	86.4	Confident	72 Å²	72	57.4 Å²	57.4	34%	0.336	29%	0.287	S	S	.	.	H	α-helix	trans	-56.8	-55.5	179.5	-175.3	177.4	-5.9	0	0	109.8	F231 S257 A261 F262 F263	F231-Q259 HydrophobicContact CB-CB 4.36Å; F231-Q259 HydrophobicContact CB-CG 4.47Å; F231-Q259 HydrophobicContact CD1-CB 3.85Å; F231-Q259 HydrophobicContact CD1-CG 4.33Å; F231-Q259 HydrophobicContact CE1-CB 4.42Å; F231-Q259 HydrophobicContact CG-CB 4.15Å; S257-Q259 VanDerWaalsContact C-N 3.33Å; S257-Q259 PolarHBondContact O-N 3.45Å; Q259-A261 VanDerWaalsContact C-N 3.31Å; Q259-A261 PolarHBondContact O-N 2.72Å; Q259-F262 PolarHBondContact O-N 2.83Å; Q259-F263 HydrophobicContact CG-CD2 3.86Å; Q259-F263 HydrophobicContact CG-CE2 3.74Å; Q259-F263 WeakPolarHBondContact O-CD2 3.41Å; Q259-F263 PolarHBondContact O-N 3.12Å
260	E	89.4	Confident	84.4	Confident	99 Å²	99	59.7 Å²	59.7	46%	0.463	30%	0.297	S	S	.	.	H	α-helix	trans	-63.6	-37.1	-179.6	-64.8	-162.1	-166.8	0	0	113.2	K255 S257 W258 F262 F263 T264	K255-E260 HydrophobicContact CB-CB 4.47Å; K255-E260 HydrophobicContact CD-CB 3.68Å; K255-E260 WeakPolarHBondContact CD-OE2 3.45Å; K255-E260 IonicContact NZ-OE2 3.13Å; K255-E260 PolarHBondContact NZ-OE2 2.81Å; K255-E260 VanDerWaalsContact NZ-OE2 3.15Å; S257-E260 PolarHBondContact O-N 3.26Å; W258-E260 PolarHBondContact O-N 3Å; E260-F262 VanDerWaalsContact C-N 3.33Å; E260-F262 PolarHBondContact O-N 3.04Å; E260-F263 PolarHBondContact O-N 3.07Å; E260-T264 WeakPolarHBondContact O-CB 3.45Å; E260-T264 PolarHBondContact O-N 3.16Å; E260-T264 PolarHBondContact O-OG1 3.07Å
261	A	92.4	Very high	82.3	Confident	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-59.2	-45.7	175.5	0	0	0	0	0	111	I248 A251 S257 W258 Q259 T264 V265	I248-A261 HydrophobicContact CG2-CB 4.35Å; A251-A261 HydrophobicContact CB-CB 3.86Å; S257-A261 WeakPolarHBondContact O-CB 3.41Å; S257-A261 PolarHBondContact O-N 3.37Å; W258-A261 PolarHBondContact O-N 3.15Å; Q259-A261 VanDerWaalsContact C-N 3.31Å; Q259-A261 PolarHBondContact O-N 2.72Å; A261-T264 PolarHBondContact O-N 2.97Å; A261-V265 WeakPolarHBondContact O-CG2 3.38Å; A261-V265 PolarHBondContact O-N 2.93Å
262	F	90.2	Very high	80.4	Confident	0 Å²	0	61.4 Å²	61.4	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.3	-44.5	176.5	-64.4	-45.3	0	0	0	112.6	L226 P227 L228 F231 V232 I248 W258 Q259 E260 T264 V265 L266	L226-F262 HydrophobicContact CB-CE1 4.38Å; L226-F262 HydrophobicContact CB-CZ 4.22Å; L226-F262 HydrophobicContact CD1-CE1 4.34Å; P227-F262 HydrophobicContact CG-CE2 4.24Å; P227-F262 HydrophobicContact CG-CZ 4.15Å; L228-F262 HydrophobicContact CD2-CD1 3.53Å; L228-F262 HydrophobicContact CD2-CD2 4.34Å; L228-F262 HydrophobicContact CD2-CE1 3.33Å; L228-F262 HydrophobicContact CD2-CE2 4.18Å; L228-F262 HydrophobicContact CD2-CG 4.06Å; L228-F262 HydrophobicContact CD2-CZ 3.7Å; L228-F262 HydrophobicContact CG-CE1 4.01Å; L228-F262 HydrophobicContact CG-CZ 4.05Å; F231-F262 HydrophobicContact CB-CD2 4.11Å; F231-F262 HydrophobicContact CB-CE2 4.46Å; F231-F262 HydrophobicContact CD2-CD2 4.3Å; F231-F262 AromaticContact CD2-CE2 3.92Å; F231-F262 HydrophobicContact CD2-CE2 3.92Å; V232-F262 HydrophobicContact CG2-CB 3.87Å; V232-F262 HydrophobicContact CG2-CD2 3.92Å; V232-F262 HydrophobicContact CG2-CG 4.03Å; I248-F262 HydrophobicContact CD1-CD1 3.73Å; I248-F262 HydrophobicContact CD1-CE1 3.95Å; I248-F262 HydrophobicContact CG1-CD1 4.04Å; I248-F262 HydrophobicContact CG1-CE1 4.41Å; I248-F262 HydrophobicContact CG2-CD1 3.94Å; I248-F262 HydrophobicContact CG2-CE1 3.68Å; W258-F262 HydrophobicContact CB-CD2 4.36Å; W258-F262 HydrophobicContact CB-CE2 3.84Å; W258-F262 HydrophobicContact CB-CZ 4.46Å; W258-F262 HydrophobicContact CE3-CE1 4.31Å; W258-F262 HydrophobicContact CE3-CE2 4.36Å; W258-F262 AromaticContact CE3-CZ 3.85Å; W258-F262 HydrophobicContact CE3-CZ 3.85Å; W258-F262 WeakPolarHBondContact O-CD2 3.47Å; W258-F262 VanDerWaalsContact O-CG 3.25Å; W258-F262 WeakPolarHBondContact O-CG 3.47Å; W258-F262 PolarHBondContact O-N 3.25Å; Q259-F262 PolarHBondContact O-N 2.83Å; E260-F262 VanDerWaalsContact C-N 3.33Å; E260-F262 PolarHBondContact O-N 3.04Å; F262-T264 VanDerWaalsContact C-N 3.29Å; F262-T264 PolarHBondContact O-N 2.9Å; F262-V265 PolarHBondContact O-N 3.46Å; F262-L266 HydrophobicContact CB-CD1 4.06Å; F262-L266 HydrophobicContact CD1-CD1 4.38Å; F262-L266 WeakPolarHBondContact O-CB 3.43Å; F262-L266 WeakPolarHBondContact O-CG 3.46Å; F262-L266 PolarHBondContact O-N 2.8Å
263	F	85.9	Confident	78.7	Confident	88 Å²	88	65.7 Å²	65.7	39%	0.386	34%	0.34	S	S	.	.	H	α-helix	trans	-66.3	-29.9	179.1	-82.5	-76.3	0	0	0	113.7	Q259 E260 A272 A274	Q259-F263 HydrophobicContact CG-CD2 3.86Å; Q259-F263 HydrophobicContact CG-CE2 3.74Å; Q259-F263 WeakPolarHBondContact O-CD2 3.41Å; Q259-F263 PolarHBondContact O-N 3.12Å; E260-F263 PolarHBondContact O-N 3.07Å; F263-A272 HydrophobicContact CE1-CB 4.18Å; F263-A272 VanDerWaalsContact CE1-O 3.31Å; F263-A272 WeakPolarHBondContact CE1-O 3.4Å; F263-A274 HydrophobicContact CE2-CB 3.9Å; F263-A274 HydrophobicContact CZ-CB 3.73Å
264	T	88	Confident	77	Confident	84 Å²	84	65.9 Å²	65.9	52%	0.515	35%	0.346	S	S	.	.	H	α-helix	trans	-73.2	-38.4	179.2	-53.2	0	0	0	0	111.4	K255 E260 A261 F262	K255-T264 WeakPolarHBondContact CE-OG1 3.47Å; K255-T264 PolarHBondContact NZ-OG1 2.93Å; E260-T264 WeakPolarHBondContact O-CB 3.45Å; E260-T264 PolarHBondContact O-N 3.16Å; E260-T264 PolarHBondContact O-OG1 3.07Å; A261-T264 PolarHBondContact O-N 2.97Å; F262-T264 VanDerWaalsContact C-N 3.29Å; F262-T264 PolarHBondContact O-N 2.9Å
265	V	87.4	Confident	75.5	Confident	20 Å²	20	64.7 Å²	64.7	12%	0.121	34%	0.342	C	S	.	.	H	α-helix	trans	-99.8	-36.8	-169.5	179.5	0	0	0	0	113.1	H244 E247 I248 A251 A261 F262 P267	H244-V265 HydrophobicContact CB-CG1 4.28Å; E247-V265 HydrophobicContact CB-CB 4.4Å; E247-V265 HydrophobicContact CB-CG1 3.57Å; E247-V265 HydrophobicContact CB-CG2 3.88Å; I248-V265 HydrophobicContact CG1-CB 3.83Å; I248-V265 HydrophobicContact CG1-CG1 3.92Å; I248-V265 HydrophobicContact CG1-CG2 4.14Å; A251-V265 HydrophobicContact CB-CG2 4.11Å; A261-V265 WeakPolarHBondContact O-CG2 3.38Å; A261-V265 PolarHBondContact O-N 2.93Å; F262-V265 PolarHBondContact O-N 3.46Å; V265-P267 WeakPolarHBondContact O-CD 3.42Å
266	L	81.9	Confident	73.3	Confident	8 Å²	8	65.8 Å²	65.8	4%	0.042	36%	0.36	C	S	.	.	S	Bend	trans	-76.9	125.5	-176.1	-63.3	178.3	0	0	0	110.4	L228 V232 L240 I248 F262 Q268	L228-L266 HydrophobicContact CD2-CD1 4.2Å; V232-L266 HydrophobicContact CG1-CD1 4.44Å; V232-L266 HydrophobicContact CG2-CD1 4.46Å; L240-L266 HydrophobicContact CD1-CD2 4.12Å; L240-L266 HydrophobicContact CD2-CD2 3.67Å; I248-L266 HydrophobicContact CD1-CD2 4.3Å; F262-L266 HydrophobicContact CB-CD1 4.06Å; F262-L266 HydrophobicContact CD1-CD1 4.38Å; F262-L266 WeakPolarHBondContact O-CB 3.43Å; F262-L266 WeakPolarHBondContact O-CG 3.46Å; F262-L266 PolarHBondContact O-N 2.8Å; L266-Q268 PolarHBondContact O-N 3.36Å
267	P	67.6	Low	71.1	Confident	38 Å²	38	71.6 Å²	71.6	25%	0.247	37%	0.372	C	S	.	.			trans	-58.5	132.7	176.8	-25	33.8	0	0	0	111.5	V265 R269 K270	V265-P267 WeakPolarHBondContact O-CD 3.42Å; P267-R269 HydrophobicContact CB-CG 3.8Å; P267-R269 PolarHBondContact O-N 3.48Å; P267-K270 WeakPolarHBondContact O-CB 3.43Å; P267-K270 PolarHBondContact O-N 3.32Å
268	Q	61.9	Low	68.4	Low	190 Å²	190	76.7 Å²	76.7	89%	0.888	40%	0.396	S	S	*	.	G	3₁₀ helix	trans	-49.7	-30.9	179.5	-69.7	177.2	-12.6	0	0	113.7	L266 K270 G271	L266-Q268 PolarHBondContact O-N 3.36Å; Q268-K270 PolarHBondContact O-N 2.83Å; Q268-G271 PolarHBondContact O-N 2.81Å
269	R	51.5	Low	65.7	Low	228 Å²	228	79.8 Å²	79.8	86%	0.86	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-59.7	-13	174.1	66.8	176.9	-179.6	-169.2	-0.3	115.3	P267 G271	P267-R269 HydrophobicContact CB-CG 3.8Å; P267-R269 PolarHBondContact O-N 3.48Å; R269-G271 VanDerWaalsContact C-N 3.28Å
270	K	53.8	Low	63	Low	48 Å²	48	82.1 Å²	82.1	21%	0.209	45%	0.452	C	S	.	.	G	3₁₀ helix	trans	-84.6	0.7	174.4	-74.8	-170.5	170.8	-170.1	0	113.3	M234 P267 Q268 A272	M234-K270 HydrophobicContact SD-CB 4.4Å; M234-K270 HydrophobicContact SD-CD 4.44Å; P267-K270 WeakPolarHBondContact O-CB 3.43Å; P267-K270 PolarHBondContact O-N 3.32Å; Q268-K270 PolarHBondContact O-N 2.83Å; K270-A272 VanDerWaalsContact C-N 3.33Å; K270-A272 PolarHBondContact O-N 2.91Å
271	G	52.1	Low	60.4	Low	35 Å²	35	83.6 Å²	83.6	36%	0.361	46%	0.463	S	S	.	.			trans	69	30.4	174.1	0	0	0	0	0	113.2	Q268 R269 I273	Q268-G271 PolarHBondContact O-N 2.81Å; R269-G271 VanDerWaalsContact C-N 3.28Å; G271-I273 PolarHBondContact O-N 3.39Å
272	A	54.3	Low	57.5	Low	20 Å²	20	94.9 Å²	94.9	17%	0.165	51%	0.506	C	S	.	.			trans	-62.8	102.6	174.5	0	0	0	0	0	109.4	V232 F263 K270	V232-A272 HydrophobicContact CG1-CB 3.52Å; F263-A272 HydrophobicContact CE1-CB 4.18Å; F263-A272 VanDerWaalsContact CE1-O 3.31Å; F263-A272 WeakPolarHBondContact CE1-O 3.4Å; K270-A272 VanDerWaalsContact C-N 3.33Å; K270-A272 PolarHBondContact O-N 2.91Å
273	I	58.7	Low	54.9	Low	120 Å²	120	102.7 Å²	102.7	62%	0.615	54%	0.542	S	S	*	.			trans	-110	131.5	171.2	-58.5	169.7	0	0	0	106.4	K233 G271	K233-I273 PolarHBondContact N-O 3.22Å; G271-I273 PolarHBondContact O-N 3.39Å
274	A	57	Low	52.2	Low	35 Å²	35	107.7 Å²	107.7	29%	0.289	57%	0.567	S	S	.	*			trans	-67.1	132.8	178.7	0	0	0	0	0	108.3	F263 S276	F263-A274 HydrophobicContact CE2-CB 3.9Å; F263-A274 HydrophobicContact CZ-CB 3.73Å; A274-S276 PolarHBondContact O-N 3.46Å
275	I	59.1	Low	49.5	Very low	82 Å²	82	111 Å²	111	42%	0.421	58%	0.581	S	S	.	*			trans	-78.5	109.9	168.2	-57.9	177.8	0	0	0	105.8	S229 Q277	S229-I275 WeakPolarHBondContact O-CD1 3.47Å; I275-Q277 PolarHBondContact O-N 2.9Å
276	S	45.7	Very low	46.9	Very low	104 Å²	104	117.8 Å²	117.8	73%	0.727	61%	0.612	S	S	*	*			trans	-62.6	119.1	173.4	-47.1	0	0	0	0	108.8	A274 D278	A274-S276 PolarHBondContact O-N 3.46Å; S276-D278 PolarHBondContact O-N 2.85Å
277	Q	43.8	Very low	44.4	Very low	178 Å²	178	125.4 Å²	125.4	83%	0.832	65%	0.653	S	S	*	*			trans	-77.1	80.6	163.9	-72.4	-172	-6.8	0	0	108	I275	I275-Q277 PolarHBondContact O-N 2.9Å
278	D	36.5	Very low	42.6	Very low	146 Å²	146	130.9 Å²	130.9	78%	0.781	68%	0.68	S	S	*	*			trans	-141.5	80.3	163.9	-116.8	-9.2	0	0	0	107.6	S276	S276-D278 PolarHBondContact O-N 2.85Å
279	G	33.4	Very low	41.1	Very low	81 Å²	81	129.5 Å²	129.5	84%	0.835	68%	0.679	S	S	*	*			trans	-108.8	63.8	174.2	0	0	0	0	0	109.4	N281	G279-N281 PolarHBondContact O-N 2.76Å; G279-N281 VanDerWaalsContact O-N 3.12Å
280	T	31.5	Very low	40.1	Very low	121 Å²	121	127.3 Å²	127.3	74%	0.742	68%	0.678	S	S	*	*			trans	-68	109.7	169	-44.6	0	0	0	0	108.1	R282	T280-R282 PolarHBondContact O-N 2.8Å; T280-R282 VanDerWaalsContact O-N 3.16Å
281	N	36.1	Very low	38.8	Very low	130 Å²	130	128.2 Å²	128.2	70%	0.695	70%	0.701	S	S	*	*			trans	-57.5	109	167.7	-166	16	0	0	0	109.6	G279	G279-N281 PolarHBondContact O-N 2.76Å; G279-N281 VanDerWaalsContact O-N 3.12Å
282	R	31.9	Very low	37.7	Very low	237 Å²	237	135 Å²	135	89%	0.894	73%	0.728	S	S	*	*			trans	-134.3	89.3	151.7	-88.5	-169.8	-179.4	-174.9	-1.1	107.9	T280	T280-R282 PolarHBondContact O-N 2.8Å; T280-R282 VanDerWaalsContact O-N 3.16Å
283	Q	34.2	Very low	36.6	Very low	164 Å²	164	141.7 Å²	141.7	77%	0.766	76%	0.761	S	S	*	*			trans	-66.6	128.5	144.9	-75.7	175.6	-44.6	0	0	107.5
284	E	30.5	Very low	35.4	Very low	193 Å²	193	141.4 Å²	141.4	90%	0.902	77%	0.77	S	S	*	*			trans	-145.6	140.4	143.2	-113.1	166.9	-154.9	0	0	108.3
285	N	30.6	Very low	34.1	Very low	152 Å²	152	147.3 Å²	147.3	81%	0.813	80%	0.797	S	S	*	*			trans	-76.9	167.9	-162.1	-78.2	-42.6	0	0	0	113.5
286	Q	32.7	Very low	33	Very low	164 Å²	164	149.1 Å²	149.1	77%	0.766	82%	0.817	S	S	*	*			trans	-25.8	140.8	159	-68.6	163	-31.4	0	0	115.6
287	D	28.9	Very low	32.4	Very low	168 Å²	168	150.7 Å²	150.7	90%	0.898	82%	0.817	S	S	*	*			trans	-143.1	125.5	132.2	-90.4	-33.7	0	0	0	108.5
288	D	30.6	Very low	31.8	Very low	153 Å²	153	150.9 Å²	150.9	82%	0.818	82%	0.822	S	S	*	*			trans	-72.4	136.4	164.5	-63.1	-57.8	0	0	0	108.7
289	D	30.7	Very low	31.6	Very low	161 Å²	161	151 Å²	151	86%	0.861	82%	0.823	S	S	*	*			trans	-164.2	147.6	137.7	-156.8	19.9	0	0	0	112.2
290	E	29.6	Very low	31.6	Very low	181 Å²	181	151.1 Å²	151.1	85%	0.846	82%	0.816	S	S	*	*			trans	-80	158.3	-167.1	-59.5	-175.8	149.2	0	0	115
291	G	27.4	Very low	31.7	Very low	67 Å²	67	149.9 Å²	149.9	69%	0.691	82%	0.819	S	S	*	*			trans	86	111	135.5	0	0	0	0	0	118.4
292	L	29.5	Very low	31.6	Very low	177 Å²	177	152 Å²	152	93%	0.927	82%	0.824	S	S	*	*				169.2	116.4	104.7	-92.7	152	0	0	0	110.9
293	D	29.4	Very low	31.7	Very low	162 Å²	162	149.2 Å²	149.2	87%	0.866	82%	0.819	S	S	*	*			trans	-56.8	136	159.7	-75	-46.7	0	0	0	111.2
294	S	33.8	Very low	31.7	Very low	114 Å²	114	147.3 Å²	147.3	80%	0.797	82%	0.818	S	S	*	*			trans	-145.3	103	142.5	76.8	0	0	0	0	110.2
295	D	31	Very low	32.1	Very low	159 Å²	159	144.6 Å²	144.6	85%	0.85	82%	0.815	S	S	*	*			trans	-58.8	135.4	162.9	-114.3	-29.6	0	0	0	110.2
296	S	36.2	Very low	32.4	Very low	120 Å²	120	144.3 Å²	144.3	84%	0.839	81%	0.812	S	S	*	*			trans	-128.1	93.3	153.4	51	0	0	0	0	109.6
297	N	31.3	Very low	32.5	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	81%	0.814	S	S	*	*			trans	-50.9	135.5	165.9	-126.6	-10.3	0	0	0	112
298	L	32.1	Very low	32.9	Very low	182 Å²	182	145.3 Å²	145.3	95%	0.953	81%	0.806	S	S	*	*			trans	-150.8	114.5	146.8	-95.2	172.8	0	0	0	109.3
299	D	32.7	Very low	33.5	Very low	148 Å²	148	147.3 Å²	147.3	79%	0.791	81%	0.81	S	S	*	*			trans	-107.5	156.5	-174.9	-149.4	-1.2	0	0	0	110.3
300	A	32.5	Very low	34.2	Very low	84 Å²	84	151.1 Å²	151.1	69%	0.694	83%	0.83	S	S	*	*			trans	79.2	121.9	154.5	0	0	0	0	0	123.6
301	A	33.3	Very low	34.4	Very low	96 Å²	96	149.6 Å²	149.6	79%	0.793	83%	0.83	S	S	*	*			trans	65.8	136.6	135.3	0	0	0	0	0	119.2
302	E	34.2	Very low	34.8	Very low	175 Å²	175	153.9 Å²	153.9	82%	0.818	84%	0.837	S	S	*	*				-165	139.7	56.8	-105.9	-172.7	131.7	0	0	112.9
303	K	35.3	Very low	35.1	Very low	178 Å²	178	152.7 Å²	152.7	77%	0.774	83%	0.832	S	S	*	*			trans	27	125.1	132.5	-79.8	179.2	179.8	172.6	0	123.1
304	T	33.3	Very low	35.4	Very low	124 Å²	124	152.1 Å²	152.1	76%	0.761	83%	0.83	S	S	*	*			trans	57.4	129.5	134.1	48.4	0	0	0	0	120.7
305	V	38.3	Very low	35.5	Very low	136 Å²	136	154.5 Å²	154.5	82%	0.824	83%	0.832	S	S	*	*				-179.6	143.8	101.3	157.3	0	0	0	0	110.8
306	I	37.7	Very low	35.8	Very low	146 Å²	146	154.2 Å²	154.2	75%	0.749	83%	0.831	S	S	*	*			trans	-57.8	139.6	175.4	-62.9	149.4	0	0	0	113
307	R	35.3	Very low	35.8	Very low	218 Å²	218	156.6 Å²	156.6	82%	0.823	83%	0.83	S	S	*	*				178.9	129.9	125.6	-104.3	-176	167.4	143.4	-1.4	114.9
308	D	37.5	Very low	36.2	Very low	134 Å²	134	158.2 Å²	158.2	72%	0.717	84%	0.838	S	S	*	*			trans	58.6	108.9	137.9	-57.6	-22.8	0	0	0	120.7
309	Q	42.1	Very low	36.5	Very low	196 Å²	196	156.3 Å²	156.3	92%	0.916	83%	0.829	S	S	*	*			trans	-63.6	138.4	150.7	-69.1	174	-8.3	0	0	109.6
310	N	45.7	Very low	36.8	Very low	240 Å²	240	157 Å²	157	100%	1.283	83%	0.832	S	S	*	*			trans	-115.7	0	153.6	-140.6	30.7	0	0	0	107

Retrieved 310 of 310 residues in 215.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).