A0A060XDE0_ONCMY Loading...

Glutaryl-CoA dehydrogenase, mitochondrial

AlphaFold DB , UniProt , Accession A0A060XDE0, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110538293, Length 441 aa.

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(Predicted Aligned Error values between residue pairs)

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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	35.7	Very low	29.3	Very low	251 Å²	251	165.2 Å²	165.2	100%	1.236	90%	0.895	S	S	*	*				0	111.1	0	-99	172.3	166.5	0	0	108
2	A	29.5	Very low	29.5	Very low	97 Å²	97	160.9 Å²	160.9	80%	0.802	88%	0.878	S	S	*	*			trans	-81.3	142.1	-172.7	0	0	0	0	0	111.6
3	L	29.1	Very low	29.5	Very low	183 Å²	183	160.3 Å²	160.3	96%	0.958	87%	0.873	S	S	*	*			trans	-119.4	103.4	164.9	-100.4	146.4	0	0	0	108.3
4	R	31.1	Very low	30.6	Very low	230 Å²	230	156.4 Å²	156.4	87%	0.868	86%	0.86	S	S	*	*			trans	-102.2	146.4	171	-89.7	-174.2	171.8	-159.6	-1.2	109.6
5	S	29.7	Very low	30.4	Very low	122 Å²	122	158.3 Å²	158.3	85%	0.853	86%	0.86	S	S	*	*			trans	82	123.8	147.8	85.1	0	0	0	0	119.5
6	A	27	Very low	30.5	Very low	99 Å²	99	163.4 Å²	163.4	82%	0.818	86%	0.863	S	S	*	*				-163.4	99.1	129.3	0	0	0	0	0	109.8
7	V	28	Very low	30.4	Very low	143 Å²	143	160.7 Å²	160.7	87%	0.867	86%	0.859	S	S	*	*			trans	-141	114.2	160.5	176.9	0	0	0	0	107.5
8	C	28	Very low	30.4	Very low	120 Å²	120	156.9 Å²	156.9	81%	0.811	85%	0.854	S	S	*	*			trans	175.3	121.9	147.2	-103	0	0	0	0	110.7
9	R	29.1	Very low	30.4	Very low	249 Å²	249	157.4 Å²	157.4	94%	0.94	85%	0.854	S	S	*	*				177.2	120.8	115.8	-94.9	174.2	-170	-159.1	2.8	111.2
10	L	26.7	Very low	30.4	Very low	166 Å²	166	157.6 Å²	157.6	87%	0.869	85%	0.852	S	S	*	*			trans	-95	162	161.2	-95.3	153.8	0	0	0	109.3
11	L	28.7	Very low	30.3	Very low	157 Å²	157	155.8 Å²	155.8	82%	0.822	85%	0.851	S	S	*	*			trans	135.2	102.1	153.7	-71	171.3	0	0	0	110.7
12	V	31.5	Very low	30.1	Very low	114 Å²	114	148.4 Å²	148.4	69%	0.691	83%	0.831	S	S	*	*				76.4	110.2	81.6	174.4	0	0	0	0	113.3
13	N	29.7	Very low	30.1	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	83%	0.834	S	S	*	*				170.2	157.1	98	-130.1	5.8	0	0	0	112.4
14	P	44.3	Very low	30.2	Very low	106 Å²	106	152.6 Å²	152.6	69%	0.688	83%	0.832	S	S	*	*			trans	-106.8	172.9	-167.4	41.8	-34.4	0	0	0	113.7
15	Q	28.8	Very low	30.2	Very low	185 Å²	185	146.6 Å²	146.6	86%	0.864	83%	0.826	S	S	*	*			trans	-169.4	153.2	153.9	-112.4	175.9	16.7	0	0	114.4
16	R	31.3	Very low	30.3	Very low	239 Å²	239	150.4 Å²	150.4	90%	0.902	83%	0.83	S	S	*	*			trans	104.5	139.6	161.7	-63.2	-176.7	179.1	-160.3	-1.2	115.7
17	C	29.4	Very low	30.3	Very low	118 Å²	118	149.4 Å²	149.4	80%	0.797	83%	0.829	S	S	*	*			cis	-173.3	138.3	-17.8	-164.5	0	0	0	0	104.6
18	A	29.1	Very low	30.5	Very low	92 Å²	92	148.5 Å²	148.5	76%	0.76	83%	0.829	S	S	*	*			trans	-98.9	141.3	177.2	0	0	0	0	0	110.4
19	I	31.6	Very low	30.7	Very low	167 Å²	167	147.3 Å²	147.3	86%	0.856	83%	0.828	S	S	*	*			trans	-133	131.4	164.9	-61.8	-178.9	0	0	0	109
20	I	29.6	Very low	31	Very low	160 Å²	160	140.1 Å²	140.1	82%	0.821	82%	0.822	S	S	*	*			trans	-98.2	142.6	177.7	-66.2	165	0	0	0	108.2
21	S	29.4	Very low	31.7	Very low	120 Å²	120	138.2 Å²	138.2	84%	0.839	82%	0.82	S	S	*	*			trans	-157.3	135.4	146.7	65.6	0	0	0	0	111.7
22	A	30.7	Very low	31.9	Very low	97 Å²	97	135.1 Å²	135.1	80%	0.802	82%	0.817	S	S	*	*			trans	-111.8	153.7	-180	0	0	0	0	0	111.3
23	S	30.5	Very low	32.2	Very low	124 Å²	124	138.3 Å²	138.3	87%	0.867	82%	0.824	S	S	*	*			trans	-162.4	136.2	149.3	56.8	0	0	0	0	113
24	R	29.3	Very low	32.6	Very low	243 Å²	243	139.6 Å²	139.6	92%	0.917	82%	0.822	S	S	*	*			trans	-70.1	163	175.5	-70	171.2	169	179.9	-4.3	111.2
25	S	31.3	Very low	32.2	Very low	105 Å²	105	142.2 Å²	142.2	73%	0.734	83%	0.83	S	S	*	*				-175.1	137.1	61.1	53	0	0	0	0	116.3
26	Q	31.9	Very low	32.6	Very low	201 Å²	201	137.4 Å²	137.4	94%	0.939	82%	0.822	S	S	*	*				59	133.4	129.4	-66.7	-164.5	-7.2	0	0	124.6
27	G	28.5	Very low	33	Very low	79 Å²	79	135.5 Å²	135.5	81%	0.814	82%	0.824	S	S	*	*			trans	171.6	80.3	160.3	0	0	0	0	0	115.9
28	S	31	Very low	33.5	Very low	123 Å²	123	139.3 Å²	139.3	86%	0.86	83%	0.827	S	S	*	*			trans	29.4	120.1	146.1	171.9	0	0	0	0	122.4
29	A	33.1	Very low	34.2	Very low	95 Å²	95	138.9 Å²	138.9	79%	0.785	82%	0.824	S	S	*	*				163.2	130.2	114.1	0	0	0	0	0	111.3
30	A	34.3	Very low	34.9	Very low	98 Å²	98	135.9 Å²	135.9	81%	0.81	82%	0.817	S	S	*	*			trans	-90	152.2	169.6	0	0	0	0	0	110.4
31	P	41.6	Very low	35.9	Very low	127 Å²	127	136.7 Å²	136.7	83%	0.825	82%	0.817	S	S	*	*				-144.3	152.9	99	35	-18	0	0	0	116.2
32	A	34.2	Very low	37	Very low	92 Å²	92	140.2 Å²	140.2	76%	0.76	82%	0.818	S	S	*	*			trans	40.4	109.3	145.8	0	0	0	0	0	122.1
33	Q	37.5	Very low	38.3	Very low	181 Å²	181	144.5 Å²	144.5	85%	0.846	82%	0.818	S	S	*	*			trans	51.8	130.1	131.4	-90.8	-177.1	-12.7	0	0	123.2
34	K	37.3	Very low	39.6	Very low	179 Å²	179	143.1 Å²	143.1	78%	0.778	81%	0.814	S	S	*	*			trans	79	102.5	158.8	-66.1	179	178.2	178.9	0	115.8
35	D	35	Very low	41.3	Very low	161 Å²	161	141.2 Å²	141.2	86%	0.861	81%	0.813	S	S	*	*				-171.6	126	111.5	-88.2	-26.5	0	0	0	112.4
36	A	38.7	Very low	43.1	Very low	84 Å²	84	140.3 Å²	140.3	69%	0.694	81%	0.811	S	S	*	*			trans	29.5	106.9	156.2	0	0	0	0	0	119.4	K38	A36-K38 VanDerWaalsContact C-N 3.33Å; A36-K38 PolarHBondContact O-N 3.39Å
37	E	38.3	Very low	45	Very low	199 Å²	199	136.5 Å²	136.5	93%	0.93	80%	0.804	S	S	*	*			trans	-52.2	97.5	144.8	-82	179.4	139	0	0	109.5	A39	E37-A39 PolarHBondContact O-N 3.47Å; E37-A39 VanDerWaalsContact O-N 3.08Å
38	K	40.3	Very low	47.6	Very low	198 Å²	198	142.5 Å²	142.5	86%	0.861	81%	0.808	S	S	*	*			trans	-77.7	79.6	155.4	-84.7	-177.3	177.9	174.5	0	107.7	A36 S40	A36-K38 VanDerWaalsContact C-N 3.33Å; A36-K38 PolarHBondContact O-N 3.39Å; K38-S40 PolarHBondContact O-N 3.19Å
39	A	44.4	Very low	50.3	Low	84 Å²	84	143.4 Å²	143.4	69%	0.694	81%	0.808	S	S	*	*			trans	-56.6	110.2	156.2	0	0	0	0	0	106.9	E37 E41	E37-A39 PolarHBondContact O-N 3.47Å; E37-A39 VanDerWaalsContact O-N 3.08Å; A39-E41 PolarHBondContact O-N 3.29Å
40	S	46.3	Very low	53.2	Low	103 Å²	103	147.1 Å²	147.1	72%	0.72	81%	0.809	S	S	*	*			trans	-71.1	90.2	171.6	76	0	0	0	0	107	K38 K42	K38-S40 PolarHBondContact O-N 3.19Å; S40-K42 VanDerWaalsContact C-N 3.26Å; S40-K42 PolarHBondContact O-N 2.93Å
41	E	50.3	Low	56.1	Low	177 Å²	177	148.9 Å²	148.9	83%	0.827	80%	0.799	S	S	*	*			trans	-57.8	99.5	158.4	-79.5	-175.4	158.6	0	0	106.6	A39 K43	A39-E41 PolarHBondContact O-N 3.29Å; E41-K43 PolarHBondContact O-N 3.45Å
42	K	52.5	Low	58.8	Low	195 Å²	195	146 Å²	146	85%	0.848	78%	0.776	S	S	*	*			trans	-61.1	92.2	162.1	-79.6	-179	177.5	175.4	0	105.6	S40 A44	S40-K42 VanDerWaalsContact C-N 3.26Å; S40-K42 PolarHBondContact O-N 2.93Å; K42-A44 PolarHBondContact O-N 2.97Å
43	K	57.5	Low	61.8	Low	187 Å²	187	144.6 Å²	144.6	81%	0.813	75%	0.751	S	S	*	*			trans	-46.9	113.4	166.1	-83.5	-174.6	175.4	-178.5	0	106.4	E41 K45	E41-K43 PolarHBondContact O-N 3.45Å; K43-K45 PolarHBondContact O-N 3.4Å
44	A	58.9	Low	64.7	Low	95 Å²	95	143.8 Å²	143.8	79%	0.785	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-51.7	118.1	171.9	0	0	0	0	0	106.5	K42 A46	K42-A44 PolarHBondContact O-N 2.97Å; A44-A46 PolarHBondContact O-N 2.96Å
45	K	64.1	Low	67.6	Low	202 Å²	202	136.4 Å²	136.4	88%	0.878	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-56.7	121.2	175.9	-89.4	-178.2	175.2	176.6	0	106.3	K43	K43-K45 PolarHBondContact O-N 3.4Å
46	A	70.3	Confident	70.5	Confident	86 Å²	86	129.5 Å²	129.5	71%	0.711	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-49.1	138	171.7	0	0	0	0	0	108.7	A44 K48	A44-A46 PolarHBondContact O-N 2.96Å; A46-K48 PolarHBondContact O-N 3.31Å
47	P	72.1	Confident	73.3	Confident	122 Å²	122	130.4 Å²	130.4	79%	0.792	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-54.2	128.2	-179.6	20.7	-30.3	0	0	0	109.1	V49	P47-V49 PolarHBondContact O-N 2.9Å; P47-V49 VanDerWaalsContact O-N 3.13Å
48	K	82.2	Confident	76.1	Confident	205 Å²	205	125.8 Å²	125.8	89%	0.891	65%	0.647	S	S	*	*			trans	-73.8	107.2	-177.7	-161.1	179.6	-174.7	-174.9	0	107.5	A46 Q50	A46-K48 PolarHBondContact O-N 3.31Å; K48-Q50 PolarHBondContact O-N 3.27Å
49	V	88	Confident	78.9	Confident	141 Å²	141	116.5 Å²	116.5	86%	0.855	61%	0.607	S	S	*	*	P	Polyproline II helix	trans	-58.5	127.8	176.2	-177.9	0	0	0	0	108.8	P47	P47-V49 PolarHBondContact O-N 2.9Å; P47-V49 VanDerWaalsContact O-N 3.13Å
50	Q	93.2	Very high	81.4	Confident	174 Å²	174	116.1 Å²	116.1	81%	0.813	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-92.4	126.9	178.3	-175.3	173.3	5.2	0	0	109.2	K48 N52	K48-Q50 PolarHBondContact O-N 3.27Å; Q50-N52 PolarHBondContact O-N 2.62Å
51	F	96.3	Very high	83.9	Confident	134 Å²	134	114.6 Å²	114.6	59%	0.588	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-71.4	126.8	177.3	179.2	-108.4	0	0	0	111.3	W53 G56 L343	F51-W53 HydrophobicContact CE1-CB 4.1Å; F51-G56 WeakPolarHBondContact CE2-O 3.38Å; F51-L343 HydrophobicContact CE1-CD2 4.13Å; F51-L343 HydrophobicContact CZ-CD2 4.08Å
52	N	97.6	Very high	86.2	Confident	66 Å²	66	109.9 Å²	109.9	35%	0.353	57%	0.57	S	S	.	*			trans	-95.1	105.4	173.5	-177.1	4.6	0	0	0	110.7	Q50 R54 D55 G56	Q50-N52 PolarHBondContact O-N 2.62Å; N52-R54 PolarHBondContact O-N 2.7Å; N52-R54 WeakPolarHBondContact OD1-CB 3.47Å; N52-R54 PolarHBondContact OD1-N 3.15Å; N52-D55 CarbonylContact O-C 3.6Å; N52-D55 PolarHBondContact O-N 2.64Å; N52-G56 PolarHBondContact O-N 2.61Å
53	W	97.9	Very high	88.4	Confident	64 Å²	64	101.5 Å²	101.5	24%	0.242	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-16.4	179.5	70	-91.2	0	0	0	114	F51 D55 F312 H313 L343	F51-W53 HydrophobicContact CE1-CB 4.1Å; W53-D55 VanDerWaalsContact C-N 3.34Å; W53-F312 AromaticContact CE3-CE1 3.76Å; W53-F312 HydrophobicContact CE3-CE1 3.76Å; W53-F312 AromaticContact CE3-CZ 3.85Å; W53-F312 HydrophobicContact CE3-CZ 3.85Å; W53-F312 AromaticContact CZ3-CE1 3.78Å; W53-F312 HydrophobicContact CZ3-CE1 3.78Å; W53-F312 HydrophobicContact CZ3-CZ 4.03Å; W53-H313 AromaticContact CH2-CD2 3.98Å; W53-H313 AromaticContact CZ3-CD2 3.53Å; W53-H313 AromaticContact CZ3-NE2 3.67Å; W53-L343 WeakPolarHBondContact O-CD1 3.32Å
54	R	97.3	Very high	90.3	Very high	163 Å²	163	95.6 Å²	95.6	62%	0.615	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-15.1	175.1	-65.4	-179.7	172.3	173.2	-3.9	112.6	N52	N52-R54 PolarHBondContact O-N 2.7Å; N52-R54 WeakPolarHBondContact OD1-CB 3.47Å; N52-R54 PolarHBondContact OD1-N 3.15Å
55	D	97.6	Very high	92.2	Very high	25 Å²	25	99 Å²	99	13%	0.134	51%	0.514	C	S	.	.	S	Bend	trans	-150.3	74.3	-179	-172.3	9.1	0	0	0	110	N52 W53 L57 E58 L59 E60	N52-D55 CarbonylContact O-C 3.6Å; N52-D55 PolarHBondContact O-N 2.64Å; W53-D55 VanDerWaalsContact C-N 3.34Å; D55-L57 PolarHBondContact O-N 3Å; D55-L57 VanDerWaalsContact O-N 3.09Å; D55-E58 PolarHBondContact O-N 3.47Å; D55-E58 PolarHBondContact OD1-N 3.35Å; D55-E58 WeakPolarHBondContact OD2-CA 3.41Å; D55-L59 VanDerWaalsContact OD1-CB 3.3Å; D55-L59 WeakPolarHBondContact OD1-CB 3.42Å; D55-L59 PolarHBondContact OD1-N 3.24Å; D55-L59 PolarHBondContact OD2-N 3.34Å; D55-E60 PolarHBondContact OD2-N 2.89Å
56	G	96.6	Very high	93.8	Very high	16 Å²	16	94.5 Å²	94.5	17%	0.165	50%	0.499	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-16.8	-166.3	0	0	0	0	0	115.6	F51 N52	F51-G56 WeakPolarHBondContact CE2-O 3.38Å; N52-G56 PolarHBondContact O-N 2.61Å
57	L	98.1	Very high	95.1	Very high	103 Å²	103	90.6 Å²	90.6	54%	0.539	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.8	23.5	178.2	-71.7	-179.8	0	0	0	112.8	D55 L59 T347 Q351	D55-L57 PolarHBondContact O-N 3Å; D55-L57 VanDerWaalsContact O-N 3.09Å; L57-L59 PolarHBondContact O-N 2.75Å; L57-T347 HydrophobicContact CB-CG2 3.88Å; L57-T347 HydrophobicContact CD1-CG2 3.67Å; L57-T347 HydrophobicContact CG-CG2 3.51Å; L57-Q351 HydrophobicContact CB-CG 4.18Å; L57-Q351 HydrophobicContact CD1-CG 3.78Å
58	E	97	Very high	96.4	Very high	101 Å²	101	86.7 Å²	86.7	47%	0.472	44%	0.438	S	S	.	.			trans	53.8	49.6	175.2	-59.9	-69.6	134.8	0	0	113	D55 E60 G61	D55-E58 PolarHBondContact O-N 3.47Å; D55-E58 PolarHBondContact OD1-N 3.35Å; D55-E58 WeakPolarHBondContact OD2-CA 3.41Å; E58-E60 PolarHBondContact O-N 3.05Å; E58-G61 PolarHBondContact O-N 3.23Å; E58-G61 VanDerWaalsContact O-N 3.07Å
59	L	98.4	Very high	97.2	Very high	4 Å²	4	82.8 Å²	82.8	2%	0.021	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-49.6	-39.7	171	178.7	63.8	0	0	0	111	D55 L57 G61 Q62 L63 L350 L354	D55-L59 VanDerWaalsContact OD1-CB 3.3Å; D55-L59 WeakPolarHBondContact OD1-CB 3.42Å; D55-L59 PolarHBondContact OD1-N 3.24Å; D55-L59 PolarHBondContact OD2-N 3.34Å; L57-L59 PolarHBondContact O-N 2.75Å; L59-G61 PolarHBondContact O-N 2.77Å; L59-Q62 WeakPolarHBondContact O-CB 3.26Å; L59-Q62 PolarHBondContact O-N 3.41Å; L59-L63 HydrophobicContact CD1-CD2 4.3Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; L59-L350 HydrophobicContact CD2-CB 4.31Å; L59-L350 HydrophobicContact CD2-CD1 4.3Å; L59-L350 HydrophobicContact CD2-CD2 4.37Å; L59-L354 HydrophobicContact CD1-CB 4.2Å; L59-L354 HydrophobicContact CD1-CD1 4.48Å; L59-L354 HydrophobicContact CD1-CD2 3.81Å; L59-L354 HydrophobicContact CD1-CG 4.38Å
60	E	97.9	Very high	97.7	Very high	75 Å²	75	78.3 Å²	78.3	35%	0.35	40%	0.396	S	S	.	.	G	3₁₀ helix	trans	-50.9	-45.4	177.8	-162.4	70.3	-166.7	0	0	112.2	D55 E58 Q62 L63 R71	D55-E60 PolarHBondContact OD2-N 2.89Å; E58-E60 PolarHBondContact O-N 3.05Å; E60-Q62 PolarHBondContact O-N 3.02Å; E60-Q62 VanDerWaalsContact O-N 3.11Å; E60-L63 PolarHBondContact O-N 3.06Å; E60-R71 IonicContact OE1-CZ 3.55Å; E60-R71 IonicContact OE1-NH1 3.39Å; E60-R71 PolarHBondContact OE1-NH1 3.07Å; E60-R71 IonicContact OE1-NH2 2.83Å; E60-R71 PolarHBondContact OE1-NH2 3.38Å; E60-R71 IonicContact OE2-CZ 3.09Å; E60-R71 IonicContact OE2-NH1 3.71Å; E60-R71 PolarHBondContact OE2-NH1 2.97Å; E60-R71 IonicContact OE2-NH2 3.32Å; E60-R71 PolarHBondContact OE2-NH2 3.01Å
61	G	97.4	Very high	97.9	Very high	72 Å²	72	70.6 Å²	70.6	74%	0.742	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-71.2	-3.5	-178.3	0	0	0	0	0	114.6	E58 L59	E58-G61 PolarHBondContact O-N 3.23Å; E58-G61 VanDerWaalsContact O-N 3.07Å; L59-G61 PolarHBondContact O-N 2.77Å
62	Q	98.6	Very high	98	Very high	78 Å²	78	66.9 Å²	66.9	36%	0.364	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-109.5	-6	-179.4	-54.2	173.1	-49.8	0	0	113.2	L59 E60 Q351 L354 R358	L59-Q62 WeakPolarHBondContact O-CB 3.26Å; L59-Q62 PolarHBondContact O-N 3.41Å; E60-Q62 PolarHBondContact O-N 3.02Å; E60-Q62 VanDerWaalsContact O-N 3.11Å; Q62-Q351 VanDerWaalsContact OE1-OE1 3.14Å; Q62-L354 HydrophobicContact CB-CD2 3.62Å; Q62-L354 HydrophobicContact CG-CD2 4.27Å; Q62-R358 PolarHBondContact O-NH2 2.83Å
63	L	98.7	Very high	98	Very high	18 Å²	18	67 Å²	67	9%	0.094	35%	0.351	C	S	.	.	S	Bend	trans	-90.7	151.5	178.6	-58.4	-178	0	0	0	110.6	L59 E60 E67 I68 V124 L128 L354	L59-L63 HydrophobicContact CD1-CD2 4.3Å; L59-L63 WeakPolarHBondContact O-CG 3.44Å; E60-L63 PolarHBondContact O-N 3.06Å; L63-E67 HydrophobicContact CB-CB 4.26Å; L63-I68 HydrophobicContact CB-CD1 4.14Å; L63-I68 HydrophobicContact CB-CG1 3.72Å; L63-I68 HydrophobicContact CD1-CG1 4.16Å; L63-V124 HydrophobicContact CD2-CG1 3.86Å; L63-L128 HydrophobicContact CD1-CD1 3.9Å; L63-L128 HydrophobicContact CD1-CD2 4.14Å; L63-L128 HydrophobicContact CD2-CD1 4.1Å; L63-L354 HydrophobicContact CD2-CD1 3.96Å
64	T	98.6	Very high	98.1	Very high	63 Å²	63	64 Å²	64	39%	0.387	34%	0.34	S	S	.	.			trans	-77.6	161.4	169.6	68.2	0	0	0	0	110.8	D66 E67 I68	T64-D66 VanDerWaalsContact C-N 3.27Å; T64-D66 PolarHBondContact O-N 3.21Å; T64-E67 PolarHBondContact N-OE2 2.83Å; T64-E67 PolarHBondContact O-N 2.86Å; T64-E67 VanDerWaalsContact O-N 3.14Å; T64-E67 WeakPolarHBondContact OG1-CB 3.44Å; T64-E67 VanDerWaalsContact OG1-CD 3.27Å; T64-E67 VanDerWaalsContact OG1-CG 3.25Å; T64-E67 WeakPolarHBondContact OG1-CG 3.39Å; T64-E67 PolarHBondContact OG1-N 2.81Å; T64-E67 PolarHBondContact OG1-OE2 2.96Å; T64-I68 WeakPolarHBondContact O-CG1 3.3Å; T64-I68 PolarHBondContact O-N 3.47Å
65	E	98.2	Very high	98.2	Very high	167 Å²	167	59.8 Å²	59.8	78%	0.78	32%	0.324	S	S	*	.	H	α-helix	trans	-57.5	-40.9	175.7	-66	-179	177.4	0	0	111.9	I68 M69	E65-I68 PolarHBondContact O-N 2.78Å; E65-M69 WeakPolarHBondContact O-CB 3.4Å; E65-M69 PolarHBondContact O-N 2.86Å
66	D	97.7	Very high	98.2	Very high	108 Å²	108	63.3 Å²	63.3	58%	0.578	34%	0.343	S	S	*	.	H	α-helix	trans	-63.4	-41.2	176.1	-66.4	-24.5	0	0	0	112.1	T64 M69 I70	T64-D66 VanDerWaalsContact C-N 3.27Å; T64-D66 PolarHBondContact O-N 3.21Å; D66-M69 PolarHBondContact O-N 2.76Å; D66-I70 WeakPolarHBondContact O-CB 3.13Å; D66-I70 WeakPolarHBondContact O-CD1 3.32Å; D66-I70 WeakPolarHBondContact O-CG1 3.42Å; D66-I70 PolarHBondContact O-N 2.78Å
67	E	98.6	Very high	98.3	Very high	4 Å²	4	63.6 Å²	63.6	2%	0.019	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-41.2	178	-77.5	163.5	178	0	0	112	L63 T64 R71 S122 V124 A125 L128 R358	L63-E67 HydrophobicContact CB-CB 4.26Å; T64-E67 PolarHBondContact N-OE2 2.83Å; T64-E67 PolarHBondContact O-N 2.86Å; T64-E67 VanDerWaalsContact O-N 3.14Å; T64-E67 WeakPolarHBondContact OG1-CB 3.44Å; T64-E67 VanDerWaalsContact OG1-CD 3.27Å; T64-E67 VanDerWaalsContact OG1-CG 3.25Å; T64-E67 WeakPolarHBondContact OG1-CG 3.39Å; T64-E67 PolarHBondContact OG1-N 2.81Å; T64-E67 PolarHBondContact OG1-OE2 2.96Å; E67-R71 WeakPolarHBondContact O-CB 3.35Å; E67-R71 PolarHBondContact O-N 2.93Å; E67-S122 PolarHBondContact OE1-OG 3.1Å; E67-V124 HydrophobicContact CG-CG1 4.28Å; E67-V124 WeakPolarHBondContact OE1-CB 3.49Å; E67-A125 HydrophobicContact CG-CB 4.15Å; E67-L128 HydrophobicContact CB-CD1 3.87Å; E67-R358 IonicContact OE1-CZ 3.55Å; E67-R358 IonicContact OE1-NH1 2.72Å; E67-R358 PolarHBondContact OE1-NH1 3.07Å; E67-R358 IonicContact OE1-NH2 3.57Å; E67-R358 IonicContact OE2-CZ 3.39Å; E67-R358 IonicContact OE2-NH1 2.68Å; E67-R358 PolarHBondContact OE2-NH1 2.88Å; E67-R358 IonicContact OE2-NH2 3.48Å; E67-R358 PolarHBondContact OE2-NH2 2.85Å
68	I	98.6	Very high	98.3	Very high	40 Å²	40	58.7 Å²	58.7	21%	0.205	31%	0.313	C	S	.	.	H	α-helix	trans	-62.7	-49.1	174.6	-69.3	168	0	0	0	110	L63 T64 E65 I70 R71 D72	L63-I68 HydrophobicContact CB-CD1 4.14Å; L63-I68 HydrophobicContact CB-CG1 3.72Å; L63-I68 HydrophobicContact CD1-CG1 4.16Å; T64-I68 WeakPolarHBondContact O-CG1 3.3Å; T64-I68 PolarHBondContact O-N 3.47Å; E65-I68 PolarHBondContact O-N 2.78Å; I68-I70 PolarHBondContact O-N 2.84Å; I68-R71 WeakPolarHBondContact O-CB 3.49Å; I68-R71 PolarHBondContact O-N 2.78Å; I68-D72 WeakPolarHBondContact O-CB 3.29Å; I68-D72 PolarHBondContact O-N 2.95Å
69	M	98.3	Very high	98.4	Very high	122 Å²	122	57.4 Å²	57.4	60%	0.601	31%	0.307	S	S	*	.	H	α-helix	trans	-60.6	-45.2	-179.2	-170.6	-171.8	-46.6	0	0	112.2	E65 D66 D72 S73	E65-M69 WeakPolarHBondContact O-CB 3.4Å; E65-M69 PolarHBondContact O-N 2.86Å; D66-M69 PolarHBondContact O-N 2.76Å; M69-D72 PolarHBondContact O-N 3.12Å; M69-S73 VanDerWaalsContact O-CB 3.29Å; M69-S73 WeakPolarHBondContact O-CB 3.24Å; M69-S73 PolarHBondContact O-N 2.76Å
70	I	98.2	Very high	98.4	Very high	48 Å²	48	62.9 Å²	62.9	25%	0.246	34%	0.336	C	S	.	.	H	α-helix	trans	-61.5	-47.3	176.7	-72.2	166.7	0	0	0	110.5	D66 I68 D72 F74 T121 A125 I129	D66-I70 WeakPolarHBondContact O-CB 3.13Å; D66-I70 WeakPolarHBondContact O-CD1 3.32Å; D66-I70 WeakPolarHBondContact O-CG1 3.42Å; D66-I70 PolarHBondContact O-N 2.78Å; I68-I70 PolarHBondContact O-N 2.84Å; I70-D72 PolarHBondContact O-N 2.95Å; I70-F74 WeakPolarHBondContact O-CB 3.21Å; I70-F74 PolarHBondContact O-N 2.87Å; I70-T121 HydrophobicContact CD1-CG2 4.44Å; I70-T121 WeakPolarHBondContact CD1-OG1 3.43Å; I70-A125 HydrophobicContact CD1-CB 4.01Å; I70-A125 HydrophobicContact CG2-CB 4.43Å; I70-I129 HydrophobicContact CG2-CD1 3.72Å; I70-I129 HydrophobicContact CG2-CG1 3.69Å
71	R	98.6	Very high	98.4	Very high	12 Å²	12	64.5 Å²	64.5	5%	0.045	34%	0.342	C	S	.	.	H	α-helix	trans	-58.8	-49	178.5	178.3	-159.5	68.7	-159.9	-0.7	111.3	E60 E67 I68 F74 R75 L128 E132	E60-R71 IonicContact OE1-CZ 3.55Å; E60-R71 IonicContact OE1-NH1 3.39Å; E60-R71 PolarHBondContact OE1-NH1 3.07Å; E60-R71 IonicContact OE1-NH2 2.83Å; E60-R71 PolarHBondContact OE1-NH2 3.38Å; E60-R71 IonicContact OE2-CZ 3.09Å; E60-R71 IonicContact OE2-NH1 3.71Å; E60-R71 PolarHBondContact OE2-NH1 2.97Å; E60-R71 IonicContact OE2-NH2 3.32Å; E60-R71 PolarHBondContact OE2-NH2 3.01Å; E67-R71 WeakPolarHBondContact O-CB 3.35Å; E67-R71 PolarHBondContact O-N 2.93Å; I68-R71 WeakPolarHBondContact O-CB 3.49Å; I68-R71 PolarHBondContact O-N 2.78Å; R71-F74 PolarHBondContact O-N 2.9Å; R71-R75 VanDerWaalsContact O-CB 3.28Å; R71-R75 WeakPolarHBondContact O-CB 3.08Å; R71-R75 PolarHBondContact O-N 2.87Å; R71-L128 HydrophobicContact CB-CB 4.09Å; R71-L128 HydrophobicContact CB-CD1 4.24Å; R71-L128 HydrophobicContact CG-CB 4.29Å; R71-L128 HydrophobicContact CG-CD2 4.42Å; R71-E132 HydrophobicContact CG-CG 3.81Å
72	D	98.6	Very high	98.5	Very high	55 Å²	55	61 Å²	61	29%	0.294	31%	0.307	S	S	.	.	H	α-helix	trans	-69.8	-45.3	-172.9	-70.1	-14.7	0	0	0	111.2	I68 M69 I70 F74 R75 D76	I68-D72 WeakPolarHBondContact O-CB 3.29Å; I68-D72 PolarHBondContact O-N 2.95Å; M69-D72 PolarHBondContact O-N 3.12Å; I70-D72 PolarHBondContact O-N 2.95Å; D72-F74 VanDerWaalsContact C-N 3.31Å; D72-F74 PolarHBondContact O-N 2.94Å; D72-R75 WeakPolarHBondContact O-CB 3.38Å; D72-R75 PolarHBondContact O-N 3.19Å; D72-D76 PolarHBondContact O-N 3.26Å
73	S	98.2	Very high	98.5	Very high	68 Å²	68	59 Å²	59	48%	0.476	30%	0.298	S	S	.	.	H	α-helix	trans	-56.4	-45.3	173.9	179.2	0	0	0	0	111.9	M69 D76 Y77	M69-S73 VanDerWaalsContact O-CB 3.29Å; M69-S73 WeakPolarHBondContact O-CB 3.24Å; M69-S73 PolarHBondContact O-N 2.76Å; S73-D76 PolarHBondContact O-N 2.76Å; S73-Y77 PolarHBondContact O-N 3.39Å
74	F	98.6	Very high	98.5	Very high	2 Å²	2	62.7 Å²	62.7	1%	0.009	32%	0.323	C	S	.	.	H	α-helix	trans	-74.6	-31.4	-179.6	-167.1	-119.2	0	0	0	113.2	I70 R71 D72 D76 Y77 C78 M103 L106 V108 I129 E132 V133	I70-F74 WeakPolarHBondContact O-CB 3.21Å; I70-F74 PolarHBondContact O-N 2.87Å; R71-F74 PolarHBondContact O-N 2.9Å; D72-F74 VanDerWaalsContact C-N 3.31Å; D72-F74 PolarHBondContact O-N 2.94Å; F74-D76 VanDerWaalsContact C-N 3.34Å; F74-Y77 AromaticContact CD2-CD1 3.84Å; F74-Y77 HydrophobicContact CD2-CD1 3.84Å; F74-Y77 AromaticContact CE2-CD1 3.49Å; F74-Y77 HydrophobicContact CE2-CD1 3.49Å; F74-Y77 VanDerWaalsContact CE2-CD1 3.49Å; F74-Y77 AromaticContact CE2-CE1 3.82Å; F74-Y77 HydrophobicContact CE2-CE1 3.82Å; F74-Y77 HydrophobicContact CZ-CD1 4.28Å; F74-Y77 HydrophobicContact CZ-CE1 4.41Å; F74-Y77 PolarHBondContact O-N 2.91Å; F74-C78 WeakPolarHBondContact O-CB 3.3Å; F74-C78 PolarHBondContact O-N 2.96Å; F74-C78 PolarHBondContact O-SG 3.32Å; F74-M103 HydrophobicContact CE2-CG 4.42Å; F74-M103 HydrophobicContact CZ-CE 4.34Å; F74-L106 HydrophobicContact CD2-CD1 4.24Å; F74-L106 HydrophobicContact CE2-CD1 4.4Å; F74-V108 HydrophobicContact CD2-CB 4.39Å; F74-V108 HydrophobicContact CD2-CG1 3.65Å; F74-V108 HydrophobicContact CD2-CG2 4.14Å; F74-V108 HydrophobicContact CE2-CB 4.18Å; F74-V108 HydrophobicContact CE2-CG1 3.93Å; F74-V108 HydrophobicContact CE2-CG2 3.52Å; F74-V108 HydrophobicContact CG-CG1 4.15Å; F74-V108 HydrophobicContact CZ-CG2 3.96Å; F74-I129 HydrophobicContact CD1-CB 4.12Å; F74-I129 HydrophobicContact CD1-CG1 4.36Å; F74-I129 HydrophobicContact CD1-CG2 3.61Å; F74-I129 HydrophobicContact CE1-CB 4.32Å; F74-I129 HydrophobicContact CE1-CG2 3.38Å; F74-I129 WeakPolarHBondContact CE1-O 3.38Å; F74-I129 HydrophobicContact CG-CG2 4.33Å; F74-I129 HydrophobicContact CZ-CG2 3.99Å; F74-E132 HydrophobicContact CD1-CB 4.26Å; F74-V133 HydrophobicContact CE1-CB 3.76Å; F74-V133 HydrophobicContact CE1-CG1 4.18Å; F74-V133 HydrophobicContact CZ-CB 4.15Å
75	R	98.8	Very high	98.5	Very high	75 Å²	75	62.9 Å²	62.9	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-59.6	-46.4	171.4	176.1	-177.8	-69.8	168.2	10.4	110.6	R71 D72 Y77 C78 Q79 E132	R71-R75 VanDerWaalsContact O-CB 3.28Å; R71-R75 WeakPolarHBondContact O-CB 3.08Å; R71-R75 PolarHBondContact O-N 2.87Å; D72-R75 WeakPolarHBondContact O-CB 3.38Å; D72-R75 PolarHBondContact O-N 3.19Å; R75-Y77 PolarHBondContact O-N 3.06Å; R75-C78 WeakPolarHBondContact O-CB 3.46Å; R75-C78 PolarHBondContact O-N 3.16Å; R75-C78 VanDerWaalsContact O-N 3.1Å; R75-Q79 HydrophobicContact CG-CG 4.27Å; R75-Q79 WeakPolarHBondContact O-CG 3.32Å; R75-Q79 PolarHBondContact O-N 2.82Å; R75-E132 HydrophobicContact CB-CB 4.42Å; R75-E132 HydrophobicContact CB-CG 4.1Å; R75-E132 IonicContact CZ-OE1 2.7Å; R75-E132 IonicContact CZ-OE2 3.6Å; R75-E132 VanDerWaalsContact NE-CD 3.34Å; R75-E132 IonicContact NE-OE1 3.24Å; R75-E132 IonicContact NE-OE2 3.57Å; R75-E132 PolarHBondContact NE-OE2 2.82Å; R75-E132 IonicContact NH2-OE1 2.79Å; R75-E132 PolarHBondContact NH2-OE1 2.72Å; R75-E132 IonicContact NH2-OE2 2.79Å
76	D	98.6	Very high	98.5	Very high	99 Å²	99	55 Å²	55	53%	0.529	28%	0.279	S	S	.	.	H	α-helix	trans	-59.6	-47.2	-179.9	-70.9	-12.4	0	0	0	110.7	D72 S73 F74 C78 Q79 D80	D72-D76 PolarHBondContact O-N 3.26Å; S73-D76 PolarHBondContact O-N 2.76Å; F74-D76 VanDerWaalsContact C-N 3.34Å; D76-C78 VanDerWaalsContact C-N 3.35Å; D76-C78 PolarHBondContact O-N 2.82Å; D76-Q79 PolarHBondContact O-N 2.72Å; D76-D80 VanDerWaalsContact O-CB 3.3Å; D76-D80 WeakPolarHBondContact O-CB 3.35Å; D76-D80 PolarHBondContact O-N 3.49Å
77	Y	98.8	Very high	98.6	Very high	22 Å²	22	51.4 Å²	51.4	9%	0.086	26%	0.26	C	S	.	.	H	α-helix	trans	-56.2	-46.4	171.5	166.2	-103.9	0	0	0	112.7	S73 F74 R75 Q79 D80 K81 L82 E102 M103 L106	S73-Y77 PolarHBondContact O-N 3.39Å; F74-Y77 AromaticContact CD2-CD1 3.84Å; F74-Y77 HydrophobicContact CD2-CD1 3.84Å; F74-Y77 AromaticContact CE2-CD1 3.49Å; F74-Y77 HydrophobicContact CE2-CD1 3.49Å; F74-Y77 VanDerWaalsContact CE2-CD1 3.49Å; F74-Y77 AromaticContact CE2-CE1 3.82Å; F74-Y77 HydrophobicContact CE2-CE1 3.82Å; F74-Y77 HydrophobicContact CZ-CD1 4.28Å; F74-Y77 HydrophobicContact CZ-CE1 4.41Å; F74-Y77 PolarHBondContact O-N 2.91Å; R75-Y77 PolarHBondContact O-N 3.06Å; Y77-Q79 VanDerWaalsContact C-N 3.33Å; Y77-Q79 PolarHBondContact O-N 3.15Å; Y77-D80 PolarHBondContact O-N 3Å; Y77-K81 HydrophobicContact CD2-CB 3.72Å; Y77-K81 HydrophobicContact CD2-CG 3.5Å; Y77-K81 HydrophobicContact CE2-CB 3.54Å; Y77-K81 HydrophobicContact CE2-CG 3.67Å; Y77-K81 VanDerWaalsContact O-CB 3.32Å; Y77-K81 WeakPolarHBondContact O-CB 3.32Å; Y77-K81 PolarHBondContact O-N 2.83Å; Y77-L82 HydrophobicContact CD1-CD1 4.46Å; Y77-L82 HydrophobicContact CD1-CG 4.46Å; Y77-L82 HydrophobicContact CE1-CD1 3.9Å; Y77-L82 HydrophobicContact CE1-CD2 4.03Å; Y77-L82 HydrophobicContact CE1-CG 3.89Å; Y77-E102 HydrophobicContact CE2-CB 3.79Å; Y77-E102 HydrophobicContact CE2-CG 4.47Å; Y77-E102 WeakPolarHBondContact CE2-OE2 3.26Å; Y77-E102 VanDerWaalsContact OH-CB 3.23Å; Y77-E102 WeakPolarHBondContact OH-CB 3.47Å; Y77-E102 PolarHBondContact OH-OE2 3.18Å; Y77-M103 HydrophobicContact CE1-CG 4.14Å; Y77-L106 HydrophobicContact CD1-CD1 3.64Å; Y77-L106 HydrophobicContact CD2-CD1 3.54Å; Y77-L106 HydrophobicContact CE1-CD1 4.11Å; Y77-L106 HydrophobicContact CE2-CD1 4.05Å; Y77-L106 HydrophobicContact CG-CD1 3.3Å
78	C	98.8	Very high	98.6	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	28%	0.282	C	S	.	.	I	π-helix	trans	-60.2	-43.5	179.9	-71.8	0	0	0	0	111.7	F74 R75 D76 L82 M83 V136	F74-C78 WeakPolarHBondContact O-CB 3.3Å; F74-C78 PolarHBondContact O-N 2.96Å; F74-C78 PolarHBondContact O-SG 3.32Å; R75-C78 WeakPolarHBondContact O-CB 3.46Å; R75-C78 PolarHBondContact O-N 3.16Å; R75-C78 VanDerWaalsContact O-N 3.1Å; D76-C78 VanDerWaalsContact C-N 3.35Å; D76-C78 PolarHBondContact O-N 2.82Å; C78-L82 HydrophobicContact CB-CD1 4.38Å; C78-L82 VanDerWaalsContact O-CB 3.31Å; C78-L82 WeakPolarHBondContact O-CB 3.27Å; C78-L82 PolarHBondContact O-N 2.87Å; C78-M83 PolarHBondContact O-N 3.11Å; C78-V136 HydrophobicContact CB-CG2 3.82Å
79	Q	98.5	Very high	98.6	Very high	74 Å²	74	53.9 Å²	53.9	35%	0.346	27%	0.272	S	S	.	.	I	π-helix	trans	-72.7	-39.7	179.4	-60.7	-46	-63.3	0	0	112.4	R75 D76 Y77 M83 P84	R75-Q79 HydrophobicContact CG-CG 4.27Å; R75-Q79 WeakPolarHBondContact O-CG 3.32Å; R75-Q79 PolarHBondContact O-N 2.82Å; D76-Q79 PolarHBondContact O-N 2.72Å; Y77-Q79 VanDerWaalsContact C-N 3.33Å; Y77-Q79 PolarHBondContact O-N 3.15Å; Q79-M83 WeakPolarHBondContact O-CB 3.35Å; Q79-P84 WeakPolarHBondContact O-CD 3.24Å
80	D	98.4	Very high	98.6	Very high	118 Å²	118	48.7 Å²	48.7	63%	0.631	25%	0.247	S	C	*	.	I	π-helix	trans	-82.9	-32.4	-173.8	-73.3	-8.8	0	0	0	113.4	D76 Y77	D76-D80 VanDerWaalsContact O-CB 3.3Å; D76-D80 WeakPolarHBondContact O-CB 3.35Å; D76-D80 PolarHBondContact O-N 3.49Å; Y77-D80 PolarHBondContact O-N 3Å
81	K	98.5	Very high	98.7	Very high	109 Å²	109	50.6 Å²	50.6	47%	0.474	25%	0.251	S	S	.	.	I	π-helix	trans	-111.3	-39.2	-173	-56.3	-59.8	-175.5	177	0	113.5	Y77 R85	Y77-K81 HydrophobicContact CD2-CB 3.72Å; Y77-K81 HydrophobicContact CD2-CG 3.5Å; Y77-K81 HydrophobicContact CE2-CB 3.54Å; Y77-K81 HydrophobicContact CE2-CG 3.67Å; Y77-K81 VanDerWaalsContact O-CB 3.32Å; Y77-K81 WeakPolarHBondContact O-CB 3.32Å; Y77-K81 PolarHBondContact O-N 2.83Å; K81-R85 WeakPolarHBondContact O-CD 3.43Å; K81-R85 WeakPolarHBondContact O-CG 3.41Å; K81-R85 PolarHBondContact O-NE 2.98Å; K81-R85 PolarHBondContact O-NH1 2.82Å
82	L	98.8	Very high	98.7	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.273	C	S	.	.	I	π-helix	trans	-88.7	-46.7	-175.2	-54.6	-174.7	0	0	0	112.4	Y77 C78 R85 I86 I99 M103 V133 V136 Y140	Y77-L82 HydrophobicContact CD1-CD1 4.46Å; Y77-L82 HydrophobicContact CD1-CG 4.46Å; Y77-L82 HydrophobicContact CE1-CD1 3.9Å; Y77-L82 HydrophobicContact CE1-CD2 4.03Å; Y77-L82 HydrophobicContact CE1-CG 3.89Å; C78-L82 HydrophobicContact CB-CD1 4.38Å; C78-L82 VanDerWaalsContact O-CB 3.31Å; C78-L82 WeakPolarHBondContact O-CB 3.27Å; C78-L82 PolarHBondContact O-N 2.87Å; L82-R85 PolarHBondContact O-N 2.75Å; L82-I86 PolarHBondContact O-N 3.07Å; L82-I99 HydrophobicContact CD2-CB 4.49Å; L82-I99 HydrophobicContact CD2-CD1 3.91Å; L82-I99 HydrophobicContact CD2-CG1 3.88Å; L82-I99 HydrophobicContact CD2-CG2 3.85Å; L82-M103 HydrophobicContact CD1-CE 4.11Å; L82-V133 HydrophobicContact CD1-CG2 3.95Å; L82-V136 HydrophobicContact CB-CB 4.46Å; L82-V136 HydrophobicContact CB-CG1 3.87Å; L82-V136 HydrophobicContact CB-CG2 4.42Å; L82-Y140 HydrophobicContact CB-CD2 4.02Å; L82-Y140 HydrophobicContact CB-CE2 3.95Å; L82-Y140 HydrophobicContact CD1-CD2 4.06Å; L82-Y140 HydrophobicContact CD2-CD2 4.41Å; L82-Y140 HydrophobicContact CD2-CE2 4.45Å; L82-Y140 HydrophobicContact CG-CD2 4.41Å
83	M	98.7	Very high	98.7	Very high	36 Å²	36	53.9 Å²	53.9	18%	0.177	27%	0.268	C	S	.	.	H	α-helix	trans	-58.4	-38.3	-176.8	-165.6	63.5	-171.3	0	0	113.8	C78 Q79 R85 I86 V136 F310 H402	C78-M83 PolarHBondContact O-N 3.11Å; Q79-M83 WeakPolarHBondContact O-CB 3.35Å; M83-R85 PolarHBondContact O-N 2.67Å; M83-I86 WeakPolarHBondContact O-CG2 3.42Å; M83-I86 HydrophobicContact SD-CG2 4.06Å; M83-V136 HydrophobicContact CB-CG1 4.39Å; M83-V136 HydrophobicContact CB-CG2 4.48Å; M83-V136 HydrophobicContact SD-CG1 4Å; M83-F310 HydrophobicContact CE-CE2 3.84Å; M83-F310 HydrophobicContact CE-CZ 4.07Å; M83-H402 WeakPolarHBondContact CE-CD2 3.37Å; M83-H402 WeakPolarHBondContact CE-NE2 3.5Å
84	P	98.6	Very high	98.7	Very high	94 Å²	94	53.5 Å²	53.5	61%	0.61	26%	0.263	S	S	*	.	H	α-helix	trans	-67.8	-23.1	176.5	-23.4	36.5	0	0	0	113.9	Q79	Q79-P84 WeakPolarHBondContact O-CD 3.24Å
85	R	98.6	Very high	98.7	Very high	68 Å²	68	54.9 Å²	54.9	26%	0.257	27%	0.269	S	S	.	.	H	α-helix	trans	-87	-28.9	-177.4	-63.3	174.5	-178.9	152.4	-6.7	112.5	K81 L82 M83 L87 A89 E102	K81-R85 WeakPolarHBondContact O-CD 3.43Å; K81-R85 WeakPolarHBondContact O-CG 3.41Å; K81-R85 PolarHBondContact O-NE 2.98Å; K81-R85 PolarHBondContact O-NH1 2.82Å; L82-R85 PolarHBondContact O-N 2.75Å; M83-R85 PolarHBondContact O-N 2.67Å; R85-L87 PolarHBondContact O-N 2.95Å; R85-A89 VanDerWaalsContact O-CB 3.24Å; R85-A89 WeakPolarHBondContact O-CB 3.42Å; R85-A89 PolarHBondContact O-N 3.35Å; R85-E102 IonicContact CZ-OE1 3.89Å; R85-E102 IonicContact CZ-OE2 2.7Å; R85-E102 IonicContact NH1-OE1 2.73Å; R85-E102 PolarHBondContact NH1-OE1 2.87Å; R85-E102 IonicContact NH1-OE2 3.72Å; R85-E102 PolarHBondContact NH1-OE2 3.22Å; R85-E102 IonicContact NH2-OE1 2.73Å; R85-E102 PolarHBondContact NH2-OE1 3.04Å; R85-E102 IonicContact NH2-OE2 3.19Å
86	I	98.8	Very high	98.6	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.2	-34.6	-161.3	-170.4	56.6	0	0	0	114.4	L82 M83 A89 N90 V136 D137 Y140 A261	L82-I86 PolarHBondContact O-N 3.07Å; M83-I86 WeakPolarHBondContact O-CG2 3.42Å; M83-I86 HydrophobicContact SD-CG2 4.06Å; I86-A89 PolarHBondContact O-N 2.82Å; I86-N90 HydrophobicContact CD1-CB 4.35Å; I86-N90 VanDerWaalsContact O-CB 3.25Å; I86-N90 WeakPolarHBondContact O-CB 3.26Å; I86-N90 PolarHBondContact O-N 2.97Å; I86-V136 HydrophobicContact CB-CG1 4.3Å; I86-V136 HydrophobicContact CG2-CG1 4.36Å; I86-D137 HydrophobicContact CD1-CB 3.45Å; I86-D137 VanDerWaalsContact CD1-CB 3.45Å; I86-D137 WeakPolarHBondContact CD1-OD2 3.21Å; I86-D137 HydrophobicContact CG1-CB 3.8Å; I86-Y140 HydrophobicContact CB-CE2 4.15Å; I86-Y140 HydrophobicContact CD1-CD2 4.4Å; I86-Y140 HydrophobicContact CD1-CE1 4.33Å; I86-Y140 HydrophobicContact CD1-CE2 3.7Å; I86-Y140 HydrophobicContact CG1-CE2 4.32Å; I86-A261 HydrophobicContact CD1-CB 3.55Å
87	L	98.8	Very high	98.5	Very high	33 Å²	33	52.8 Å²	52.8	17%	0.173	26%	0.256	C	S	.	.	H	α-helix	trans	-57.5	-56.7	-177.5	179.4	63.8	0	0	0	110.9	R85 R91 D399 E400	R85-L87 PolarHBondContact O-N 2.95Å; L87-R91 VanDerWaalsContact O-CB 3.32Å; L87-R91 WeakPolarHBondContact O-CB 3.48Å; L87-R91 PolarHBondContact O-N 3.41Å; L87-D399 HydrophobicContact CD1-CB 4.25Å; L87-D399 WeakPolarHBondContact CD1-O 3.37Å; L87-E400 WeakPolarHBondContact CD2-OE2 3.4Å
88	M	98.8	Very high	98.5	Very high	96 Å²	96	56.8 Å²	56.8	47%	0.473	28%	0.279	S	S	.	.	H	α-helix	trans	-73.9	-34.1	-179.2	-64.3	-52.7	-59.8	0	0	112.1	R91 N92	M88-R91 PolarHBondContact O-N 2.91Å; M88-N92 WeakPolarHBondContact CE-ND2 3.3Å; M88-N92 WeakPolarHBondContact O-CB 3.31Å; M88-N92 PolarHBondContact O-N 2.78Å
89	A	98.8	Very high	98.4	Very high	1 Å²	1	56.9 Å²	56.9	1%	0.008	28%	0.28	C	S	.	.	H	α-helix	trans	-58.2	-49.7	174.9	0	0	0	0	0	111.8	R85 I86 E93 V94 A261	R85-A89 VanDerWaalsContact O-CB 3.24Å; R85-A89 WeakPolarHBondContact O-CB 3.42Å; R85-A89 PolarHBondContact O-N 3.35Å; I86-A89 PolarHBondContact O-N 2.82Å; A89-E93 WeakPolarHBondContact O-CA 3.47Å; A89-E93 PolarHBondContact O-N 2.58Å; A89-V94 WeakPolarHBondContact CB-O 3.16Å; A89-V94 PolarHBondContact O-N 2.82Å; A89-A261 HydrophobicContact CB-CB 4.1Å
90	N	98.9	Very high	98.4	Very high	13 Å²	13	53.4 Å²	53.4	7%	0.07	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-42.7	178.4	177.6	79.6	0	0	0	112.2	I86 N92 R260 R405	I86-N90 HydrophobicContact CD1-CB 4.35Å; I86-N90 VanDerWaalsContact O-CB 3.25Å; I86-N90 WeakPolarHBondContact O-CB 3.26Å; I86-N90 PolarHBondContact O-N 2.97Å; N90-N92 VanDerWaalsContact C-N 3.32Å; N90-N92 PolarHBondContact O-N 3.38Å; N90-R260 VanDerWaalsContact O-CB 3.23Å; N90-R260 WeakPolarHBondContact O-CB 3.23Å; N90-R260 PolarHBondContact O-NE 3.3Å; N90-R405 VanDerWaalsContact CB-CD 3.46Å; N90-R405 HydrophobicContact CB-CG 4.31Å
91	R	98.8	Very high	98.3	Very high	87 Å²	87	49.6 Å²	49.6	33%	0.328	25%	0.246	S	C	.	.	H	α-helix	trans	-60.1	-43.4	-179.6	-171.8	175.7	-69.1	168.2	-5.1	111.5	L87 M88 R260 D399 E400	L87-R91 VanDerWaalsContact O-CB 3.32Å; L87-R91 WeakPolarHBondContact O-CB 3.48Å; L87-R91 PolarHBondContact O-N 3.41Å; M88-R91 PolarHBondContact O-N 2.91Å; R91-R260 PolarHBondContact O-NH2 3.43Å; R91-D399 IonicContact CZ-OD1 2.75Å; R91-D399 IonicContact CZ-OD2 2.9Å; R91-D399 IonicContact NE-OD1 3.97Å; R91-D399 IonicContact NE-OD2 3.99Å; R91-D399 PolarHBondContact NE-OD2 2.99Å; R91-D399 IonicContact NH2-OD1 3.06Å; R91-D399 PolarHBondContact NH2-OD1 2.78Å; R91-D399 IonicContact NH2-OD2 2.68Å; R91-D399 PolarHBondContact NH2-OD2 3.14Å; R91-D399 VanDerWaalsContact NH2-OD2 3.1Å; R91-E400 IonicContact CZ-OE1 3.75Å; R91-E400 IonicContact NH1-OE1 3.39Å; R91-E400 IonicContact NH2-OE1 3.72Å; R91-E400 PolarHBondContact NH2-OE1 3.36Å
92	N	98.8	Very high	98.3	Very high	94 Å²	94	46.1 Å²	46.1	50%	0.503	23%	0.232	S	C	.	.	H	α-helix	trans	-102	7.6	-172	-62	-17.5	0	0	0	114.7	M88 N90 V94	M88-N92 WeakPolarHBondContact CE-ND2 3.3Å; M88-N92 WeakPolarHBondContact O-CB 3.31Å; M88-N92 PolarHBondContact O-N 2.78Å; N90-N92 VanDerWaalsContact C-N 3.32Å; N90-N92 PolarHBondContact O-N 3.38Å; N92-V94 VanDerWaalsContact C-N 3.32Å; N92-V94 HydrophobicContact CB-CG2 3.92Å; N92-V94 PolarHBondContact O-N 2.96Å
93	E	98.6	Very high	98.3	Very high	43 Å²	43	46.1 Å²	46.1	20%	0.201	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.8	42.5	-176	-70.9	172.5	-106.5	0	0	113.8	A89 R260	A89-E93 WeakPolarHBondContact O-CA 3.47Å; A89-E93 PolarHBondContact O-N 2.58Å; E93-R260 VanDerWaalsContact CA-O 3.3Å; E93-R260 WeakPolarHBondContact CA-O 3.34Å; E93-R260 HydrophobicContact CG-CB 3.76Å; E93-R260 HydrophobicContact CG-CG 3.97Å; E93-R260 VanDerWaalsContact CG-CZ 3.4Å; E93-R260 IonicContact OE1-CZ 3.63Å; E93-R260 IonicContact OE1-NH1 2.82Å; E93-R260 PolarHBondContact OE1-NH1 2.85Å; E93-R260 IonicContact OE1-NH2 3.76Å; E93-R260 PolarHBondContact OE1-NH2 2.06Å; E93-R260 IonicContact OE2-NH1 3.35Å
94	V	98.5	Very high	98.2	Very high	60 Å²	60	44.9 Å²	44.9	36%	0.364	23%	0.228	S	C	.	.			trans	-101.3	120.1	-179.4	178.4	0	0	0	0	110.5	A89 N92	A89-V94 WeakPolarHBondContact CB-O 3.16Å; A89-V94 PolarHBondContact O-N 2.82Å; N92-V94 VanDerWaalsContact C-N 3.32Å; N92-V94 HydrophobicContact CB-CG2 3.92Å; N92-V94 PolarHBondContact O-N 2.96Å
95	F	98.2	Very high	98.2	Very high	31 Å²	31	48.3 Å²	48.3	14%	0.136	24%	0.236	C	C	.	.			trans	-96	126.4	165.9	170.5	-113.1	0	0	0	109.8	R97 V100 V143 L177 V221 A263	F95-R97 HydrophobicContact CE1-CB 4.4Å; F95-V100 HydrophobicContact CZ-CG2 3.72Å; F95-V143 HydrophobicContact CD2-CG2 4.18Å; F95-V143 HydrophobicContact CE2-CB 4.42Å; F95-V143 HydrophobicContact CE2-CG1 4.04Å; F95-V143 HydrophobicContact CE2-CG2 3.63Å; F95-V143 HydrophobicContact CZ-CG1 4.07Å; F95-V143 HydrophobicContact CZ-CG2 4.27Å; F95-L177 HydrophobicContact CE1-CD2 4.01Å; F95-L177 HydrophobicContact CZ-CD2 4.25Å; F95-V221 HydrophobicContact CD1-CG2 3.9Å; F95-V221 HydrophobicContact CE1-CG2 3.83Å; F95-A263 HydrophobicContact CB-CB 4.1Å; F95-A263 HydrophobicContact CD1-CB 4.14Å; F95-A263 HydrophobicContact CG-CB 4.25Å
96	H	97.8	Very high	98.1	Very high	65 Å²	65	48.7 Å²	48.7	30%	0.301	24%	0.242	S	C	.	.			trans	-94.2	108.1	177.2	-59.9	91.5	0	0	0	109.5	D98 I99	H96-D98 PolarHBondContact O-N 3.3Å; H96-I99 HydrophobicContact CB-CD1 3.87Å; H96-I99 HydrophobicContact CB-CG1 4.06Å; H96-I99 WeakPolarHBondContact O-CB 3.44Å; H96-I99 PolarHBondContact O-N 2.69Å
97	R	96.9	Very high	98	Very high	64 Å²	64	50 Å²	50	24%	0.242	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-31.9	-178.4	177.7	57	172.2	76.3	1.7	113	F95 I99 V100 G174 E175 D223	F95-R97 HydrophobicContact CE1-CB 4.4Å; R97-I99 PolarHBondContact O-N 3.32Å; R97-V100 WeakPolarHBondContact O-CB 3.42Å; R97-V100 WeakPolarHBondContact O-CG2 3.48Å; R97-V100 PolarHBondContact O-N 2.81Å; R97-G174 PolarHBondContact NH1-O 2.58Å; R97-E175 PolarHBondContact NH2-O 3.15Å; R97-D223 IonicContact NH2-OD2 3.52Å; R97-D223 PolarHBondContact NH2-OD2 3.13Å
98	D	97.3	Very high	97.9	Very high	107 Å²	107	48.8 Å²	48.8	57%	0.572	25%	0.249	S	C	*	.	H	α-helix	trans	-60.7	-26.7	-179.4	-55.2	-22.9	0	0	0	112.6	H96 V100 S101 E102	H96-D98 PolarHBondContact O-N 3.3Å; D98-V100 PolarHBondContact O-N 2.87Å; D98-S101 PolarHBondContact O-N 2.89Å; D98-E102 WeakPolarHBondContact O-CG 3.34Å; D98-E102 PolarHBondContact O-N 3.15Å
99	I	97.9	Very high	97.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.005	23%	0.227	C	C	.	.	H	α-helix	trans	-56.6	-34.6	175.2	-69.2	172.3	0	0	0	111.2	L82 H96 R97 M103 Y140	L82-I99 HydrophobicContact CD2-CB 4.49Å; L82-I99 HydrophobicContact CD2-CD1 3.91Å; L82-I99 HydrophobicContact CD2-CG1 3.88Å; L82-I99 HydrophobicContact CD2-CG2 3.85Å; H96-I99 HydrophobicContact CB-CD1 3.87Å; H96-I99 HydrophobicContact CB-CG1 4.06Å; H96-I99 WeakPolarHBondContact O-CB 3.44Å; H96-I99 PolarHBondContact O-N 2.69Å; R97-I99 PolarHBondContact O-N 3.32Å; I99-M103 HydrophobicContact CG2-CE 3.62Å; I99-M103 HydrophobicContact CG2-CG 4.41Å; I99-M103 HydrophobicContact CG2-SD 4.09Å; I99-M103 WeakPolarHBondContact O-CB 3.32Å; I99-M103 VanDerWaalsContact O-CG 3.23Å; I99-M103 WeakPolarHBondContact O-CG 3.19Å; I99-M103 PolarHBondContact O-N 3.04Å; I99-Y140 HydrophobicContact CD1-CD1 4.03Å; I99-Y140 HydrophobicContact CD1-CE1 3.57Å; I99-Y140 HydrophobicContact CD1-CE2 4.45Å
100	V	97.8	Very high	97.9	Very high	1 Å²	1	44.3 Å²	44.3	1%	0.006	23%	0.227	C	C	.	.	H	α-helix	trans	-68.1	-42.5	178.7	-174.3	0	0	0	0	110.3	F95 R97 D98 M103 G104 L109 V143 L177	F95-V100 HydrophobicContact CZ-CG2 3.72Å; R97-V100 WeakPolarHBondContact O-CB 3.42Å; R97-V100 WeakPolarHBondContact O-CG2 3.48Å; R97-V100 PolarHBondContact O-N 2.81Å; D98-V100 PolarHBondContact O-N 2.87Å; V100-M103 PolarHBondContact O-N 3.17Å; V100-G104 PolarHBondContact O-N 3.4Å; V100-L109 HydrophobicContact CG1-CD1 4.08Å; V100-L109 WeakPolarHBondContact O-CD1 3.48Å; V100-V143 HydrophobicContact CG2-CG1 3.92Å; V100-L177 HydrophobicContact CG1-CD1 4.06Å; V100-L177 HydrophobicContact CG2-CD1 3.95Å; V100-L177 HydrophobicContact CG2-CD2 4.43Å
101	S	97.3	Very high	97.9	Very high	38 Å²	38	43.8 Å²	43.8	27%	0.266	23%	0.225	S	C	.	.	H	α-helix	trans	-67.8	-44.3	177.8	-58.2	0	0	0	0	111.1	D98 M103 G104 E105 G174	D98-S101 PolarHBondContact O-N 2.89Å; S101-M103 VanDerWaalsContact C-N 3.34Å; S101-M103 PolarHBondContact O-N 2.86Å; S101-G104 CarbonylContact O-C 3.56Å; S101-G104 WeakPolarHBondContact O-CA 3.43Å; S101-G104 PolarHBondContact O-N 3.12Å; S101-E105 WeakPolarHBondContact O-CG 3.42Å; S101-E105 PolarHBondContact O-N 3.32Å; S101-G174 PolarHBondContact OG-O 2.7Å
102	E	98.4	Very high	97.8	Very high	37 Å²	37	41.1 Å²	41.1	17%	0.173	22%	0.218	C	C	.	.	H	α-helix	trans	-58.1	-43.4	174	-69.1	171.8	-174.2	0	0	111.8	Y77 R85 D98 G104 E105 L106	Y77-E102 HydrophobicContact CE2-CB 3.79Å; Y77-E102 HydrophobicContact CE2-CG 4.47Å; Y77-E102 WeakPolarHBondContact CE2-OE2 3.26Å; Y77-E102 VanDerWaalsContact OH-CB 3.23Å; Y77-E102 WeakPolarHBondContact OH-CB 3.47Å; Y77-E102 PolarHBondContact OH-OE2 3.18Å; R85-E102 IonicContact CZ-OE1 3.89Å; R85-E102 IonicContact CZ-OE2 2.7Å; R85-E102 IonicContact NH1-OE1 2.73Å; R85-E102 PolarHBondContact NH1-OE1 2.87Å; R85-E102 IonicContact NH1-OE2 3.72Å; R85-E102 PolarHBondContact NH1-OE2 3.22Å; R85-E102 IonicContact NH2-OE1 2.73Å; R85-E102 PolarHBondContact NH2-OE1 3.04Å; R85-E102 IonicContact NH2-OE2 3.19Å; D98-E102 WeakPolarHBondContact O-CG 3.34Å; D98-E102 PolarHBondContact O-N 3.15Å; E102-G104 VanDerWaalsContact C-N 3.3Å; E102-G104 PolarHBondContact O-N 3.09Å; E102-E105 PolarHBondContact O-N 2.72Å; E102-L106 WeakPolarHBondContact O-CG 3.36Å; E102-L106 PolarHBondContact O-N 3.3Å
103	M	98.1	Very high	97.8	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-64.2	-34.4	173.5	-76.7	178.3	-179.1	0	0	112.7	F74 Y77 L82 I99 V100 S101 L106 G107 V108 L109 V133 M144	F74-M103 HydrophobicContact CE2-CG 4.42Å; F74-M103 HydrophobicContact CZ-CE 4.34Å; Y77-M103 HydrophobicContact CE1-CG 4.14Å; L82-M103 HydrophobicContact CD1-CE 4.11Å; I99-M103 HydrophobicContact CG2-CE 3.62Å; I99-M103 HydrophobicContact CG2-CG 4.41Å; I99-M103 HydrophobicContact CG2-SD 4.09Å; I99-M103 WeakPolarHBondContact O-CB 3.32Å; I99-M103 VanDerWaalsContact O-CG 3.23Å; I99-M103 WeakPolarHBondContact O-CG 3.19Å; I99-M103 PolarHBondContact O-N 3.04Å; V100-M103 PolarHBondContact O-N 3.17Å; S101-M103 VanDerWaalsContact C-N 3.34Å; S101-M103 PolarHBondContact O-N 2.86Å; M103-L106 PolarHBondContact O-N 3.29Å; M103-G107 PolarHBondContact O-N 3.18Å; M103-V108 HydrophobicContact CB-CG2 3.7Å; M103-V108 HydrophobicContact CG-CG2 3.98Å; M103-V108 VanDerWaalsContact O-CG2 3.22Å; M103-V108 WeakPolarHBondContact O-CG2 3.43Å; M103-V108 PolarHBondContact O-N 3.24Å; M103-L109 HydrophobicContact CB-CD1 4.38Å; M103-L109 HydrophobicContact CB-CD2 3.93Å; M103-L109 HydrophobicContact CB-CG 4.03Å; M103-L109 HydrophobicContact SD-CD2 4.39Å; M103-V133 HydrophobicContact CE-CG2 3.93Å; M103-M144 HydrophobicContact SD-CB 4.22Å; M103-M144 HydrophobicContact SD-CG 4.45Å
104	G	97.8	Very high	97.8	Very high	9 Å²	9	41.9 Å²	41.9	9%	0.093	22%	0.216	C	C	.	.	H	α-helix	trans	-68.5	-40.8	176.1	0	0	0	0	0	113	V100 S101 E102 L106 G107 A172	V100-G104 PolarHBondContact O-N 3.4Å; S101-G104 CarbonylContact O-C 3.56Å; S101-G104 WeakPolarHBondContact O-CA 3.43Å; S101-G104 PolarHBondContact O-N 3.12Å; E102-G104 VanDerWaalsContact C-N 3.3Å; E102-G104 PolarHBondContact O-N 3.09Å; G104-L106 PolarHBondContact O-N 3.31Å; G104-G107 PolarHBondContact O-N 3.21Å; G104-A172 WeakPolarHBondContact CA-O 3.22Å
105	E	97.1	Very high	97.7	Very high	167 Å²	167	41.1 Å²	41.1	78%	0.78	22%	0.221	S	C	*	.	H	α-helix	trans	-60.8	-34.7	174.5	-71.4	173.9	-173.6	0	0	112.3	S101 E102 G107	S101-E105 WeakPolarHBondContact O-CG 3.42Å; S101-E105 PolarHBondContact O-N 3.32Å; E102-E105 PolarHBondContact O-N 2.72Å; E105-G107 VanDerWaalsContact C-N 3.28Å; E105-G107 PolarHBondContact O-N 3.25Å
106	L	97	Very high	97.7	Very high	76 Å²	76	41.7 Å²	41.7	40%	0.398	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-7.1	175.8	-66.1	170.4	0	0	0	113.6	F74 Y77 E102 M103 G104 V108	F74-L106 HydrophobicContact CD2-CD1 4.24Å; F74-L106 HydrophobicContact CE2-CD1 4.4Å; Y77-L106 HydrophobicContact CD1-CD1 3.64Å; Y77-L106 HydrophobicContact CD2-CD1 3.54Å; Y77-L106 HydrophobicContact CE1-CD1 4.11Å; Y77-L106 HydrophobicContact CE2-CD1 4.05Å; Y77-L106 HydrophobicContact CG-CD1 3.3Å; E102-L106 WeakPolarHBondContact O-CG 3.36Å; E102-L106 PolarHBondContact O-N 3.3Å; M103-L106 PolarHBondContact O-N 3.29Å; G104-L106 PolarHBondContact O-N 3.31Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 HydrophobicContact CB-CG1 4.29Å; L106-V108 PolarHBondContact O-N 3.04Å
107	G	96.6	Very high	97.7	Very high	26 Å²	26	42 Å²	42	27%	0.268	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.8	22.2	179.3	0	0	0	0	0	114.7	M103 G104 E105	M103-G107 PolarHBondContact O-N 3.18Å; G104-G107 PolarHBondContact O-N 3.21Å; E105-G107 VanDerWaalsContact C-N 3.28Å; E105-G107 PolarHBondContact O-N 3.25Å
108	V	97.8	Very high	97.7	Very high	8 Å²	8	39.8 Å²	39.8	5%	0.048	24%	0.237	C	C	.	.			trans	-92	-2.9	-177.9	-60.3	0	0	0	0	114.2	F74 M103 L106 P111 I129	F74-V108 HydrophobicContact CD2-CB 4.39Å; F74-V108 HydrophobicContact CD2-CG1 3.65Å; F74-V108 HydrophobicContact CD2-CG2 4.14Å; F74-V108 HydrophobicContact CE2-CB 4.18Å; F74-V108 HydrophobicContact CE2-CG1 3.93Å; F74-V108 HydrophobicContact CE2-CG2 3.52Å; F74-V108 HydrophobicContact CG-CG1 4.15Å; F74-V108 HydrophobicContact CZ-CG2 3.96Å; M103-V108 HydrophobicContact CB-CG2 3.7Å; M103-V108 HydrophobicContact CG-CG2 3.98Å; M103-V108 VanDerWaalsContact O-CG2 3.22Å; M103-V108 WeakPolarHBondContact O-CG2 3.43Å; M103-V108 PolarHBondContact O-N 3.24Å; L106-V108 VanDerWaalsContact C-N 3.33Å; L106-V108 HydrophobicContact CB-CG1 4.29Å; L106-V108 PolarHBondContact O-N 3.04Å; V108-P111 WeakPolarHBondContact O-CD 3.14Å; V108-I129 HydrophobicContact CB-CD1 4.19Å; V108-I129 HydrophobicContact CB-CG2 4.06Å; V108-I129 HydrophobicContact CG1-CD1 4.01Å; V108-I129 HydrophobicContact CG1-CG1 4.41Å; V108-I129 HydrophobicContact CG1-CG2 4.35Å
109	L	98.6	Very high	97.7	Very high	2 Å²	2	37.8 Å²	37.8	1%	0.01	24%	0.236	C	C	.	.	S	Bend	trans	-88.5	126.8	175	-59.3	-178.8	0	0	0	110.5	V100 M103 M144 Q147 M152 L171	V100-L109 HydrophobicContact CG1-CD1 4.08Å; V100-L109 WeakPolarHBondContact O-CD1 3.48Å; M103-L109 HydrophobicContact CB-CD1 4.38Å; M103-L109 HydrophobicContact CB-CD2 3.93Å; M103-L109 HydrophobicContact CB-CG 4.03Å; M103-L109 HydrophobicContact SD-CD2 4.39Å; L109-M144 HydrophobicContact CD2-CG 4.13Å; L109-Q147 HydrophobicContact CB-CG 4.48Å; L109-Q147 HydrophobicContact CD1-CG 4.15Å; L109-Q147 HydrophobicContact CD2-CB 4.39Å; L109-Q147 HydrophobicContact CD2-CG 4.1Å; L109-Q147 HydrophobicContact CG-CG 4.47Å; L109-M152 HydrophobicContact CB-SD 4.2Å; L109-L171 WeakPolarHBondContact CD1-O 3.11Å
110	G	98.2	Very high	97.7	Very high	1 Å²	1	39.1 Å²	39.1	1%	0.01	25%	0.249	C	C	.	.	S	Bend	trans	62	44.5	-173	0	0	0	0	0	113.9	T112 I113 C118 S148	G110-T112 PolarHBondContact O-N 2.9Å; G110-T112 VanDerWaalsContact O-N 3.08Å; G110-I113 WeakPolarHBondContact O-CB 3.01Å; G110-I113 PolarHBondContact O-N 2.89Å; G110-C118 WeakPolarHBondContact O-CB 3.12Å; G110-S148 PolarHBondContact N-OG 3.2Å
111	P	97.7	Very high	97.6	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.013	26%	0.258	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-30.6	-164.2	25.1	-33.7	0	0	0	113.2	V108 G120 T121 Y126 I129	V108-P111 WeakPolarHBondContact O-CD 3.14Å; P111-G120 CarbonylContact O-C 3.58Å; P111-G120 WeakPolarHBondContact O-CA 3.48Å; P111-G120 PolarHBondContact O-N 3.36Å; P111-T121 HydrophobicContact CB-CG2 3.66Å; P111-T121 VanDerWaalsContact O-CG2 3.29Å; P111-T121 WeakPolarHBondContact O-CG2 3.33Å; P111-T121 PolarHBondContact O-N 3.47Å; P111-Y126 HydrophobicContact CG-CD2 3.67Å; P111-Y126 HydrophobicContact CG-CG 3.96Å; P111-I129 HydrophobicContact CB-CD1 4.12Å; P111-I129 HydrophobicContact CG-CD1 4.49Å
112	T	98.1	Very high	97.7	Very high	32 Å²	32	40 Å²	40	20%	0.196	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	-6.1	-178.4	60.7	0	0	0	0	114.2	G110 Y123	G110-T112 PolarHBondContact O-N 2.9Å; G110-T112 VanDerWaalsContact O-N 3.08Å; T112-Y123 HydrophobicContact CG2-CD1 4.2Å; T112-Y123 HydrophobicContact CG2-CD2 4.07Å; T112-Y123 HydrophobicContact CG2-CE1 4.24Å; T112-Y123 HydrophobicContact CG2-CE2 4.12Å; T112-Y123 HydrophobicContact CG2-CG 4.12Å
113	I	98.6	Very high	97.7	Very high	4 Å²	4	40.2 Å²	40.2	2%	0.021	25%	0.254	C	S	.	.			trans	-75.1	133.2	178.9	-69	171.1	0	0	0	109	G110 Y116 C118 G120 M152 Y156 L168	G110-I113 WeakPolarHBondContact O-CB 3.01Å; G110-I113 PolarHBondContact O-N 2.89Å; I113-Y116 HydrophobicContact CG2-CD2 4.27Å; I113-C118 HydrophobicContact CB-CB 3.77Å; I113-C118 HydrophobicContact CG2-CB 3.9Å; I113-C118 WeakPolarHBondContact O-CB 3.48Å; I113-G120 WeakPolarHBondContact O-CA 3.32Å; I113-G120 PolarHBondContact O-N 3.47Å; I113-G120 VanDerWaalsContact O-N 3.07Å; I113-M152 HydrophobicContact CD1-CB 3.6Å; I113-M152 HydrophobicContact CD1-CE 4.29Å; I113-Y156 HydrophobicContact CD1-CG 4.41Å; I113-Y156 HydrophobicContact CG1-CD1 4.34Å; I113-Y156 HydrophobicContact CG1-CG 4.15Å; I113-Y156 HydrophobicContact CG2-CD2 3.6Å; I113-Y156 HydrophobicContact CG2-CE2 3.8Å; I113-Y156 HydrophobicContact CG2-CG 4.07Å; I113-L168 HydrophobicContact CD1-CD2 4.45Å
114	K	97.6	Very high	97.7	Very high	148 Å²	148	40.2 Å²	40.2	64%	0.643	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.1	127.4	176.8	-61.7	-174.7	179.2	-172.1	0	109.9
115	G	97.9	Very high	97.8	Very high	45 Å²	45	39.8 Å²	39.8	46%	0.464	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	84.7	-168.8	-176.3	0	0	0	0	0	112.9	G117 C118	G115-G117 PolarHBondContact O-N 2.99Å; G115-G117 VanDerWaalsContact O-N 3.07Å; G115-C118 WeakPolarHBondContact O-CB 3.48Å; G115-C118 PolarHBondContact O-N 3.05Å
116	Y	98.3	Very high	97.8	Very high	43 Å²	43	31.9 Å²	31.9	17%	0.169	21%	0.212	C	C	.	.	T	Hydrogen-bonded Turn	trans	53.8	28.5	176.8	-44.6	-80.6	0	0	0	115.1	I113 C118 Y156 E161 K164 E165 L168 P169	I113-Y116 HydrophobicContact CG2-CD2 4.27Å; Y116-C118 VanDerWaalsContact C-N 3.32Å; Y116-C118 PolarHBondContact O-N 3.3Å; Y116-Y156 HydrophobicContact CD2-CD2 4.15Å; Y116-Y156 HydrophobicContact CD2-CE2 4.22Å; Y116-Y156 AromaticContact CE2-CD2 3.85Å; Y116-Y156 HydrophobicContact CE2-CD2 3.85Å; Y116-Y156 AromaticContact CE2-CE2 3.77Å; Y116-Y156 HydrophobicContact CE2-CE2 3.77Å; Y116-E161 PolarHBondContact OH-OE2 2.97Å; Y116-K164 HydrophobicContact CD1-CB 4.2Å; Y116-K164 HydrophobicContact CE1-CB 3.62Å; Y116-K164 HydrophobicContact CE1-CD 4.42Å; Y116-K164 HydrophobicContact CE2-CD 4.28Å; Y116-K164 VanDerWaalsContact OH-CD 3.3Å; Y116-K164 WeakPolarHBondContact OH-CD 3.41Å; Y116-E165 HydrophobicContact CE1-CG 4.28Å; Y116-E165 VanDerWaalsContact CE1-OE1 3.3Å; Y116-E165 WeakPolarHBondContact CE1-OE1 3.41Å; Y116-L168 HydrophobicContact CD1-CD1 4.36Å; Y116-L168 HydrophobicContact CD2-CD1 3.69Å; Y116-L168 HydrophobicContact CE2-CD1 4.13Å; Y116-L168 HydrophobicContact CG-CB 4.09Å; Y116-L168 HydrophobicContact CG-CD1 3.81Å; Y116-P169 WeakPolarHBondContact O-CA 3.46Å
117	G	96.7	Very high	97.9	Very high	70 Å²	70	28.3 Å²	28.3	72%	0.722	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.2	12.3	-177.5	0	0	0	0	0	115.2	G115	G115-G117 PolarHBondContact O-N 2.99Å; G115-G117 VanDerWaalsContact O-N 3.07Å
118	C	98.3	Very high	98	Very high	18 Å²	18	27 Å²	27	12%	0.122	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	154.6	175.6	-60.6	0	0	0	0	111.7	G110 I113 G115 Y116 G120 M152	G110-C118 WeakPolarHBondContact O-CB 3.12Å; I113-C118 HydrophobicContact CB-CB 3.77Å; I113-C118 HydrophobicContact CG2-CB 3.9Å; I113-C118 WeakPolarHBondContact O-CB 3.48Å; G115-C118 WeakPolarHBondContact O-CB 3.48Å; G115-C118 PolarHBondContact O-N 3.05Å; Y116-C118 VanDerWaalsContact C-N 3.32Å; Y116-C118 PolarHBondContact O-N 3.3Å; C118-G120 PolarHBondContact O-N 2.9Å; C118-M152 VanDerWaalsContact SG-CE 3.57Å
119	A	96.5	Very high	98.1	Very high	66 Å²	66	26.8 Å²	26.8	55%	0.545	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	-28.6	-174.1	0	0	0	0	0	114.7	T121	A119-T121 VanDerWaalsContact C-N 3.32Å; A119-T121 PolarHBondContact O-N 3.02Å
120	G	97.2	Very high	98.1	Very high	28 Å²	28	26.7 Å²	26.7	29%	0.289	18%	0.179	S	C	.	.			trans	65.1	30.2	-178.9	0	0	0	0	0	114.9	P111 I113 C118	P111-G120 CarbonylContact O-C 3.58Å; P111-G120 WeakPolarHBondContact O-CA 3.48Å; P111-G120 PolarHBondContact O-N 3.36Å; I113-G120 WeakPolarHBondContact O-CA 3.32Å; I113-G120 PolarHBondContact O-N 3.47Å; I113-G120 VanDerWaalsContact O-N 3.07Å; C118-G120 PolarHBondContact O-N 2.9Å
121	T	96.9	Very high	98.1	Very high	32 Å²	32	27.6 Å²	27.6	20%	0.196	18%	0.182	C	C	.	.			trans	-81.5	174.4	-176.9	-170.8	0	0	0	0	113.5	I70 P111 A119 A125	I70-T121 HydrophobicContact CD1-CG2 4.44Å; I70-T121 WeakPolarHBondContact CD1-OG1 3.43Å; P111-T121 HydrophobicContact CB-CG2 3.66Å; P111-T121 VanDerWaalsContact O-CG2 3.29Å; P111-T121 WeakPolarHBondContact O-CG2 3.33Å; P111-T121 PolarHBondContact O-N 3.47Å; A119-T121 VanDerWaalsContact C-N 3.32Å; A119-T121 PolarHBondContact O-N 3.02Å; T121-A125 HydrophobicContact CG2-CB 3.79Å; T121-A125 WeakPolarHBondContact OG1-CB 3.46Å
122	S	98	Very high	98.2	Very high	25 Å²	25	27.5 Å²	27.5	18%	0.175	18%	0.181	C	C	.	.			trans	-68.5	159.5	179.4	73.9	0	0	0	0	112.4	E67 V124 A125 Y126	E67-S122 PolarHBondContact OE1-OG 3.1Å; S122-V124 PolarHBondContact O-N 2.96Å; S122-V124 PolarHBondContact OG-N 3.15Å; S122-A125 PolarHBondContact O-N 3.49Å; S122-A125 PolarHBondContact OG-N 3.42Å; S122-Y126 PolarHBondContact O-N 2.9Å; S122-Y126 VanDerWaalsContact O-N 3.14Å
123	Y	98.4	Very high	98.2	Very high	42 Å²	42	26 Å²	26	17%	0.165	17%	0.172	C	C	.	.	H	α-helix	trans	-65.2	-30.1	170.3	-85.9	-93.7	0	0	0	111.7	T112 Y126 G127 N295 Y298 I360 D361	T112-Y123 HydrophobicContact CG2-CD1 4.2Å; T112-Y123 HydrophobicContact CG2-CD2 4.07Å; T112-Y123 HydrophobicContact CG2-CE1 4.24Å; T112-Y123 HydrophobicContact CG2-CE2 4.12Å; T112-Y123 HydrophobicContact CG2-CG 4.12Å; Y123-Y126 HydrophobicContact CD1-CD1 4.27Å; Y123-Y126 PolarHBondContact O-N 3.43Å; Y123-G127 PolarHBondContact O-N 2.82Å; Y123-N295 WeakPolarHBondContact CE1-OD1 3.39Å; Y123-N295 PolarHBondContact OH-OD1 2.9Å; Y123-Y298 AromaticContact CD1-CD1 3.91Å; Y123-Y298 HydrophobicContact CD1-CD1 3.91Å; Y123-Y298 AromaticContact CD1-CE1 3.88Å; Y123-Y298 HydrophobicContact CD1-CE1 3.88Å; Y123-Y298 HydrophobicContact CG-CE1 4.45Å; Y123-Y298 WeakPolarHBondContact O-CE1 3.31Å; Y123-Y298 VanDerWaalsContact O-CZ 3.3Å; Y123-Y298 PolarHBondContact O-OH 3.21Å; Y123-I360 HydrophobicContact CD1-CB 4.44Å; Y123-I360 HydrophobicContact CD1-CD1 4.25Å; Y123-I360 HydrophobicContact CD1-CG2 3.7Å; Y123-I360 HydrophobicContact CD2-CB 4.3Å; Y123-I360 HydrophobicContact CD2-CG2 3.42Å; Y123-I360 VanDerWaalsContact CD2-CG2 3.42Å; Y123-I360 HydrophobicContact CE1-CG2 3.82Å; Y123-I360 HydrophobicContact CE2-CG2 3.55Å; Y123-I360 HydrophobicContact CG-CB 4.09Å; Y123-I360 HydrophobicContact CG-CG2 3.49Å; Y123-I360 VanDerWaalsContact CG-CG2 3.49Å; Y123-D361 WeakPolarHBondContact CD2-OD1 3.26Å; Y123-D361 PolarHBondContact N-OD1 3.41Å; Y123-D361 PolarHBondContact N-OD2 3.38Å
124	V	98.8	Very high	98.3	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-62.3	-44.7	173.8	174.1	0	0	0	0	110.9	L63 E67 S122 Y126 G127 L128 W302 L354 R358	L63-V124 HydrophobicContact CD2-CG1 3.86Å; E67-V124 HydrophobicContact CG-CG1 4.28Å; E67-V124 WeakPolarHBondContact OE1-CB 3.49Å; S122-V124 PolarHBondContact O-N 2.96Å; S122-V124 PolarHBondContact OG-N 3.15Å; V124-Y126 VanDerWaalsContact C-N 3.35Å; V124-Y126 PolarHBondContact O-N 3.05Å; V124-G127 WeakPolarHBondContact O-CA 3.36Å; V124-G127 PolarHBondContact O-N 3.41Å; V124-G127 VanDerWaalsContact O-N 3.1Å; V124-L128 HydrophobicContact CG1-CD1 4.23Å; V124-L128 WeakPolarHBondContact O-CG 3.44Å; V124-L128 PolarHBondContact O-N 2.84Å; V124-W302 HydrophobicContact CG1-CZ2 4.47Å; V124-L354 HydrophobicContact CG1-CD1 3.73Å; V124-L354 HydrophobicContact CG2-CD1 3.97Å; V124-R358 HydrophobicContact CG2-CG 4.32Å
125	A	98.8	Very high	98.3	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-60.3	-42.3	174.3	0	0	0	0	0	112.3	E67 I70 T121 S122 G127 L128 I129	E67-A125 HydrophobicContact CG-CB 4.15Å; I70-A125 HydrophobicContact CD1-CB 4.01Å; I70-A125 HydrophobicContact CG2-CB 4.43Å; T121-A125 HydrophobicContact CG2-CB 3.79Å; T121-A125 WeakPolarHBondContact OG1-CB 3.46Å; S122-A125 PolarHBondContact O-N 3.49Å; S122-A125 PolarHBondContact OG-N 3.42Å; A125-G127 VanDerWaalsContact C-N 3.31Å; A125-G127 PolarHBondContact O-N 2.78Å; A125-L128 PolarHBondContact O-N 3Å; A125-I129 VanDerWaalsContact O-CG1 3.3Å; A125-I129 WeakPolarHBondContact O-CG1 3.38Å; A125-I129 PolarHBondContact O-N 3.44Å
126	Y	98.8	Very high	98.4	Very high	2 Å²	2	17.7 Å²	17.7	1%	0.008	12%	0.122	C	C	.	.	H	α-helix	trans	-57.9	-43.6	172.4	171.4	-140.8	0	0	0	112.2	P111 S122 Y123 V124 L128 I129 A130 M144 S149 Y298	P111-Y126 HydrophobicContact CG-CD2 3.67Å; P111-Y126 HydrophobicContact CG-CG 3.96Å; S122-Y126 PolarHBondContact O-N 2.9Å; S122-Y126 VanDerWaalsContact O-N 3.14Å; Y123-Y126 HydrophobicContact CD1-CD1 4.27Å; Y123-Y126 PolarHBondContact O-N 3.43Å; V124-Y126 VanDerWaalsContact C-N 3.35Å; V124-Y126 PolarHBondContact O-N 3.05Å; Y126-L128 PolarHBondContact O-N 2.78Å; Y126-I129 PolarHBondContact O-N 3.05Å; Y126-A130 PolarHBondContact O-N 3.36Å; Y126-M144 HydrophobicContact CE2-CE 4Å; Y126-S149 PolarHBondContact OH-OG 2.73Å; Y126-Y298 AromaticContact CD1-CD1 3.8Å; Y126-Y298 HydrophobicContact CD1-CD1 3.8Å; Y126-Y298 AromaticContact CD1-CE1 3.88Å; Y126-Y298 HydrophobicContact CD1-CE1 3.88Å; Y126-Y298 AromaticContact CE1-CD1 3.95Å; Y126-Y298 HydrophobicContact CE1-CD1 3.95Å; Y126-Y298 HydrophobicContact CE1-CE1 4.47Å
127	G	98.9	Very high	98.4	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-59.9	-44.6	175.2	0	0	0	0	0	112.7	Y123 V124 A125 A130 R131 W302	Y123-G127 PolarHBondContact O-N 2.82Å; V124-G127 WeakPolarHBondContact O-CA 3.36Å; V124-G127 PolarHBondContact O-N 3.41Å; V124-G127 VanDerWaalsContact O-N 3.1Å; A125-G127 VanDerWaalsContact C-N 3.31Å; A125-G127 PolarHBondContact O-N 2.78Å; G127-A130 PolarHBondContact O-N 2.86Å; G127-R131 WeakPolarHBondContact O-CB 3.11Å; G127-R131 PolarHBondContact O-N 3.22Å; G127-W302 VanDerWaalsContact O-CB 3.27Å; G127-W302 WeakPolarHBondContact O-CB 3.5Å
128	L	98.9	Very high	98.5	Very high	0 Å²	0	12.3 Å²	12.3	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.7	-44.1	176.9	-68.2	169.3	0	0	0	112.1	L63 E67 R71 V124 A125 Y126 A130 R131 E132 W302	L63-L128 HydrophobicContact CD1-CD1 3.9Å; L63-L128 HydrophobicContact CD1-CD2 4.14Å; L63-L128 HydrophobicContact CD2-CD1 4.1Å; E67-L128 HydrophobicContact CB-CD1 3.87Å; R71-L128 HydrophobicContact CB-CB 4.09Å; R71-L128 HydrophobicContact CB-CD1 4.24Å; R71-L128 HydrophobicContact CG-CB 4.29Å; R71-L128 HydrophobicContact CG-CD2 4.42Å; V124-L128 HydrophobicContact CG1-CD1 4.23Å; V124-L128 WeakPolarHBondContact O-CG 3.44Å; V124-L128 PolarHBondContact O-N 2.84Å; A125-L128 PolarHBondContact O-N 3Å; Y126-L128 PolarHBondContact O-N 2.78Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 2.77Å; L128-R131 WeakPolarHBondContact O-CB 3.38Å; L128-R131 PolarHBondContact O-N 3.06Å; L128-E132 WeakPolarHBondContact O-CG 3.24Å; L128-E132 PolarHBondContact O-N 2.88Å; L128-W302 HydrophobicContact CD2-CE3 4.48Å; L128-W302 HydrophobicContact CD2-CH2 4.1Å; L128-W302 HydrophobicContact CD2-CZ3 3.71Å; L128-W302 HydrophobicContact CG-CH2 4.48Å; L128-W302 HydrophobicContact CG-CZ3 4.34Å
129	I	98.9	Very high	98.5	Very high	3 Å²	3	11.5 Å²	11.5	2%	0.015	7%	0.074	C	C	.	.	H	α-helix	trans	-56	-50.8	173.7	-68.1	166.5	0	0	0	109.6	I70 F74 V108 P111 A125 Y126 R131 E132 V133 M144	I70-I129 HydrophobicContact CG2-CD1 3.72Å; I70-I129 HydrophobicContact CG2-CG1 3.69Å; F74-I129 HydrophobicContact CD1-CB 4.12Å; F74-I129 HydrophobicContact CD1-CG1 4.36Å; F74-I129 HydrophobicContact CD1-CG2 3.61Å; F74-I129 HydrophobicContact CE1-CB 4.32Å; F74-I129 HydrophobicContact CE1-CG2 3.38Å; F74-I129 WeakPolarHBondContact CE1-O 3.38Å; F74-I129 HydrophobicContact CG-CG2 4.33Å; F74-I129 HydrophobicContact CZ-CG2 3.99Å; V108-I129 HydrophobicContact CB-CD1 4.19Å; V108-I129 HydrophobicContact CB-CG2 4.06Å; V108-I129 HydrophobicContact CG1-CD1 4.01Å; V108-I129 HydrophobicContact CG1-CG1 4.41Å; V108-I129 HydrophobicContact CG1-CG2 4.35Å; P111-I129 HydrophobicContact CB-CD1 4.12Å; P111-I129 HydrophobicContact CG-CD1 4.49Å; A125-I129 VanDerWaalsContact O-CG1 3.3Å; A125-I129 WeakPolarHBondContact O-CG1 3.38Å; A125-I129 PolarHBondContact O-N 3.44Å; Y126-I129 PolarHBondContact O-N 3.05Å; I129-R131 VanDerWaalsContact C-N 3.33Å; I129-R131 PolarHBondContact O-N 2.79Å; I129-E132 PolarHBondContact O-N 2.81Å; I129-V133 WeakPolarHBondContact O-CG1 3.47Å; I129-V133 PolarHBondContact O-N 3.46Å; I129-V133 VanDerWaalsContact O-N 3.07Å; I129-M144 HydrophobicContact CG2-CE 3.94Å; I129-M144 HydrophobicContact CG2-SD 3.42Å; I129-M144 WeakPolarHBondContact CG2-SD 3.49Å
130	A	98.9	Very high	98.7	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-59.3	-41.5	179.3	0	0	0	0	0	112.7	Y126 G127 L128 V133 E134 R141 M144 G299 G303	Y126-A130 PolarHBondContact O-N 3.36Å; G127-A130 PolarHBondContact O-N 2.86Å; L128-A130 VanDerWaalsContact C-N 3.34Å; L128-A130 PolarHBondContact O-N 2.77Å; A130-V133 WeakPolarHBondContact O-CG1 3.35Å; A130-E134 WeakPolarHBondContact O-CB 3.37Å; A130-E134 PolarHBondContact O-N 2.91Å; A130-R141 HydrophobicContact CB-CG 4.27Å; A130-M144 HydrophobicContact CB-CE 4.02Å; A130-G299 WeakPolarHBondContact CB-O 3.39Å; A130-G303 WeakPolarHBondContact O-CA 3.36Å
131	R	98.9	Very high	98.7	Very high	20 Å²	20	7 Å²	7	8%	0.075	4%	0.035	C	C	.	.	H	α-helix	trans	-59.3	-45.8	174.6	176	179.4	169.9	-118.1	18.1	111.9	G127 L128 I129 R135 W302 G306 E309	G127-R131 WeakPolarHBondContact O-CB 3.11Å; G127-R131 PolarHBondContact O-N 3.22Å; L128-R131 WeakPolarHBondContact O-CB 3.38Å; L128-R131 PolarHBondContact O-N 3.06Å; I129-R131 VanDerWaalsContact C-N 3.33Å; I129-R131 PolarHBondContact O-N 2.79Å; R131-R135 WeakPolarHBondContact O-CB 3.49Å; R131-R135 PolarHBondContact O-N 2.73Å; R131-W302 HydrophobicContact CB-CE3 4.3Å; R131-G306 WeakPolarHBondContact O-CA 3.4Å; R131-E309 IonicContact CZ-OE1 3.42Å; R131-E309 IonicContact CZ-OE2 2.64Å; R131-E309 VanDerWaalsContact CZ-OE2 3.24Å; R131-E309 IonicContact NE-OE1 2.7Å; R131-E309 PolarHBondContact NE-OE1 3Å; R131-E309 IonicContact NE-OE2 3.39Å; R131-E309 PolarHBondContact NE-OE2 3.35Å; R131-E309 VanDerWaalsContact NH2-CD 3.28Å; R131-E309 IonicContact NH2-OE1 2.68Å; R131-E309 PolarHBondContact NH2-OE1 3.23Å; R131-E309 IonicContact NH2-OE2 2.71Å; R131-E309 PolarHBondContact NH2-OE2 3.05Å; R131-E309 VanDerWaalsContact NH2-OE2 3.1Å
132	E	98.9	Very high	98.8	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.026	C	C	.	.	H	α-helix	trans	-73	-36.3	-176.8	-61.5	-52.7	146.3	0	0	113	R71 F74 R75 L128 I129 R135	R71-E132 HydrophobicContact CG-CG 3.81Å; F74-E132 HydrophobicContact CD1-CB 4.26Å; R75-E132 HydrophobicContact CB-CB 4.42Å; R75-E132 HydrophobicContact CB-CG 4.1Å; R75-E132 IonicContact CZ-OE1 2.7Å; R75-E132 IonicContact CZ-OE2 3.6Å; R75-E132 VanDerWaalsContact NE-CD 3.34Å; R75-E132 IonicContact NE-OE1 3.24Å; R75-E132 IonicContact NE-OE2 3.57Å; R75-E132 PolarHBondContact NE-OE2 2.82Å; R75-E132 IonicContact NH2-OE1 2.79Å; R75-E132 PolarHBondContact NH2-OE1 2.72Å; R75-E132 IonicContact NH2-OE2 2.79Å; L128-E132 WeakPolarHBondContact O-CG 3.24Å; L128-E132 PolarHBondContact O-N 2.88Å; I129-E132 PolarHBondContact O-N 2.81Å; E132-R135 WeakPolarHBondContact O-CB 3.32Å; E132-R135 IonicContact OE1-NH2 3.1Å; E132-R135 PolarHBondContact OE1-NH2 3.35Å; E132-R135 IonicContact OE2-CZ 3.26Å; E132-R135 IonicContact OE2-NE 3.17Å; E132-R135 PolarHBondContact OE2-NE 2.82Å; E132-R135 IonicContact OE2-NH2 2.78Å
133	V	98.9	Very high	98.8	Very high	0 Å²	0	4.7 Å²	4.7	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-71.8	-38.9	175.1	59.1	0	0	0	0	112.5	F74 L82 M103 I129 A130 R135 V136 D137 R141 M144	F74-V133 HydrophobicContact CE1-CB 3.76Å; F74-V133 HydrophobicContact CE1-CG1 4.18Å; F74-V133 HydrophobicContact CZ-CB 4.15Å; L82-V133 HydrophobicContact CD1-CG2 3.95Å; M103-V133 HydrophobicContact CE-CG2 3.93Å; I129-V133 WeakPolarHBondContact O-CG1 3.47Å; I129-V133 PolarHBondContact O-N 3.46Å; I129-V133 VanDerWaalsContact O-N 3.07Å; A130-V133 WeakPolarHBondContact O-CG1 3.35Å; V133-R135 VanDerWaalsContact C-N 3.32Å; V133-R135 PolarHBondContact O-N 3.47Å; V133-V136 WeakPolarHBondContact O-CA 3.23Å; V133-V136 WeakPolarHBondContact O-CB 3.46Å; V133-V136 PolarHBondContact O-N 2.81Å; V133-D137 PolarHBondContact O-N 3.04Å; V133-R141 HydrophobicContact CG1-CB 3.67Å; V133-R141 HydrophobicContact CG1-CG 3.71Å; V133-R141 HydrophobicContact CG2-CB 4.4Å; V133-M144 HydrophobicContact CG1-CE 3.99Å; V133-M144 HydrophobicContact CG1-SD 4.19Å
134	E	98.9	Very high	98.8	Very high	0 Å²	0	2.7 Å²	2.7	0%	0	1%	0.011	C	C	.	.	H	α-helix	trans	-76.8	-20.6	179.5	-174.1	153.4	-153.4	0	0	113.1	A130 V136 D137 S138 R141 G303 S304 A307 H406	A130-E134 WeakPolarHBondContact O-CB 3.37Å; A130-E134 PolarHBondContact O-N 2.91Å; E134-V136 PolarHBondContact O-N 2.82Å; E134-D137 PolarHBondContact O-N 2.79Å; E134-S138 WeakPolarHBondContact OE1-CB 3.49Å; E134-S138 PolarHBondContact OE1-OG 2.82Å; E134-R141 HydrophobicContact CB-CB 3.78Å; E134-R141 HydrophobicContact CB-CG 3.96Å; E134-R141 HydrophobicContact CG-CB 4.45Å; E134-R141 IonicContact OE1-CZ 3.93Å; E134-R141 IonicContact OE1-NE 3.59Å; E134-R141 IonicContact OE1-NH2 3.24Å; E134-R141 PolarHBondContact OE1-NH2 3.05Å; E134-R141 IonicContact OE2-CZ 2.67Å; E134-R141 IonicContact OE2-NE 2.98Å; E134-R141 PolarHBondContact OE2-NE 3.4Å; E134-R141 IonicContact OE2-NH2 2.98Å; E134-R141 PolarHBondContact OE2-NH2 2.83Å; E134-G303 VanDerWaalsContact CB-O 3.23Å; E134-G303 WeakPolarHBondContact CB-O 3.38Å; E134-G303 WeakPolarHBondContact CG-O 3.33Å; E134-G303 WeakPolarHBondContact OE2-CA 3.46Å; E134-S304 PolarHBondContact OE2-N 3.12Å; E134-S304 VanDerWaalsContact OE2-N 3.09Å; E134-A307 HydrophobicContact CG-CB 3.99Å; E134-H406 PolarHBondContact O-CE1 2.96Å
135	R	98.9	Very high	98.8	Very high	23 Å²	23	2.7 Å²	2.7	9%	0.087	1%	0.011	C	C	.	.	H	α-helix	trans	-54.9	-32	163.2	-173.1	-171.3	-53.7	-63.7	0.9	111.6	R131 E132 V133 G306 E309 F310	R131-R135 WeakPolarHBondContact O-CB 3.49Å; R131-R135 PolarHBondContact O-N 2.73Å; E132-R135 WeakPolarHBondContact O-CB 3.32Å; E132-R135 IonicContact OE1-NH2 3.1Å; E132-R135 PolarHBondContact OE1-NH2 3.35Å; E132-R135 IonicContact OE2-CZ 3.26Å; E132-R135 IonicContact OE2-NE 3.17Å; E132-R135 PolarHBondContact OE2-NE 2.82Å; E132-R135 IonicContact OE2-NH2 2.78Å; V133-R135 VanDerWaalsContact C-N 3.32Å; V133-R135 PolarHBondContact O-N 3.47Å; R135-G306 WeakPolarHBondContact CA-O 3.33Å; R135-E309 IonicContact CZ-OE2 3.34Å; R135-E309 IonicContact NH1-OE2 3.79Å; R135-E309 PolarHBondContact NH1-OE2 3.02Å; R135-E309 IonicContact NH2-OE2 3.31Å; R135-E309 PolarHBondContact NH2-OE2 3.37Å; R135-F310 HydrophobicContact CG-CB 4.07Å; R135-F310 HydrophobicContact CG-CD2 4.46Å; R135-F310 WeakPolarHBondContact O-CD2 3.43Å
136	V	98.9	Very high	98.8	Very high	0 Å²	0	3 Å²	3	0%	0	1%	0.013	C	C	.	.	H	α-helix	trans	-82.5	-60.9	170.4	179.9	0	0	0	0	110.4	C78 L82 M83 I86 V133 E134 Y140 R405 H406	C78-V136 HydrophobicContact CB-CG2 3.82Å; L82-V136 HydrophobicContact CB-CB 4.46Å; L82-V136 HydrophobicContact CB-CG1 3.87Å; L82-V136 HydrophobicContact CB-CG2 4.42Å; M83-V136 HydrophobicContact CB-CG1 4.39Å; M83-V136 HydrophobicContact CB-CG2 4.48Å; M83-V136 HydrophobicContact SD-CG1 4Å; I86-V136 HydrophobicContact CB-CG1 4.3Å; I86-V136 HydrophobicContact CG2-CG1 4.36Å; V133-V136 WeakPolarHBondContact O-CA 3.23Å; V133-V136 WeakPolarHBondContact O-CB 3.46Å; V133-V136 PolarHBondContact O-N 2.81Å; E134-V136 PolarHBondContact O-N 2.82Å; V136-Y140 HydrophobicContact CG1-CD2 4.15Å; V136-Y140 HydrophobicContact CG1-CE2 4.19Å; V136-R405 PolarHBondContact O-NH1 2.79Å; V136-H406 PolarHBondContact O-CE1 3.04Å; V136-H406 VanDerWaalsContact O-CE1 3.28Å; V136-H406 PolarHBondContact O-NE2 3.16Å
137	D	98.9	Very high	98.8	Very high	0 Å²	0	3 Å²	3	0%	0	1%	0.013	C	C	.	.			trans	-161.5	136.9	-179.7	-161.7	-98.9	0	0	0	114	I86 V133 E134 G139 Y140 R141 R405 N409	I86-D137 HydrophobicContact CD1-CB 3.45Å; I86-D137 VanDerWaalsContact CD1-CB 3.45Å; I86-D137 WeakPolarHBondContact CD1-OD2 3.21Å; I86-D137 HydrophobicContact CG1-CB 3.8Å; V133-D137 PolarHBondContact O-N 3.04Å; E134-D137 PolarHBondContact O-N 2.79Å; D137-G139 VanDerWaalsContact C-N 3.26Å; D137-G139 PolarHBondContact O-N 3.31Å; D137-G139 VanDerWaalsContact OD1-CA 3.27Å; D137-G139 WeakPolarHBondContact OD1-CA 3.49Å; D137-G139 PolarHBondContact OD1-N 3.33Å; D137-Y140 HydrophobicContact CB-CD2 3.92Å; D137-Y140 HydrophobicContact CB-CE2 4.36Å; D137-Y140 HydrophobicContact CB-CG 4.3Å; D137-Y140 PolarHBondContact O-N 3.42Å; D137-R141 PolarHBondContact O-N 2.98Å; D137-R405 WeakPolarHBondContact OD2-CD 3.36Å; D137-R405 IonicContact OD2-CZ 3.31Å; D137-R405 IonicContact OD2-NE 3.18Å; D137-R405 IonicContact OD2-NH1 2.67Å; D137-R405 PolarHBondContact OD2-NH1 3.31Å; D137-N409 PolarHBondContact OD1-ND2 3.01Å; D137-N409 PolarHBondContact OD2-ND2 2.77Å
138	S	98.9	Very high	98.8	Very high	0 Å²	0	3.2 Å²	3.2	0%	0	2%	0.015	C	C	.	.	H	α-helix	trans	-62.9	-28.6	175.6	-55.2	0	0	0	0	113.7	E134 S142 L259	E134-S138 WeakPolarHBondContact OE1-CB 3.49Å; E134-S138 PolarHBondContact OE1-OG 2.82Å; S138-S142 VanDerWaalsContact O-CB 3.31Å; S138-S142 WeakPolarHBondContact O-CB 3.37Å; S138-S142 PolarHBondContact O-N 3.41Å; S138-L259 VanDerWaalsContact CB-CD2 3.47Å
139	G	98.8	Very high	98.8	Very high	0 Å²	0	3.6 Å²	3.6	0%	0	2%	0.017	C	C	.	.	H	α-helix	trans	-64.3	-44.7	175.8	0	0	0	0	0	111.9	D137 S142 V143	D137-G139 VanDerWaalsContact C-N 3.26Å; D137-G139 PolarHBondContact O-N 3.31Å; D137-G139 VanDerWaalsContact OD1-CA 3.27Å; D137-G139 WeakPolarHBondContact OD1-CA 3.49Å; D137-G139 PolarHBondContact OD1-N 3.33Å; G139-S142 WeakPolarHBondContact O-CB 3.26Å; G139-S142 PolarHBondContact O-N 3.2Å; G139-V143 WeakPolarHBondContact O-CG2 3.44Å; G139-V143 PolarHBondContact O-N 2.9Å; G139-V143 VanDerWaalsContact O-N 3.16Å
140	Y	98.9	Very high	98.8	Very high	1 Å²	1	3.8 Å²	3.8	0%	0.004	2%	0.019	C	C	.	.	H	α-helix	trans	-65.5	-43.2	175.4	-62.5	-25.3	0	0	0	111.9	L82 I86 I99 V136 D137 S142 V143 M144 A261	L82-Y140 HydrophobicContact CB-CD2 4.02Å; L82-Y140 HydrophobicContact CB-CE2 3.95Å; L82-Y140 HydrophobicContact CD1-CD2 4.06Å; L82-Y140 HydrophobicContact CD2-CD2 4.41Å; L82-Y140 HydrophobicContact CD2-CE2 4.45Å; L82-Y140 HydrophobicContact CG-CD2 4.41Å; I86-Y140 HydrophobicContact CB-CE2 4.15Å; I86-Y140 HydrophobicContact CD1-CD2 4.4Å; I86-Y140 HydrophobicContact CD1-CE1 4.33Å; I86-Y140 HydrophobicContact CD1-CE2 3.7Å; I86-Y140 HydrophobicContact CG1-CE2 4.32Å; I99-Y140 HydrophobicContact CD1-CD1 4.03Å; I99-Y140 HydrophobicContact CD1-CE1 3.57Å; I99-Y140 HydrophobicContact CD1-CE2 4.45Å; V136-Y140 HydrophobicContact CG1-CD2 4.15Å; V136-Y140 HydrophobicContact CG1-CE2 4.19Å; D137-Y140 HydrophobicContact CB-CD2 3.92Å; D137-Y140 HydrophobicContact CB-CE2 4.36Å; D137-Y140 HydrophobicContact CB-CG 4.3Å; D137-Y140 PolarHBondContact O-N 3.42Å; Y140-S142 VanDerWaalsContact C-N 3.27Å; Y140-S142 PolarHBondContact O-N 3.11Å; Y140-V143 PolarHBondContact O-N 2.82Å; Y140-M144 PolarHBondContact O-N 2.71Å; Y140-A261 HydrophobicContact CE1-CB 3.97Å
141	R	98.8	Very high	98.8	Very high	0 Å²	0	3.8 Å²	3.8	0%	0	2%	0.019	C	C	.	.	H	α-helix	trans	-60.6	-38.8	173.5	-169.4	-86.7	-54.8	118.8	13.7	111.6	A130 V133 E134 D137 V143 M144 S145 Y416	A130-R141 HydrophobicContact CB-CG 4.27Å; V133-R141 HydrophobicContact CG1-CB 3.67Å; V133-R141 HydrophobicContact CG1-CG 3.71Å; V133-R141 HydrophobicContact CG2-CB 4.4Å; E134-R141 HydrophobicContact CB-CB 3.78Å; E134-R141 HydrophobicContact CB-CG 3.96Å; E134-R141 HydrophobicContact CG-CB 4.45Å; E134-R141 IonicContact OE1-CZ 3.93Å; E134-R141 IonicContact OE1-NE 3.59Å; E134-R141 IonicContact OE1-NH2 3.24Å; E134-R141 PolarHBondContact OE1-NH2 3.05Å; E134-R141 IonicContact OE2-CZ 2.67Å; E134-R141 IonicContact OE2-NE 2.98Å; E134-R141 PolarHBondContact OE2-NE 3.4Å; E134-R141 IonicContact OE2-NH2 2.98Å; E134-R141 PolarHBondContact OE2-NH2 2.83Å; D137-R141 PolarHBondContact O-N 2.98Å; R141-V143 VanDerWaalsContact C-N 3.35Å; R141-V143 PolarHBondContact O-N 3.02Å; R141-M144 HydrophobicContact CG-CE 4.46Å; R141-M144 PolarHBondContact O-N 3.01Å; R141-S145 VanDerWaalsContact CD-OG 3.28Å; R141-S145 WeakPolarHBondContact CD-OG 3.49Å; R141-S145 PolarHBondContact O-N 2.94Å; R141-S145 PolarHBondContact O-OG 3.46Å; R141-Y416 PolarHBondContact NH1-OH 3.26Å; R141-Y416 PolarHBondContact NH2-OH 3.17Å
142	S	98.6	Very high	98.8	Very high	3 Å²	3	2.9 Å²	2.9	2%	0.021	2%	0.015	C	C	.	.	H	α-helix	trans	-61.2	-41	177.9	-174.2	0	0	0	0	112.5	S138 G139 Y140 M144 S145 V146	S138-S142 VanDerWaalsContact O-CB 3.31Å; S138-S142 WeakPolarHBondContact O-CB 3.37Å; S138-S142 PolarHBondContact O-N 3.41Å; G139-S142 WeakPolarHBondContact O-CB 3.26Å; G139-S142 PolarHBondContact O-N 3.2Å; Y140-S142 VanDerWaalsContact C-N 3.27Å; Y140-S142 PolarHBondContact O-N 3.11Å; S142-M144 PolarHBondContact O-N 2.98Å; S142-S145 PolarHBondContact O-N 3.45Å; S142-V146 WeakPolarHBondContact O-CB 3.29Å; S142-V146 VanDerWaalsContact O-CG2 3.22Å; S142-V146 WeakPolarHBondContact O-CG2 3.22Å; S142-V146 PolarHBondContact O-N 3.49Å
143	V	98.5	Very high	98.8	Very high	4 Å²	4	4.2 Å²	4.2	2%	0.024	2%	0.021	C	C	.	.	H	α-helix	trans	-59.5	-48	174.3	175.8	0	0	0	0	110.6	F95 V100 G139 Y140 R141 V146 Q147 L177	F95-V143 HydrophobicContact CD2-CG2 4.18Å; F95-V143 HydrophobicContact CE2-CB 4.42Å; F95-V143 HydrophobicContact CE2-CG1 4.04Å; F95-V143 HydrophobicContact CE2-CG2 3.63Å; F95-V143 HydrophobicContact CZ-CG1 4.07Å; F95-V143 HydrophobicContact CZ-CG2 4.27Å; V100-V143 HydrophobicContact CG2-CG1 3.92Å; G139-V143 WeakPolarHBondContact O-CG2 3.44Å; G139-V143 PolarHBondContact O-N 2.9Å; G139-V143 VanDerWaalsContact O-N 3.16Å; Y140-V143 PolarHBondContact O-N 2.82Å; R141-V143 VanDerWaalsContact C-N 3.35Å; R141-V143 PolarHBondContact O-N 3.02Å; V143-V146 PolarHBondContact O-N 3.36Å; V143-Q147 WeakPolarHBondContact O-CB 3.08Å; V143-Q147 PolarHBondContact O-N 3.03Å; V143-L177 HydrophobicContact CG1-CD1 4.33Å
144	M	98.4	Very high	98.8	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-64.1	-43	179.1	-172.8	-166.8	73.3	0	0	112.8	M103 L109 Y126 I129 A130 V133 Y140 R141 S142 Q147 S148	M103-M144 HydrophobicContact SD-CB 4.22Å; M103-M144 HydrophobicContact SD-CG 4.45Å; L109-M144 HydrophobicContact CD2-CG 4.13Å; Y126-M144 HydrophobicContact CE2-CE 4Å; I129-M144 HydrophobicContact CG2-CE 3.94Å; I129-M144 HydrophobicContact CG2-SD 3.42Å; I129-M144 WeakPolarHBondContact CG2-SD 3.49Å; A130-M144 HydrophobicContact CB-CE 4.02Å; V133-M144 HydrophobicContact CG1-CE 3.99Å; V133-M144 HydrophobicContact CG1-SD 4.19Å; Y140-M144 PolarHBondContact O-N 2.71Å; R141-M144 HydrophobicContact CG-CE 4.46Å; R141-M144 PolarHBondContact O-N 3.01Å; S142-M144 PolarHBondContact O-N 2.98Å; M144-Q147 PolarHBondContact O-N 3.3Å; M144-S148 VanDerWaalsContact O-CB 3.28Å; M144-S148 WeakPolarHBondContact O-CB 3.18Å; M144-S148 PolarHBondContact O-N 2.84Å; M144-S148 PolarHBondContact O-OG 3.17Å
145	S	98.4	Very high	98.8	Very high	0 Å²	0	4.2 Å²	4.2	0%	0	2%	0.021	C	C	.	.	H	α-helix	trans	-62.5	-43.3	176.8	-68.3	0	0	0	0	111.8	R141 S142 S149 L150	R141-S145 VanDerWaalsContact CD-OG 3.28Å; R141-S145 WeakPolarHBondContact CD-OG 3.49Å; R141-S145 PolarHBondContact O-N 2.94Å; R141-S145 PolarHBondContact O-OG 3.46Å; S142-S145 PolarHBondContact O-N 3.45Å; S145-S149 WeakPolarHBondContact O-CA 3.43Å; S145-S149 WeakPolarHBondContact O-CB 3.18Å; S145-S149 PolarHBondContact O-N 2.73Å; S145-L150 PolarHBondContact O-N 3.29Å
146	V	98.8	Very high	98.8	Very high	7 Å²	7	6.7 Å²	6.7	4%	0.042	3%	0.031	C	C	.	.	I	π-helix	trans	-62.5	-51.3	177	171.2	0	0	0	0	110.2	S142 V143 S148 L150 V151 T217 N218	S142-V146 WeakPolarHBondContact O-CB 3.29Å; S142-V146 VanDerWaalsContact O-CG2 3.22Å; S142-V146 WeakPolarHBondContact O-CG2 3.22Å; S142-V146 PolarHBondContact O-N 3.49Å; V143-V146 PolarHBondContact O-N 3.36Å; V146-S148 PolarHBondContact O-N 2.69Å; V146-L150 HydrophobicContact CG2-CD1 4.06Å; V146-L150 CarbonylContact O-C 3.12Å; V146-L150 WeakPolarHBondContact O-CA 3.44Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 PolarHBondContact O-N 2.87Å; V146-L150 VanDerWaalsContact O-N 3.11Å; V146-V151 HydrophobicContact CG1-CG2 4.24Å; V146-V151 WeakPolarHBondContact O-CG2 3.48Å; V146-V151 PolarHBondContact O-N 3.37Å; V146-T217 HydrophobicContact CG2-CG2 3.83Å; V146-N218 WeakPolarHBondContact CG1-ND2 3.4Å
147	Q	98.9	Very high	98.7	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	5%	0.045	C	C	.	.	I	π-helix	trans	-57.5	-50.4	179.6	-173.4	76.2	-11.6	0	0	111.3	L109 V143 M144 M152 L171 I176	L109-Q147 HydrophobicContact CB-CG 4.48Å; L109-Q147 HydrophobicContact CD1-CG 4.15Å; L109-Q147 HydrophobicContact CD2-CB 4.39Å; L109-Q147 HydrophobicContact CD2-CG 4.1Å; L109-Q147 HydrophobicContact CG-CG 4.47Å; V143-Q147 WeakPolarHBondContact O-CB 3.08Å; V143-Q147 PolarHBondContact O-N 3.03Å; M144-Q147 PolarHBondContact O-N 3.3Å; Q147-M152 HydrophobicContact CG-SD 4.08Å; Q147-M152 WeakPolarHBondContact O-CB 3.43Å; Q147-M152 WeakPolarHBondContact O-CG 3.33Å; Q147-M152 PolarHBondContact O-N 3.23Å; Q147-L171 VanDerWaalsContact NE2-CD2 3.32Å; Q147-L171 PolarHBondContact NE2-O 3.45Å; Q147-I176 PolarHBondContact NE2-O 3.32Å
148	S	98.8	Very high	98.7	Very high	6 Å²	6	10 Å²	10	4%	0.042	5%	0.052	C	C	.	.	I	π-helix	trans	-78.8	-56.2	-172.1	-55	0	0	0	0	112.9	G110 M144 V146 H153	G110-S148 PolarHBondContact N-OG 3.2Å; M144-S148 VanDerWaalsContact O-CB 3.28Å; M144-S148 WeakPolarHBondContact O-CB 3.18Å; M144-S148 PolarHBondContact O-N 2.84Å; M144-S148 PolarHBondContact O-OG 3.17Å; V146-S148 PolarHBondContact O-N 2.69Å; S148-H153 WeakPolarHBondContact O-CB 3.42Å; S148-H153 PolarHBondContact O-N 3.46Å
149	S	98.6	Very high	98.7	Very high	7 Å²	7	10 Å²	10	5%	0.049	5%	0.052	C	C	.	.	I	π-helix	trans	-92.4	-22.3	-169.3	-59.2	0	0	0	0	113.9	Y126 S145 H153	Y126-S149 PolarHBondContact OH-OG 2.73Å; S145-S149 WeakPolarHBondContact O-CA 3.43Å; S145-S149 WeakPolarHBondContact O-CB 3.18Å; S145-S149 PolarHBondContact O-N 2.73Å; S149-H153 WeakPolarHBondContact O-CB 3.31Å
150	L	98.8	Very high	98.7	Very high	8 Å²	8	11.9 Å²	11.9	4%	0.042	6%	0.063	C	C	.	.	I	π-helix	trans	-110	-14.9	-176.2	-53.4	-178.6	0	0	0	113.3	S145 V146 P154 F180 C292 L293 A296	S145-L150 PolarHBondContact O-N 3.29Å; V146-L150 HydrophobicContact CG2-CD1 4.06Å; V146-L150 CarbonylContact O-C 3.12Å; V146-L150 WeakPolarHBondContact O-CA 3.44Å; V146-L150 WeakPolarHBondContact O-CB 3.39Å; V146-L150 PolarHBondContact O-N 2.87Å; V146-L150 VanDerWaalsContact O-N 3.11Å; L150-P154 WeakPolarHBondContact O-CG 3.32Å; L150-F180 HydrophobicContact CB-CB 3.65Å; L150-F180 HydrophobicContact CB-CD1 4.36Å; L150-F180 HydrophobicContact CB-CD2 3.85Å; L150-F180 HydrophobicContact CB-CE2 4.4Å; L150-F180 HydrophobicContact CB-CG 3.74Å; L150-F180 HydrophobicContact CD1-CB 4.29Å; L150-F180 HydrophobicContact CD1-CD1 4.25Å; L150-F180 HydrophobicContact CD1-CG 4.37Å; L150-F180 HydrophobicContact CG-CG 4.49Å; L150-F180 WeakPolarHBondContact O-CD2 3.11Å; L150-C292 HydrophobicContact CD2-CB 3.87Å; L150-L293 HydrophobicContact CD2-CD2 4.23Å; L150-A296 HydrophobicContact CD1-CB 4.41Å; L150-A296 HydrophobicContact CD2-CB 3.71Å; L150-A296 HydrophobicContact CG-CB 4.03Å
151	V	98.9	Very high	98.7	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.081	C	C	.	.	I	π-helix	trans	-117.3	-61	177	177.2	0	0	0	0	110.9	V146 H153 P154 I155 L171 I224 V226	V146-V151 HydrophobicContact CG1-CG2 4.24Å; V146-V151 WeakPolarHBondContact O-CG2 3.48Å; V146-V151 PolarHBondContact O-N 3.37Å; V151-H153 PolarHBondContact O-N 3.5Å; V151-P154 VanDerWaalsContact O-CD 3.28Å; V151-P154 WeakPolarHBondContact O-CD 3.26Å; V151-P154 WeakPolarHBondContact O-CG 3.16Å; V151-I155 HydrophobicContact CG1-CD1 4.14Å; V151-I155 WeakPolarHBondContact O-CG1 3.38Å; V151-I155 PolarHBondContact O-N 3.27Å; V151-L171 HydrophobicContact CG1-CD1 3.88Å; V151-L171 HydrophobicContact CG1-CD2 3.94Å; V151-I224 HydrophobicContact CG1-CD1 3.95Å; V151-I224 HydrophobicContact CG1-CG1 4.39Å; V151-V226 HydrophobicContact CG1-CG2 4.13Å
152	M	98.9	Very high	98.7	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	11%	0.112	C	C	.	.	I	π-helix	trans	-65	-43.7	-177.6	-66.2	168.6	76	0	0	111.5	L109 I113 C118 Q147 I155 Y156 L168 L171 A172	L109-M152 HydrophobicContact CB-SD 4.2Å; I113-M152 HydrophobicContact CD1-CB 3.6Å; I113-M152 HydrophobicContact CD1-CE 4.29Å; C118-M152 VanDerWaalsContact SG-CE 3.57Å; Q147-M152 HydrophobicContact CG-SD 4.08Å; Q147-M152 WeakPolarHBondContact O-CB 3.43Å; Q147-M152 WeakPolarHBondContact O-CG 3.33Å; Q147-M152 PolarHBondContact O-N 3.23Å; M152-I155 PolarHBondContact O-N 3.23Å; M152-Y156 WeakPolarHBondContact O-CB 3.07Å; M152-Y156 PolarHBondContact O-N 3.01Å; M152-L168 HydrophobicContact CB-CD2 3.92Å; M152-L168 HydrophobicContact CG-CD2 4.29Å; M152-L168 WeakPolarHBondContact O-CD2 3.35Å; M152-L171 HydrophobicContact CE-CB 4.3Å; M152-L171 HydrophobicContact CG-CB 3.59Å; M152-L171 HydrophobicContact CG-CD1 3.83Å; M152-L171 HydrophobicContact CG-CG 4.24Å; M152-L171 HydrophobicContact SD-CB 3.96Å; M152-A172 HydrophobicContact CE-CB 3.71Å
153	H	98.7	Very high	98.7	Very high	28 Å²	28	22.7 Å²	22.7	13%	0.13	11%	0.113	C	C	.	.	H	α-helix	trans	-58.4	-52.3	178.9	179.9	76.5	0	0	0	114.1	S148 S149 V151 I155 Y156 A157 N295	S148-H153 WeakPolarHBondContact O-CB 3.42Å; S148-H153 PolarHBondContact O-N 3.46Å; S149-H153 WeakPolarHBondContact O-CB 3.31Å; V151-H153 PolarHBondContact O-N 3.5Å; H153-I155 VanDerWaalsContact C-N 3.31Å; H153-I155 PolarHBondContact O-N 2.91Å; H153-Y156 PolarHBondContact O-N 2.98Å; H153-A157 VanDerWaalsContact O-CB 3.29Å; H153-A157 WeakPolarHBondContact O-CB 3.49Å; H153-A157 PolarHBondContact O-N 3.35Å; H153-N295 PolarHBondContact CD2-ND2 3.22Å; H153-N295 PolarHBondContact CE1-ND2 3.42Å; H153-N295 PolarHBondContact NE2-ND2 3.43Å
154	P	98.8	Very high	98.7	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.4	-35.4	177.8	14.8	-24.9	0	0	0	113.6	L150 V151 Y158 G159 V226 L280 C292	L150-P154 WeakPolarHBondContact O-CG 3.32Å; V151-P154 VanDerWaalsContact O-CD 3.28Å; V151-P154 WeakPolarHBondContact O-CD 3.26Å; V151-P154 WeakPolarHBondContact O-CG 3.16Å; P154-Y158 HydrophobicContact CB-CD2 3.75Å; P154-Y158 HydrophobicContact CB-CE2 4.07Å; P154-Y158 WeakPolarHBondContact O-CA 3.4Å; P154-Y158 VanDerWaalsContact O-CB 3.25Å; P154-Y158 WeakPolarHBondContact O-CB 3.43Å; P154-Y158 PolarHBondContact O-N 3.34Å; P154-G159 PolarHBondContact O-N 2.9Å; P154-V226 HydrophobicContact CB-CG1 4.43Å; P154-V226 HydrophobicContact CG-CG1 4.21Å; P154-L280 HydrophobicContact CB-CD1 4.14Å; P154-C292 VanDerWaalsContact CB-SG 3.59Å
155	I	98.9	Very high	98.7	Very high	0 Å²	0	29 Å²	29	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.1	-44.5	174.5	-64.9	170.1	0	0	0	110	V151 M152 H153 G159 K164 W167 L168 L171 I224 V226 I240	V151-I155 HydrophobicContact CG1-CD1 4.14Å; V151-I155 WeakPolarHBondContact O-CG1 3.38Å; V151-I155 PolarHBondContact O-N 3.27Å; M152-I155 PolarHBondContact O-N 3.23Å; H153-I155 VanDerWaalsContact C-N 3.31Å; H153-I155 PolarHBondContact O-N 2.91Å; I155-G159 VanDerWaalsContact O-CA 3.24Å; I155-G159 WeakPolarHBondContact O-CA 3.43Å; I155-G159 PolarHBondContact O-N 3.49Å; I155-K164 HydrophobicContact CG2-CG 4.38Å; I155-W167 HydrophobicContact CD1-CB 4Å; I155-W167 HydrophobicContact CD1-CG 4.35Å; I155-W167 HydrophobicContact CG2-CB 4.31Å; I155-L168 HydrophobicContact CB-CD2 4.01Å; I155-L168 HydrophobicContact CG2-CD2 3.91Å; I155-L168 HydrophobicContact CG2-CG 4.01Å; I155-L171 HydrophobicContact CD1-CD1 3.82Å; I155-I224 HydrophobicContact CD1-CD1 4.19Å; I155-V226 HydrophobicContact CD1-CG2 4.44Å; I155-V226 HydrophobicContact CG1-CG2 4.44Å; I155-I240 HydrophobicContact CD1-CD1 4.2Å; I155-I240 HydrophobicContact CG1-CD1 3.94Å
156	Y	98.8	Very high	98.7	Very high	76 Å²	76	33.3 Å²	33.3	30%	0.298	16%	0.161	S	C	.	.	H	α-helix	trans	-65.6	-44.4	177.9	177.5	-102	0	0	0	113.4	I113 Y116 M152 H153 K164 L168	I113-Y156 HydrophobicContact CD1-CG 4.41Å; I113-Y156 HydrophobicContact CG1-CD1 4.34Å; I113-Y156 HydrophobicContact CG1-CG 4.15Å; I113-Y156 HydrophobicContact CG2-CD2 3.6Å; I113-Y156 HydrophobicContact CG2-CE2 3.8Å; I113-Y156 HydrophobicContact CG2-CG 4.07Å; Y116-Y156 HydrophobicContact CD2-CD2 4.15Å; Y116-Y156 HydrophobicContact CD2-CE2 4.22Å; Y116-Y156 AromaticContact CE2-CD2 3.85Å; Y116-Y156 HydrophobicContact CE2-CD2 3.85Å; Y116-Y156 AromaticContact CE2-CE2 3.77Å; Y116-Y156 HydrophobicContact CE2-CE2 3.77Å; M152-Y156 WeakPolarHBondContact O-CB 3.07Å; M152-Y156 PolarHBondContact O-N 3.01Å; H153-Y156 PolarHBondContact O-N 2.98Å; Y156-K164 WeakPolarHBondContact O-CE 3.25Å; Y156-K164 PolarHBondContact O-NZ 2.89Å; Y156-K164 VanDerWaalsContact O-NZ 3.17Å; Y156-L168 HydrophobicContact CD2-CD1 3.92Å; Y156-L168 HydrophobicContact CG-CD1 4.42Å
157	A	98.3	Very high	98.7	Very high	35 Å²	35	33.1 Å²	33.1	29%	0.289	16%	0.159	S	C	.	.	H	α-helix	trans	-80.1	-39	-174.7	0	0	0	0	0	112.1	H153	H153-A157 VanDerWaalsContact O-CB 3.29Å; H153-A157 WeakPolarHBondContact O-CB 3.49Å; H153-A157 PolarHBondContact O-N 3.35Å
158	Y	98.7	Very high	98.7	Very high	35 Å²	35	33.1 Å²	33.1	14%	0.137	16%	0.159	C	C	.	.	H	α-helix	trans	-116.9	-13.6	-166.2	-45	-45.1	0	0	0	114.2	P154 W228 P281 K282 V283	P154-Y158 HydrophobicContact CB-CD2 3.75Å; P154-Y158 HydrophobicContact CB-CE2 4.07Å; P154-Y158 WeakPolarHBondContact O-CA 3.4Å; P154-Y158 VanDerWaalsContact O-CB 3.25Å; P154-Y158 WeakPolarHBondContact O-CB 3.43Å; P154-Y158 PolarHBondContact O-N 3.34Å; Y158-W228 HydrophobicContact CD2-CH2 4.27Å; Y158-W228 HydrophobicContact CE2-CH2 4.44Å; Y158-P281 VanDerWaalsContact O-CD 3.29Å; Y158-P281 WeakPolarHBondContact O-CD 3.47Å; Y158-K282 WeakPolarHBondContact O-CB 3.23Å; Y158-K282 PolarHBondContact O-N 2.82Å; Y158-K282 VanDerWaalsContact O-N 3.1Å; Y158-V283 HydrophobicContact CD1-CB 3.77Å; Y158-V283 HydrophobicContact CD1-CG1 4.32Å; Y158-V283 HydrophobicContact CD1-CG2 4.08Å; Y158-V283 HydrophobicContact CD2-CB 4.21Å; Y158-V283 HydrophobicContact CD2-CG1 3.92Å; Y158-V283 HydrophobicContact CD2-CG2 4.41Å; Y158-V283 HydrophobicContact CE1-CB 4.4Å; Y158-V283 HydrophobicContact CE1-CG2 4.21Å; Y158-V283 HydrophobicContact CG-CB 3.68Å; Y158-V283 HydrophobicContact CG-CG1 3.7Å; Y158-V283 HydrophobicContact CG-CG2 4.21Å
159	G	98.5	Very high	98.7	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.164	C	C	.	.	S	Bend	trans	-80.5	165.4	-178.9	0	0	0	0	0	114.7	P154 I155 K164 K282	P154-G159 PolarHBondContact O-N 2.9Å; I155-G159 VanDerWaalsContact O-CA 3.24Å; I155-G159 WeakPolarHBondContact O-CA 3.43Å; I155-G159 PolarHBondContact O-N 3.49Å; G159-K164 WeakPolarHBondContact O-CE 3.37Å; G159-K282 WeakPolarHBondContact O-CE 3.32Å; G159-K282 PolarHBondContact O-NZ 3.25Å
160	T	98.7	Very high	98.7	Very high	39 Å²	39	37.8 Å²	37.8	24%	0.239	18%	0.178	C	C	.	.			trans	-71.6	167.3	167.4	76.7	0	0	0	0	111	E162 Q163 K164 P281	T160-E162 VanDerWaalsContact C-N 3.29Å; T160-E162 WeakPolarHBondContact CB-OE2 3.23Å; T160-E162 PolarHBondContact O-N 3.38Å; T160-E162 PolarHBondContact OG1-N 2.85Å; T160-E162 PolarHBondContact OG1-OE2 3.46Å; T160-Q163 PolarHBondContact O-N 3.33Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.42Å; T160-Q163 PolarHBondContact OG1-N 3.1Å; T160-K164 VanDerWaalsContact O-CG 3.29Å; T160-K164 WeakPolarHBondContact O-CG 3.18Å; T160-K164 PolarHBondContact O-N 2.74Å; T160-K164 VanDerWaalsContact O-N 3.1Å; T160-P281 HydrophobicContact CG2-CG 3.56Å
161	E	98.5	Very high	98.7	Very high	84 Å²	84	37.4 Å²	37.4	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-65.8	-35.8	176	-66	-51.9	127.1	0	0	111.5	Y116 Q163 K164 E165 K282	Y116-E161 PolarHBondContact OH-OE2 2.97Å; E161-Q163 VanDerWaalsContact C-N 3.33Å; E161-Q163 PolarHBondContact O-N 2.7Å; E161-K164 PolarHBondContact O-N 3.28Å; E161-K164 VanDerWaalsContact O-N 3.15Å; E161-K164 WeakPolarHBondContact OE1-CE 3.42Å; E161-K164 IonicContact OE1-NZ 3.98Å; E161-K164 PolarHBondContact OE1-NZ 3.19Å; E161-K164 IonicContact OE2-NZ 2.74Å; E161-E165 WeakPolarHBondContact O-CG 3.3Å; E161-E165 PolarHBondContact O-N 2.75Å; E161-K282 IonicContact OE1-NZ 2.84Å
162	E	98.5	Very high	98.7	Very high	139 Å²	139	37.6 Å²	37.6	65%	0.65	18%	0.177	S	C	*	.	H	α-helix	trans	-61.5	-41.9	175.9	-57.3	74.6	-162.3	0	0	111.5	T160 K166	T160-E162 VanDerWaalsContact C-N 3.29Å; T160-E162 WeakPolarHBondContact CB-OE2 3.23Å; T160-E162 PolarHBondContact O-N 3.38Å; T160-E162 PolarHBondContact OG1-N 2.85Å; T160-E162 PolarHBondContact OG1-OE2 3.46Å; E162-K166 WeakPolarHBondContact O-CB 3.18Å; E162-K166 PolarHBondContact O-N 3.32Å
163	Q	98.7	Very high	98.7	Very high	8 Å²	8	43 Å²	43	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-42.1	174.8	-70.6	173	-22.8	0	0	111.5	T160 E161 K166 W167 I240 E277 L279	T160-Q163 PolarHBondContact O-N 3.33Å; T160-Q163 WeakPolarHBondContact OG1-CG 3.42Å; T160-Q163 PolarHBondContact OG1-N 3.1Å; E161-Q163 VanDerWaalsContact C-N 3.33Å; E161-Q163 PolarHBondContact O-N 2.7Å; Q163-K166 PolarHBondContact O-N 3.47Å; Q163-W167 WeakPolarHBondContact O-CB 3.37Å; Q163-W167 PolarHBondContact O-N 3.25Å; Q163-I240 HydrophobicContact CG-CD1 4.4Å; Q163-E277 PolarHBondContact NE2-O 3.44Å; Q163-L279 PolarHBondContact NE2-O 2.77Å
164	K	98.8	Very high	98.7	Very high	18 Å²	18	41.7 Å²	41.7	8%	0.078	19%	0.191	C	C	.	.	H	α-helix	trans	-63.7	-49.5	179.2	-68.7	173.8	-162.8	-175.5	0	111.6	Y116 I155 Y156 G159 T160 E161 K166 W167 L168 P169	Y116-K164 HydrophobicContact CD1-CB 4.2Å; Y116-K164 HydrophobicContact CE1-CB 3.62Å; Y116-K164 HydrophobicContact CE1-CD 4.42Å; Y116-K164 HydrophobicContact CE2-CD 4.28Å; Y116-K164 VanDerWaalsContact OH-CD 3.3Å; Y116-K164 WeakPolarHBondContact OH-CD 3.41Å; I155-K164 HydrophobicContact CG2-CG 4.38Å; Y156-K164 WeakPolarHBondContact O-CE 3.25Å; Y156-K164 PolarHBondContact O-NZ 2.89Å; Y156-K164 VanDerWaalsContact O-NZ 3.17Å; G159-K164 WeakPolarHBondContact O-CE 3.37Å; T160-K164 VanDerWaalsContact O-CG 3.29Å; T160-K164 WeakPolarHBondContact O-CG 3.18Å; T160-K164 PolarHBondContact O-N 2.74Å; T160-K164 VanDerWaalsContact O-N 3.1Å; E161-K164 PolarHBondContact O-N 3.28Å; E161-K164 VanDerWaalsContact O-N 3.15Å; E161-K164 WeakPolarHBondContact OE1-CE 3.42Å; E161-K164 IonicContact OE1-NZ 3.98Å; E161-K164 PolarHBondContact OE1-NZ 3.19Å; E161-K164 IonicContact OE2-NZ 2.74Å; K164-K166 VanDerWaalsContact C-N 3.33Å; K164-K166 PolarHBondContact O-N 3.16Å; K164-W167 PolarHBondContact O-N 2.97Å; K164-L168 HydrophobicContact CB-CD1 3.81Å; K164-L168 HydrophobicContact CB-CG 4.35Å; K164-L168 HydrophobicContact CG-CD1 3.9Å; K164-L168 VanDerWaalsContact O-CB 3.31Å; K164-L168 WeakPolarHBondContact O-CB 3.23Å; K164-L168 PolarHBondContact O-N 3.42Å; K164-P169 WeakPolarHBondContact O-CD 3.5Å
165	E	98.6	Very high	98.6	Very high	119 Å²	119	46.3 Å²	46.3	56%	0.556	21%	0.213	S	C	*	.	H	α-helix	trans	-63.5	-38.3	178.5	-68.6	-62.9	165.4	0	0	112	Y116 E161 P169	Y116-E165 HydrophobicContact CE1-CG 4.28Å; Y116-E165 VanDerWaalsContact CE1-OE1 3.3Å; Y116-E165 WeakPolarHBondContact CE1-OE1 3.41Å; E161-E165 WeakPolarHBondContact O-CG 3.3Å; E161-E165 PolarHBondContact O-N 2.75Å; E165-P169 WeakPolarHBondContact O-CD 3.33Å
166	K	98.4	Very high	98.6	Very high	90 Å²	90	46.7 Å²	46.7	39%	0.391	22%	0.215	S	C	.	.	H	α-helix	trans	-65.3	-42.5	176.8	-177.7	178.7	173.8	-170	0	112.4	E162 Q163 K164 R170 E242	E162-K166 WeakPolarHBondContact O-CB 3.18Å; E162-K166 PolarHBondContact O-N 3.32Å; Q163-K166 PolarHBondContact O-N 3.47Å; K164-K166 VanDerWaalsContact C-N 3.33Å; K164-K166 PolarHBondContact O-N 3.16Å; K166-R170 WeakPolarHBondContact O-CD 3.38Å; K166-E242 IonicContact NZ-OE1 2.81Å; K166-E242 PolarHBondContact NZ-OE1 3.45Å
167	W	98.8	Very high	98.6	Very high	3 Å²	3	43 Å²	43	1%	0.011	20%	0.201	C	C	.	.	H	α-helix	trans	-106.9	-46.8	-164.5	-62.8	122.2	0	0	0	114.9	I155 Q163 K164 R170 L171 I176 I224 I240 E242	I155-W167 HydrophobicContact CD1-CB 4Å; I155-W167 HydrophobicContact CD1-CG 4.35Å; I155-W167 HydrophobicContact CG2-CB 4.31Å; Q163-W167 WeakPolarHBondContact O-CB 3.37Å; Q163-W167 PolarHBondContact O-N 3.25Å; K164-W167 PolarHBondContact O-N 2.97Å; W167-R170 PolarHBondContact O-N 2.94Å; W167-L171 HydrophobicContact CB-CD1 4.07Å; W167-L171 WeakPolarHBondContact O-CG 3.31Å; W167-L171 PolarHBondContact O-N 3.4Å; W167-I176 HydrophobicContact CE3-CD1 3.53Å; W167-I176 HydrophobicContact CZ3-CD1 3.85Å; W167-I224 HydrophobicContact CD2-CD1 4.4Å; W167-I224 HydrophobicContact CE3-CD1 4.22Å; W167-I224 HydrophobicContact CE3-CG2 4.08Å; W167-I224 HydrophobicContact CH2-CG2 3.64Å; W167-I224 HydrophobicContact CZ2-CG2 4.34Å; W167-I224 HydrophobicContact CZ3-CG2 3.49Å; W167-I224 VanDerWaalsContact CZ3-CG2 3.49Å; W167-I240 HydrophobicContact CZ2-CG2 4.18Å; W167-E242 HydrophobicContact CH2-CG 3.79Å; W167-E242 WeakPolarHBondContact CH2-OE1 3.28Å; W167-E242 HydrophobicContact CZ2-CG 4.04Å; W167-E242 VanDerWaalsContact CZ2-OE1 3.3Å; W167-E242 WeakPolarHBondContact CZ2-OE1 3.49Å
168	L	98.9	Very high	98.6	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-61.5	-44	-168.8	-64.1	179.3	0	0	0	113.4	I113 Y116 M152 I155 Y156 K164 R170 L171 A172	I113-L168 HydrophobicContact CD1-CD2 4.45Å; Y116-L168 HydrophobicContact CD1-CD1 4.36Å; Y116-L168 HydrophobicContact CD2-CD1 3.69Å; Y116-L168 HydrophobicContact CE2-CD1 4.13Å; Y116-L168 HydrophobicContact CG-CB 4.09Å; Y116-L168 HydrophobicContact CG-CD1 3.81Å; M152-L168 HydrophobicContact CB-CD2 3.92Å; M152-L168 HydrophobicContact CG-CD2 4.29Å; M152-L168 WeakPolarHBondContact O-CD2 3.35Å; I155-L168 HydrophobicContact CB-CD2 4.01Å; I155-L168 HydrophobicContact CG2-CD2 3.91Å; I155-L168 HydrophobicContact CG2-CG 4.01Å; Y156-L168 HydrophobicContact CD2-CD1 3.92Å; Y156-L168 HydrophobicContact CG-CD1 4.42Å; K164-L168 HydrophobicContact CB-CD1 3.81Å; K164-L168 HydrophobicContact CB-CG 4.35Å; K164-L168 HydrophobicContact CG-CD1 3.9Å; K164-L168 VanDerWaalsContact O-CB 3.31Å; K164-L168 WeakPolarHBondContact O-CB 3.23Å; K164-L168 PolarHBondContact O-N 3.42Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.11Å; L168-L171 PolarHBondContact O-N 2.83Å; L168-A172 VanDerWaalsContact O-CB 3.25Å; L168-A172 WeakPolarHBondContact O-CB 3.29Å; L168-A172 PolarHBondContact O-N 3.49Å
169	P	98.8	Very high	98.7	Very high	21 Å²	21	39.8 Å²	39.8	14%	0.136	18%	0.181	C	C	.	.	H	α-helix	trans	-61	-38.4	179.2	-24.5	35	0	0	0	113.3	Y116 K164 E165 R173	Y116-P169 WeakPolarHBondContact O-CA 3.46Å; K164-P169 WeakPolarHBondContact O-CD 3.5Å; E165-P169 WeakPolarHBondContact O-CD 3.33Å; P169-R173 WeakPolarHBondContact O-CG 3.3Å; P169-R173 PolarHBondContact O-N 3.1Å; P169-R173 PolarHBondContact O-NH1 3.45Å
170	R	98.7	Very high	98.7	Very high	91 Å²	91	40.5 Å²	40.5	34%	0.343	18%	0.184	S	C	.	.	H	α-helix	trans	-73.8	-38.3	-179.8	-60.3	171.4	62.8	-160.1	1.3	111.6	K166 W167 L168 G174 E175 I176	K166-R170 WeakPolarHBondContact O-CD 3.38Å; W167-R170 PolarHBondContact O-N 2.94Å; L168-R170 VanDerWaalsContact C-N 3.3Å; L168-R170 PolarHBondContact O-N 3.11Å; R170-G174 PolarHBondContact O-N 2.85Å; R170-E175 HydrophobicContact CB-CB 4.47Å; R170-E175 WeakPolarHBondContact CG-OE2 3.38Å; R170-E175 PolarHBondContact O-N 3.17Å; R170-I176 HydrophobicContact CB-CD1 3.77Å; R170-I176 HydrophobicContact CB-CG1 3.75Å; R170-I176 VanDerWaalsContact NH2-CG2 3.31Å
171	L	98.9	Very high	98.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-66	-40.6	173.8	-71.8	162.7	0	0	0	111.7	L109 Q147 V151 M152 I155 W167 L168 G174 I176 I224	L109-L171 WeakPolarHBondContact CD1-O 3.11Å; Q147-L171 VanDerWaalsContact NE2-CD2 3.32Å; Q147-L171 PolarHBondContact NE2-O 3.45Å; V151-L171 HydrophobicContact CG1-CD1 3.88Å; V151-L171 HydrophobicContact CG1-CD2 3.94Å; M152-L171 HydrophobicContact CE-CB 4.3Å; M152-L171 HydrophobicContact CG-CB 3.59Å; M152-L171 HydrophobicContact CG-CD1 3.83Å; M152-L171 HydrophobicContact CG-CG 4.24Å; M152-L171 HydrophobicContact SD-CB 3.96Å; I155-L171 HydrophobicContact CD1-CD1 3.82Å; W167-L171 HydrophobicContact CB-CD1 4.07Å; W167-L171 WeakPolarHBondContact O-CG 3.31Å; W167-L171 PolarHBondContact O-N 3.4Å; L168-L171 PolarHBondContact O-N 2.83Å; L171-G174 PolarHBondContact O-N 3.24Å; L171-G174 VanDerWaalsContact O-N 3.12Å; L171-I176 HydrophobicContact CD2-CD1 4.1Å; L171-I176 HydrophobicContact CD2-CG1 3.83Å; L171-I176 HydrophobicContact CG-CD1 3.94Å; L171-I176 HydrophobicContact CG-CG1 3.93Å; L171-I224 HydrophobicContact CD1-CD1 4.12Å; L171-I224 HydrophobicContact CD2-CD1 4.07Å; L171-I224 HydrophobicContact CD2-CG1 4.49Å; L171-I224 HydrophobicContact CG-CD1 4.49Å
172	A	98.8	Very high	98.7	Very high	4 Å²	4	35.1 Å²	35.1	3%	0.033	16%	0.157	C	C	.	.	H	α-helix	trans	-64.2	-39.5	179.2	0	0	0	0	0	112	G104 M152 L168 G174	G104-A172 WeakPolarHBondContact CA-O 3.22Å; M152-A172 HydrophobicContact CE-CB 3.71Å; L168-A172 VanDerWaalsContact O-CB 3.25Å; L168-A172 WeakPolarHBondContact O-CB 3.29Å; L168-A172 PolarHBondContact O-N 3.49Å; A172-G174 PolarHBondContact O-N 3.35Å
173	R	98.5	Very high	98.6	Very high	113 Å²	113	30.8 Å²	30.8	43%	0.426	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-2.3	174.5	-65.9	-171.5	-56.2	-87.5	-3	114.1	P169 E175	P169-R173 WeakPolarHBondContact O-CG 3.3Å; P169-R173 PolarHBondContact O-N 3.1Å; P169-R173 PolarHBondContact O-NH1 3.45Å; R173-E175 HydrophobicContact CB-CG 4.02Å; R173-E175 IonicContact CZ-OE1 2.71Å; R173-E175 IonicContact CZ-OE2 3.6Å; R173-E175 IonicContact NE-OE1 3.58Å; R173-E175 PolarHBondContact NE-OE1 3.37Å; R173-E175 IonicContact NE-OE2 2.83Å; R173-E175 VanDerWaalsContact NH2-CD 3.31Å; R173-E175 IonicContact NH2-OE1 3.99Å; R173-E175 PolarHBondContact NH2-OE1 3.44Å; R173-E175 VanDerWaalsContact NH2-OE1 3.09Å; R173-E175 IonicContact NH2-OE2 3.52Å; R173-E175 PolarHBondContact NH2-OE2 3.35Å; R173-E175 PolarHBondContact O-N 3.48Å
174	G	98.4	Very high	98.6	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	66.2	16.4	-177.6	0	0	0	0	0	114.4	R97 S101 R170 L171 A172 I176	R97-G174 PolarHBondContact NH1-O 2.58Å; S101-G174 PolarHBondContact OG-O 2.7Å; R170-G174 PolarHBondContact O-N 2.85Å; L171-G174 PolarHBondContact O-N 3.24Å; L171-G174 VanDerWaalsContact O-N 3.12Å; A172-G174 PolarHBondContact O-N 3.35Å; G174-I176 VanDerWaalsContact C-N 3.3Å
175	E	98.5	Very high	98.4	Very high	97 Å²	97	33.6 Å²	33.6	45%	0.453	16%	0.16	S	C	.	.	S	Bend	trans	-66.1	-38.6	175.7	-68.6	171.8	-179.6	0	0	110.5	R97 R170 R173	R97-E175 PolarHBondContact NH2-O 3.15Å; R170-E175 HydrophobicContact CB-CB 4.47Å; R170-E175 WeakPolarHBondContact CG-OE2 3.38Å; R170-E175 PolarHBondContact O-N 3.17Å; R173-E175 HydrophobicContact CB-CG 4.02Å; R173-E175 IonicContact CZ-OE1 2.71Å; R173-E175 IonicContact CZ-OE2 3.6Å; R173-E175 IonicContact NE-OE1 3.58Å; R173-E175 PolarHBondContact NE-OE1 3.37Å; R173-E175 IonicContact NE-OE2 2.83Å; R173-E175 VanDerWaalsContact NH2-CD 3.31Å; R173-E175 IonicContact NH2-OE1 3.99Å; R173-E175 PolarHBondContact NH2-OE1 3.44Å; R173-E175 VanDerWaalsContact NH2-OE1 3.09Å; R173-E175 IonicContact NH2-OE2 3.52Å; R173-E175 PolarHBondContact NH2-OE2 3.35Å; R173-E175 PolarHBondContact O-N 3.48Å
176	I	98.6	Very high	98.1	Very high	8 Å²	8	33.2 Å²	33.2	4%	0.041	16%	0.162	C	C	.	.	S	Bend	trans	-120.5	147.9	174.4	58.8	173.8	0	0	0	111.1	Q147 W167 R170 L171 G174 D223	Q147-I176 PolarHBondContact NE2-O 3.32Å; W167-I176 HydrophobicContact CE3-CD1 3.53Å; W167-I176 HydrophobicContact CZ3-CD1 3.85Å; R170-I176 HydrophobicContact CB-CD1 3.77Å; R170-I176 HydrophobicContact CB-CG1 3.75Å; R170-I176 VanDerWaalsContact NH2-CG2 3.31Å; L171-I176 HydrophobicContact CD2-CD1 4.1Å; L171-I176 HydrophobicContact CD2-CG1 3.83Å; L171-I176 HydrophobicContact CG-CD1 3.94Å; L171-I176 HydrophobicContact CG-CG1 3.93Å; G174-I176 VanDerWaalsContact C-N 3.3Å; I176-D223 VanDerWaalsContact CA-OD2 3.26Å; I176-D223 WeakPolarHBondContact CA-OD2 3.29Å; I176-D223 HydrophobicContact CB-CB 3.95Å; I176-D223 HydrophobicContact CG2-CB 4.13Å
177	L	98.8	Very high	97.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	15%	0.15	C	C	.	.			trans	-111.3	132.4	179.8	-178.5	60.3	0	0	0	109.9	F95 V100 V143 N218 V221 A222 D223 I224	F95-L177 HydrophobicContact CE1-CD2 4.01Å; F95-L177 HydrophobicContact CZ-CD2 4.25Å; V100-L177 HydrophobicContact CG1-CD1 4.06Å; V100-L177 HydrophobicContact CG2-CD1 3.95Å; V100-L177 HydrophobicContact CG2-CD2 4.43Å; V143-L177 HydrophobicContact CG1-CD1 4.33Å; L177-N218 HydrophobicContact CD1-CB 4.4Å; L177-N218 WeakPolarHBondContact CD1-ND2 3.42Å; L177-N218 HydrophobicContact CD2-CB 4.07Å; L177-N218 HydrophobicContact CG-CB 4.11Å; L177-V221 HydrophobicContact CD2-CG2 3.77Å; L177-A222 CarbonylContact O-C 3.56Å; L177-A222 WeakPolarHBondContact O-CA 3.41Å; L177-D223 PolarHBondContact N-OD2 3.44Å; L177-D223 PolarHBondContact O-N 3.04Å; L177-I224 PolarHBondContact O-N 3.3Å
178	G	98.8	Very high	97.6	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	160	175.3	0	0	0	0	0	113.8	N218 I224	G178-N218 WeakPolarHBondContact O-CB 2.91Å; G178-N218 PolarHBondContact O-ND2 2.84Å; G178-I224 CarbonylContact C-O 3.53Å; G178-I224 WeakPolarHBondContact CA-O 3.42Å
179	C	98.9	Very high	97.2	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.007	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	164.7	166.4	66.7	0	0	0	0	111.3	I216 T217 N218 A222 I224 A225 V226	C179-I216 HydrophobicContact CB-CG2 3.91Å; C179-T217 VanDerWaalsContact CB-O 3.26Å; C179-T217 WeakPolarHBondContact CB-O 3.31Å; C179-N218 HydrophobicContact CB-CB 4.04Å; C179-A222 HydrophobicContact CB-CB 3.8Å; C179-I224 PolarHBondContact N-O 2.94Å; C179-I224 PolarHBondContact SG-O 3.08Å; C179-A225 WeakPolarHBondContact O-CA 3.15Å; C179-A225 WeakPolarHBondContact SG-CB 3.22Å; C179-V226 PolarHBondContact O-N 3.39Å
180	F	98.9	Very high	96.9	Very high	15 Å²	15	39.6 Å²	39.6	7%	0.066	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	110.6	-174	179.8	-97.9	0	0	0	111.5	L150 L182 I216 V226 W228 P289 C292 L293	L150-F180 HydrophobicContact CB-CB 3.65Å; L150-F180 HydrophobicContact CB-CD1 4.36Å; L150-F180 HydrophobicContact CB-CD2 3.85Å; L150-F180 HydrophobicContact CB-CE2 4.4Å; L150-F180 HydrophobicContact CB-CG 3.74Å; L150-F180 HydrophobicContact CD1-CB 4.29Å; L150-F180 HydrophobicContact CD1-CD1 4.25Å; L150-F180 HydrophobicContact CD1-CG 4.37Å; L150-F180 HydrophobicContact CG-CG 4.49Å; L150-F180 WeakPolarHBondContact O-CD2 3.11Å; F180-L182 HydrophobicContact CD1-CB 4.06Å; F180-L182 HydrophobicContact CE1-CB 3.54Å; F180-L182 HydrophobicContact CE1-CD2 3.99Å; F180-L182 HydrophobicContact CE1-CG 4.38Å; F180-L182 HydrophobicContact CZ-CB 4.35Å; F180-I216 WeakPolarHBondContact O-CG2 3.38Å; F180-V226 CarbonylContact C-O 3.49Å; F180-V226 WeakPolarHBondContact CA-O 3.44Å; F180-V226 HydrophobicContact CD2-CB 4.35Å; F180-V226 HydrophobicContact CD2-CG1 4.31Å; F180-W228 AromaticContact CD2-NE1 3.65Å; F180-W228 AromaticContact CE2-CD1 3.77Å; F180-W228 AromaticContact CE2-CE2 3.8Å; F180-W228 HydrophobicContact CE2-CZ2 4.17Å; F180-W228 AromaticContact CE2-NE1 2.87Å; F180-W228 AromaticContact CZ-CD1 3.67Å; F180-W228 AromaticContact CZ-NE1 3.07Å; F180-P289 HydrophobicContact CZ-CB 4.06Å; F180-C292 HydrophobicContact CE2-CB 4.11Å; F180-C292 HydrophobicContact CZ-CB 4.24Å; F180-L293 HydrophobicContact CE1-CD2 4.37Å
181	G	98.6	Very high	96.5	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	95.1	-176.1	0	0	0	0	0	112.9	K213 V226 W228	G181-K213 WeakPolarHBondContact O-CE 3.09Å; G181-V226 PolarHBondContact N-O 3.49Å; G181-W228 PolarHBondContact O-N 3.23Å
182	L	98.4	Very high	96.1	Very high	11 Å²	11	37.2 Å²	37.2	6%	0.058	22%	0.216	C	C	.	.			trans	-119.2	-60.8	174.2	179.6	65.1	0	0	0	111.9	F180 P191 M194 K213 W228 P289 L293	F180-L182 HydrophobicContact CD1-CB 4.06Å; F180-L182 HydrophobicContact CE1-CB 3.54Å; F180-L182 HydrophobicContact CE1-CD2 3.99Å; F180-L182 HydrophobicContact CE1-CG 4.38Å; F180-L182 HydrophobicContact CZ-CB 4.35Å; L182-P191 HydrophobicContact CD1-CB 4.12Å; L182-P191 HydrophobicContact CD2-CB 4.4Å; L182-P191 HydrophobicContact CG-CB 4.27Å; L182-M194 HydrophobicContact CD1-CE 3.72Å; L182-K213 PolarHBondContact O-NZ 2.85Å; L182-W228 HydrophobicContact CD1-CB 3.91Å; L182-W228 HydrophobicContact CD1-CG 4.11Å; L182-P289 HydrophobicContact CD1-CB 3.94Å; L182-P289 HydrophobicContact CD1-CG 4.24Å; L182-P289 HydrophobicContact CD2-CB 3.95Å; L182-L293 HydrophobicContact CD2-CD1 3.94Å
183	T	97.3	Very high	95.8	Very high	48 Å²	48	38.1 Å²	38.1	29%	0.294	23%	0.225	S	C	.	.			trans	-63.1	138.9	-175.8	-62.2	0	0	0	0	112.4	K213 T214	T183-K213 CarbonylContact O-C 3.6Å; T183-K213 WeakPolarHBondContact O-CA 3.4Å; T183-K213 WeakPolarHBondContact O-CB 3.4Å; T183-T214 HydrophobicContact CG2-CG2 4.44Å; T183-T214 PolarHBondContact O-N 3.4Å
184	E	98.3	Very high	95.8	Very high	6 Å²	6	32.8 Å²	32.8	3%	0.028	21%	0.206	C	C	.	.	B	Isolated β-bridge	trans	-123.6	162.6	179.4	-52	-170.9	159	0	0	110.4	N186 H187 M194 E195 T196 S212 K213	E184-N186 PolarHBondContact O-N 2.86Å; E184-N186 VanDerWaalsContact O-N 3.16Å; E184-H187 HydrophobicContact CB-CB 4.18Å; E184-H187 PolarHBondContact N-O 3.41Å; E184-H187 CarbonylContact O-C 3.53Å; E184-H187 PolarHBondContact O-N 3.41Å; E184-H187 IonicContact OE2-CD2 2.73Å; E184-M194 HydrophobicContact CG-CB 4.48Å; E184-M194 WeakPolarHBondContact OE2-CA 3.25Å; E184-E195 PolarHBondContact OE2-N 3.01Å; E184-T196 WeakPolarHBondContact OE1-CB 3.24Å; E184-T196 PolarHBondContact OE1-N 3.43Å; E184-T196 PolarHBondContact OE1-OG1 3.28Å; E184-S212 WeakPolarHBondContact CG-O 3.5Å; E184-K213 HydrophobicContact CG-CD 3.77Å; E184-K213 IonicContact OE1-NZ 3.13Å; E184-K213 PolarHBondContact OE1-NZ 3.27Å
185	P	94.5	Very high	95.8	Very high	78 Å²	78	37.9 Å²	37.9	51%	0.506	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.8	-39	179.4	-28.8	36.7	0	0	0	113.9	T214	P185-T214 HydrophobicContact CG-CG2 4.08Å
186	N	92.9	Very high	95.8	Very high	112 Å²	112	33.3 Å²	33.3	60%	0.599	21%	0.208	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-8.2	-179	-60.2	-28.1	0	0	0	113.4	E184 E195	E184-N186 PolarHBondContact O-N 2.86Å; E184-N186 VanDerWaalsContact O-N 3.16Å; N186-E195 PolarHBondContact ND2-OE1 3.03Å
187	H	93.5	Very high	95.7	Very high	31 Å²	31	40.1 Å²	40.1	14%	0.144	23%	0.233	C	C	.	.	B	Isolated β-bridge	trans	-137.2	87.4	-170.1	-63.4	-68	0	0	0	112	E184 D190 G193 E195	E184-H187 HydrophobicContact CB-CB 4.18Å; E184-H187 PolarHBondContact N-O 3.41Å; E184-H187 CarbonylContact O-C 3.53Å; E184-H187 PolarHBondContact O-N 3.41Å; E184-H187 IonicContact OE2-CD2 2.73Å; H187-D190 WeakPolarHBondContact CB-O 3.44Å; H187-D190 PolarHBondContact ND1-O 3.44Å; H187-G193 VanDerWaalsContact CE1-C 3.43Å; H187-G193 PolarHBondContact CE1-O 3.17Å; H187-G193 PolarHBondContact NE2-O 3.14Å; H187-E195 IonicContact NE2-OE1 2.77Å
188	G	91.8	Very high	95.7	Very high	47 Å²	47	40.1 Å²	40.1	49%	0.485	23%	0.233	S	C	.	.	S	Bend	trans	-93.2	-79.4	170.2	0	0	0	0	0	112.2	D190	G188-D190 VanDerWaalsContact C-N 3.32Å; G188-D190 PolarHBondContact O-N 3.18Å
189	S	91.3	Very high	95.7	Very high	75 Å²	75	46.6 Å²	46.6	52%	0.524	26%	0.262	S	S	.	.	S	Bend	trans	-72.9	-20.8	-177.8	-59.2	0	0	0	0	114.1	P191	S189-P191 VanDerWaalsContact C-CD 3.43Å; S189-P191 WeakPolarHBondContact O-CD 3.46Å
190	D	93	Very high	95.7	Very high	95 Å²	95	49.7 Å²	49.7	51%	0.508	28%	0.275	S	S	.	.			trans	-112.1	81.3	173.9	175.2	25.7	0	0	0	111.2	H187 G188 G192 G193	H187-D190 WeakPolarHBondContact CB-O 3.44Å; H187-D190 PolarHBondContact ND1-O 3.44Å; G188-D190 VanDerWaalsContact C-N 3.32Å; G188-D190 PolarHBondContact O-N 3.18Å; D190-G192 PolarHBondContact O-N 3.37Å; D190-G192 PolarHBondContact OD1-N 2.97Å; D190-G192 VanDerWaalsContact OD1-N 3.15Å; D190-G193 PolarHBondContact O-N 3.07Å; D190-G193 PolarHBondContact OD1-N 2.96Å
191	P	89.4	Confident	95.6	Very high	14 Å²	14	51.6 Å²	51.6	9%	0.091	29%	0.286	C	S	.	.	G	3₁₀ helix	trans	-72.7	-12.6	176	27.4	-31.7	0	0	0	113	L182 S189 G193 M194 L286 F290	L182-P191 HydrophobicContact CD1-CB 4.12Å; L182-P191 HydrophobicContact CD2-CB 4.4Å; L182-P191 HydrophobicContact CG-CB 4.27Å; S189-P191 VanDerWaalsContact C-CD 3.43Å; S189-P191 WeakPolarHBondContact O-CD 3.46Å; P191-G193 PolarHBondContact O-N 3.31Å; P191-M194 WeakPolarHBondContact O-CB 3.16Å; P191-M194 WeakPolarHBondContact O-CE 3.28Å; P191-M194 PolarHBondContact O-N 3.48Å; P191-L286 HydrophobicContact CB-CD2 4.26Å; P191-L286 HydrophobicContact CG-CD2 4.31Å; P191-F290 HydrophobicContact CG-CE1 3.59Å; P191-F290 HydrophobicContact CG-CZ 3.79Å
192	G	90.8	Very high	95.4	Very high	27 Å²	27	56.1 Å²	56.1	28%	0.278	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-66.4	-29.6	173.8	0	0	0	0	0	112.1	D190 M194 K230	D190-G192 PolarHBondContact O-N 3.37Å; D190-G192 PolarHBondContact OD1-N 2.97Å; D190-G192 VanDerWaalsContact OD1-N 3.15Å; G192-M194 VanDerWaalsContact C-N 3.27Å; G192-M194 PolarHBondContact O-N 2.93Å; G192-K230 WeakPolarHBondContact O-CE 3.39Å; G192-K230 PolarHBondContact O-NZ 2.97Å
193	G	93.6	Very high	95.4	Very high	22 Å²	22	60.9 Å²	60.9	23%	0.227	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-68.8	-14	176.1	0	0	0	0	0	115.7	H187 D190 P191 K230	H187-G193 VanDerWaalsContact CE1-C 3.43Å; H187-G193 PolarHBondContact CE1-O 3.17Å; H187-G193 PolarHBondContact NE2-O 3.14Å; D190-G193 PolarHBondContact O-N 3.07Å; D190-G193 PolarHBondContact OD1-N 2.96Å; P191-G193 PolarHBondContact O-N 3.31Å; G193-K230 PolarHBondContact O-NZ 3.1Å; G193-K230 VanDerWaalsContact O-NZ 3.11Å
194	M	97.1	Very high	95.3	Very high	2 Å²	2	61.4 Å²	61.4	1%	0.01	36%	0.355	C	S	.	.			trans	-43	141.8	-167.3	76.1	175	71.3	0	0	116	L182 E184 P191 G192 W228 K230 V236 L286	L182-M194 HydrophobicContact CD1-CE 3.72Å; E184-M194 HydrophobicContact CG-CB 4.48Å; E184-M194 WeakPolarHBondContact OE2-CA 3.25Å; P191-M194 WeakPolarHBondContact O-CB 3.16Å; P191-M194 WeakPolarHBondContact O-CE 3.28Å; P191-M194 PolarHBondContact O-N 3.48Å; G192-M194 VanDerWaalsContact C-N 3.27Å; G192-M194 PolarHBondContact O-N 2.93Å; M194-W228 HydrophobicContact CE-CB 4.39Å; M194-K230 HydrophobicContact CG-CD 4.18Å; M194-K230 HydrophobicContact CG-CG 3.88Å; M194-K230 VanDerWaalsContact O-CD 3.26Å; M194-K230 WeakPolarHBondContact O-CD 3.41Å; M194-K230 WeakPolarHBondContact O-CE 3.33Å; M194-K230 PolarHBondContact O-NZ 3.08Å; M194-K230 HydrophobicContact SD-CG 4.43Å; M194-V236 HydrophobicContact CE-CB 4.38Å; M194-V236 HydrophobicContact CE-CG1 3.68Å; M194-V236 HydrophobicContact CE-CG2 3.71Å; M194-V236 HydrophobicContact SD-CG1 4.05Å; M194-V236 HydrophobicContact SD-CG2 4.01Å; M194-L286 HydrophobicContact CE-CD2 4.43Å
195	E	97.9	Very high	95.2	Very high	107 Å²	107	68.7 Å²	68.7	50%	0.5	38%	0.382	S	S	.	.			trans	-97.1	-23.5	-175.8	-64.3	175.4	-165.9	0	0	112.9	E184 N186 H187 R197	E184-E195 PolarHBondContact OE2-N 3.01Å; N186-E195 PolarHBondContact ND2-OE1 3.03Å; H187-E195 IonicContact NE2-OE1 2.77Å; E195-R197 WeakPolarHBondContact O-CG 3.34Å; E195-R197 PolarHBondContact O-N 2.95Å
196	T	98.6	Very high	95.4	Very high	1 Å²	1	66 Å²	66	1%	0.006	36%	0.364	C	S	.	.			trans	-59.2	128	177	-59.2	0	0	0	0	110.3	E184 T210 K213 A229 K230 M269	E184-T196 WeakPolarHBondContact OE1-CB 3.24Å; E184-T196 PolarHBondContact OE1-N 3.43Å; E184-T196 PolarHBondContact OE1-OG1 3.28Å; T196-T210 WeakPolarHBondContact CA-O 3.22Å; T196-K213 WeakPolarHBondContact OG1-CE 3Å; T196-K213 PolarHBondContact OG1-NZ 2.73Å; T196-A229 HydrophobicContact CG2-CB 3.64Å; T196-K230 PolarHBondContact O-N 3.28Å; T196-M269 HydrophobicContact CG2-CE 3.53Å
197	R	98.4	Very high	95.7	Very high	150 Å²	150	61.5 Å²	61.5	57%	0.566	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.2	151.4	-178.7	-58.4	-169.5	-178.9	-83.4	-2.7	112.1	E195 L209 T210 K230	E195-R197 WeakPolarHBondContact O-CG 3.34Å; E195-R197 PolarHBondContact O-N 2.95Å; R197-L209 WeakPolarHBondContact O-CA 3.31Å; R197-T210 PolarHBondContact N-O 3.45Å; R197-T210 PolarHBondContact O-N 3.39Å; R197-K230 CarbonylContact C-O 3.4Å; R197-K230 VanDerWaalsContact CA-O 3.31Å; R197-K230 WeakPolarHBondContact CA-O 3.22Å
198	A	98.5	Very high	95.9	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	114.6	169.9	0	0	0	0	0	108.6	F207 T208 L209 A229 K230 C231 F239	A198-F207 HydrophobicContact CB-CD1 4.19Å; A198-T208 WeakPolarHBondContact CA-O 3.43Å; A198-L209 HydrophobicContact CB-CD1 3.73Å; A198-L209 HydrophobicContact CB-CG 3.94Å; A198-A229 HydrophobicContact CB-CB 4.1Å; A198-K230 PolarHBondContact N-O 2.96Å; A198-C231 WeakPolarHBondContact O-CA 3.37Å; A198-F239 HydrophobicContact CB-CE1 4.33Å; A198-F239 HydrophobicContact CB-CE2 3.57Å; A198-F239 HydrophobicContact CB-CZ 3.43Å; A198-F239 VanDerWaalsContact CB-CZ 3.43Å
199	K	98.2	Very high	96.2	Very high	137 Å²	137	59.2 Å²	59.2	60%	0.596	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.7	127.9	179.1	-176.7	-179.2	178.9	-176.2	0	109.9	F207 T208	K199-F207 CarbonylContact O-C 3.56Å; K199-F207 VanDerWaalsContact O-CA 3.27Å; K199-F207 WeakPolarHBondContact O-CA 3.27Å; K199-T208 PolarHBondContact N-O 3.17Å; K199-T208 PolarHBondContact O-N 2.76Å
200	F	98.1	Very high	96.6	Very high	66 Å²	66	58.8 Å²	58.8	29%	0.289	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	135.1	179.8	-174.2	-121.9	0	0	0	111.7	P202 T206 F207 D232 E276	F200-P202 HydrophobicContact CD1-CG 3.97Å; F200-P202 HydrophobicContact CE1-CB 4.16Å; F200-P202 HydrophobicContact CE1-CG 3.99Å; F200-T206 WeakPolarHBondContact CD2-O 3.43Å; F200-F207 HydrophobicContact CB-CD1 3.98Å; F200-F207 HydrophobicContact CB-CE1 3.69Å; F200-F207 HydrophobicContact CB-CZ 4.24Å; F200-F207 HydrophobicContact CD2-CD1 4.09Å; F200-F207 AromaticContact CD2-CD2 3.93Å; F200-F207 HydrophobicContact CD2-CD2 3.93Å; F200-F207 AromaticContact CD2-CE1 3.78Å; F200-F207 HydrophobicContact CD2-CE1 3.78Å; F200-F207 AromaticContact CD2-CE2 3.59Å; F200-F207 HydrophobicContact CD2-CE2 3.59Å; F200-F207 HydrophobicContact CD2-CG 4.17Å; F200-F207 AromaticContact CD2-CZ 3.5Å; F200-F207 HydrophobicContact CD2-CZ 3.5Å; F200-F207 HydrophobicContact CE2-CD2 4.44Å; F200-F207 AromaticContact CE2-CE2 3.96Å; F200-F207 HydrophobicContact CE2-CE2 3.96Å; F200-F207 HydrophobicContact CE2-CZ 4.16Å; F200-F207 HydrophobicContact CG-CE1 4.08Å; F200-F207 HydrophobicContact CG-CZ 4.12Å; F200-D232 PolarHBondContact N-OD2 3.4Å; F200-D232 VanDerWaalsContact N-OD2 3.12Å; F200-E276 HydrophobicContact CE2-CG 4.49Å
201	N	97.3	Very high	96.9	Very high	55 Å²	55	55.2 Å²	55.2	29%	0.294	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	104	170.3	-175.3	-12.3	0	0	0	110	S203 S204 R205 T206	N201-S203 PolarHBondContact O-N 3.5Å; N201-S203 WeakPolarHBondContact OD1-CB 3.44Å; N201-S203 PolarHBondContact OD1-N 3.22Å; N201-S203 PolarHBondContact OD1-OG 2.95Å; N201-S204 WeakPolarHBondContact CB-OG 3.01Å; N201-S204 PolarHBondContact ND2-OG 3.17Å; N201-S204 VanDerWaalsContact ND2-OG 3.15Å; N201-R205 WeakPolarHBondContact O-CA 3.33Å; N201-R205 PolarHBondContact O-N 3.17Å; N201-T206 PolarHBondContact N-O 3.26Å; N201-T206 PolarHBondContact O-N 3.05Å
202	P	95.5	Very high	97.3	Very high	94 Å²	94	56.5 Å²	56.5	61%	0.61	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-27.1	-179.6	-23.3	33.4	0	0	0	114.3	F200	F200-P202 HydrophobicContact CD1-CG 3.97Å; F200-P202 HydrophobicContact CE1-CB 4.16Å; F200-P202 HydrophobicContact CE1-CG 3.99Å
203	S	96.6	Very high	97.7	Very high	111 Å²	111	55.2 Å²	55.2	78%	0.776	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-37.5	-175	67.4	0	0	0	0	112.9	N201	N201-S203 PolarHBondContact O-N 3.5Å; N201-S203 WeakPolarHBondContact OD1-CB 3.44Å; N201-S203 PolarHBondContact OD1-N 3.22Å; N201-S203 PolarHBondContact OD1-OG 2.95Å
204	S	96	Very high	97.9	Very high	59 Å²	59	55 Å²	55	41%	0.413	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-10.3	177.5	50.7	0	0	0	0	113.1	N201 T206	N201-S204 WeakPolarHBondContact CB-OG 3.01Å; N201-S204 PolarHBondContact ND2-OG 3.17Å; N201-S204 VanDerWaalsContact ND2-OG 3.15Å; S204-T206 VanDerWaalsContact C-N 3.27Å; S204-T206 PolarHBondContact O-N 2.79Å; S204-T206 PolarHBondContact OG-OG1 3.14Å
205	R	97.1	Very high	98	Very high	159 Å²	159	62.4 Å²	62.4	60%	0.6	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.3	45.4	-170.1	-57.6	-175	63.8	170.7	-0.3	111.9	N201 E276	N201-R205 WeakPolarHBondContact O-CA 3.33Å; N201-R205 PolarHBondContact O-N 3.17Å; R205-E276 IonicContact CZ-OE2 3.25Å; R205-E276 VanDerWaalsContact CZ-OE2 3.25Å; R205-E276 IonicContact NE-OE2 2.86Å; R205-E276 PolarHBondContact NE-OE2 2.94Å; R205-E276 IonicContact NH2-OE1 2.86Å; R205-E276 IonicContact NH2-OE2 3.69Å; R205-E276 PolarHBondContact NH2-OE2 3.06Å; R205-E276 VanDerWaalsContact O-CB 3.29Å; R205-E276 WeakPolarHBondContact O-CB 3.49Å; R205-E276 PolarHBondContact O-N 3.01Å
206	T	98	Very high	98	Very high	22 Å²	22	57.6 Å²	57.6	14%	0.135	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	160.5	178.2	58.8	0	0	0	0	110.9	F200 N201 S204 E273 V274	F200-T206 WeakPolarHBondContact CD2-O 3.43Å; N201-T206 PolarHBondContact N-O 3.26Å; N201-T206 PolarHBondContact O-N 3.05Å; S204-T206 VanDerWaalsContact C-N 3.27Å; S204-T206 PolarHBondContact O-N 2.79Å; S204-T206 PolarHBondContact OG-OG1 3.14Å; T206-E273 VanDerWaalsContact CB-OE2 3.26Å; T206-E273 WeakPolarHBondContact CB-OE2 3.29Å; T206-E273 PolarHBondContact OG1-OE2 3.27Å; T206-V274 CarbonylContact C-O 3.52Å; T206-V274 WeakPolarHBondContact CA-O 3.41Å
207	F	98.5	Very high	98	Very high	17 Å²	17	58.6 Å²	58.6	8%	0.075	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	134	165.5	-70	-95.9	0	0	0	109.5	A198 K199 F200 L209 F239 V274 E276 L279	A198-F207 HydrophobicContact CB-CD1 4.19Å; K199-F207 CarbonylContact O-C 3.56Å; K199-F207 VanDerWaalsContact O-CA 3.27Å; K199-F207 WeakPolarHBondContact O-CA 3.27Å; F200-F207 HydrophobicContact CB-CD1 3.98Å; F200-F207 HydrophobicContact CB-CE1 3.69Å; F200-F207 HydrophobicContact CB-CZ 4.24Å; F200-F207 HydrophobicContact CD2-CD1 4.09Å; F200-F207 AromaticContact CD2-CD2 3.93Å; F200-F207 HydrophobicContact CD2-CD2 3.93Å; F200-F207 AromaticContact CD2-CE1 3.78Å; F200-F207 HydrophobicContact CD2-CE1 3.78Å; F200-F207 AromaticContact CD2-CE2 3.59Å; F200-F207 HydrophobicContact CD2-CE2 3.59Å; F200-F207 HydrophobicContact CD2-CG 4.17Å; F200-F207 AromaticContact CD2-CZ 3.5Å; F200-F207 HydrophobicContact CD2-CZ 3.5Å; F200-F207 HydrophobicContact CE2-CD2 4.44Å; F200-F207 AromaticContact CE2-CE2 3.96Å; F200-F207 HydrophobicContact CE2-CE2 3.96Å; F200-F207 HydrophobicContact CE2-CZ 4.16Å; F200-F207 HydrophobicContact CG-CE1 4.08Å; F200-F207 HydrophobicContact CG-CZ 4.12Å; F207-L209 HydrophobicContact CB-CD1 3.72Å; F207-F239 HydrophobicContact CB-CE1 3.97Å; F207-F239 AromaticContact CD1-CE1 3.88Å; F207-F239 HydrophobicContact CD1-CE1 3.88Å; F207-F239 AromaticContact CD1-CZ 3.98Å; F207-F239 HydrophobicContact CD1-CZ 3.98Å; F207-F239 AromaticContact CD2-CE1 3.77Å; F207-F239 HydrophobicContact CD2-CE1 3.77Å; F207-F239 HydrophobicContact CE1-CE1 4.29Å; F207-F239 HydrophobicContact CE1-CZ 4.3Å; F207-F239 HydrophobicContact CE2-CE1 4.2Å; F207-F239 AromaticContact CG-CE1 3.6Å; F207-F239 HydrophobicContact CG-CE1 3.6Å; F207-F239 HydrophobicContact CG-CZ 4.16Å; F207-F239 HydrophobicContact CZ-CE1 4.44Å; F207-V274 PolarHBondContact N-O 3.38Å; F207-V274 PolarHBondContact O-N 3.48Å; F207-E276 HydrophobicContact CE2-CB 4.49Å; F207-E276 HydrophobicContact CE2-CG 4.33Å; F207-L279 HydrophobicContact CE2-CB 4.48Å; F207-L279 HydrophobicContact CE2-CD2 4.25Å; F207-L279 HydrophobicContact CZ-CD2 4.18Å
208	T	98.6	Very high	98	Very high	31 Å²	31	51.4 Å²	51.4	19%	0.19	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	115.8	169.9	-44.7	0	0	0	0	108.6	A198 K199 E271 V272 E273	A198-T208 WeakPolarHBondContact CA-O 3.43Å; K199-T208 PolarHBondContact N-O 3.17Å; K199-T208 PolarHBondContact O-N 2.76Å; T208-E271 HydrophobicContact CG2-CB 3.83Å; T208-E271 HydrophobicContact CG2-CG 4.32Å; T208-V272 WeakPolarHBondContact CA-O 3.44Å; T208-E273 WeakPolarHBondContact CB-OE1 3.07Å; T208-E273 WeakPolarHBondContact CG2-OE1 3.28Å; T208-E273 PolarHBondContact OG1-OE1 3.28Å
209	L	98.8	Very high	98	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	128.8	179.7	-84.8	68.8	0	0	0	111.3	R197 A198 F207 F239 L241 M269 E271 V272 V274	R197-L209 WeakPolarHBondContact O-CA 3.31Å; A198-L209 HydrophobicContact CB-CD1 3.73Å; A198-L209 HydrophobicContact CB-CG 3.94Å; F207-L209 HydrophobicContact CB-CD1 3.72Å; L209-F239 HydrophobicContact CD1-CD1 4.34Å; L209-F239 HydrophobicContact CD1-CE1 4.38Å; L209-F239 HydrophobicContact CD1-CG 4.44Å; L209-F239 HydrophobicContact CD2-CB 4.2Å; L209-F239 HydrophobicContact CD2-CD2 4.03Å; L209-F239 HydrophobicContact CD2-CG 4.09Å; L209-L241 HydrophobicContact CD2-CD1 3.95Å; L209-L241 HydrophobicContact CD2-CD2 4.24Å; L209-M269 HydrophobicContact CB-SD 4.28Å; L209-M269 HydrophobicContact CD2-SD 4.09Å; L209-E271 WeakPolarHBondContact O-CA 3.09Å; L209-E271 PolarHBondContact O-N 2.67Å; L209-V272 HydrophobicContact CB-CB 4.44Å; L209-V272 PolarHBondContact N-O 3.17Å; L209-V272 PolarHBondContact O-N 3.4Å; L209-V274 HydrophobicContact CD1-CB 4.15Å; L209-V274 HydrophobicContact CD1-CG2 3.86Å; L209-V274 HydrophobicContact CD2-CG2 4.33Å
210	T	98.8	Very high	98	Very high	65 Å²	65	46.1 Å²	46.1	40%	0.399	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	128.9	175.3	-57.5	0	0	0	0	110.4	T196 R197 M269 E271	T196-T210 WeakPolarHBondContact CA-O 3.22Å; R197-T210 PolarHBondContact N-O 3.45Å; R197-T210 PolarHBondContact O-N 3.39Å; T210-M269 WeakPolarHBondContact CA-O 3Å; T210-E271 PolarHBondContact OG1-N 3.18Å
211	G	98.4	Very high	98	Very high	21 Å²	21	45.7 Å²	45.7	22%	0.216	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	155.7	-172.7	177	0	0	0	0	0	113.5	M269	G211-M269 PolarHBondContact N-O 3.06Å; G211-M269 PolarHBondContact O-N 3.31Å
212	S	98.3	Very high	98.1	Very high	40 Å²	40	43.2 Å²	43.2	28%	0.28	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	138.7	177.8	70	0	0	0	0	112	E184 I267	E184-S212 WeakPolarHBondContact CG-O 3.5Å; S212-I267 CarbonylContact C-O 3.53Å; S212-I267 WeakPolarHBondContact CA-O 3.43Å
213	K	98.7	Very high	98.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	147.3	170.5	-49.5	-57.7	-168.1	175.4	0	109.4	G181 L182 T183 E184 T196 I216 W228 M266 I267 M269	G181-K213 WeakPolarHBondContact O-CE 3.09Å; L182-K213 PolarHBondContact O-NZ 2.85Å; T183-K213 CarbonylContact O-C 3.6Å; T183-K213 WeakPolarHBondContact O-CA 3.4Å; T183-K213 WeakPolarHBondContact O-CB 3.4Å; E184-K213 HydrophobicContact CG-CD 3.77Å; E184-K213 IonicContact OE1-NZ 3.13Å; E184-K213 PolarHBondContact OE1-NZ 3.27Å; T196-K213 WeakPolarHBondContact OG1-CE 3Å; T196-K213 PolarHBondContact OG1-NZ 2.73Å; K213-I216 HydrophobicContact CB-CD1 3.9Å; K213-I216 HydrophobicContact CB-CG1 3.81Å; K213-W228 WeakPolarHBondContact CE-O 3.25Å; K213-W228 PolarHBondContact NZ-O 3.46Å; K213-M266 CarbonylContact O-C 3.43Å; K213-M266 WeakPolarHBondContact O-CA 3.49Å; K213-M266 VanDerWaalsContact O-CB 3.24Å; K213-M266 WeakPolarHBondContact O-CB 3.26Å; K213-I267 HydrophobicContact CB-CB 4.03Å; K213-I267 HydrophobicContact CG-CB 4.31Å; K213-I267 PolarHBondContact N-O 3.05Å; K213-I267 PolarHBondContact O-N 2.88Å; K213-M269 HydrophobicContact CG-CE 4.21Å
214	T	98.4	Very high	98.4	Very high	17 Å²	17	36.4 Å²	36.4	10%	0.104	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	159.7	-177.7	-168.9	0	0	0	0	111.4	T183 P185 I216	T183-T214 HydrophobicContact CG2-CG2 4.44Å; T183-T214 PolarHBondContact O-N 3.4Å; P185-T214 HydrophobicContact CG-CG2 4.08Å; T214-I216 VanDerWaalsContact C-N 3.3Å; T214-I216 WeakPolarHBondContact O-CD1 3.38Å; T214-I216 PolarHBondContact O-N 3.48Å
215	W	98.3	Very high	98.5	Very high	158 Å²	158	33.6 Å²	33.6	60%	0.598	17%	0.173	S	C	*	.	E	Extended strand (participates in β ladder)	trans	59.2	38.1	-174.3	-61	111.6	0	0	0	113.7	T217 I253 K256 T264 G265	W215-T217 PolarHBondContact O-N 2.61Å; W215-I253 HydrophobicContact CD2-CD1 4.01Å; W215-I253 HydrophobicContact CE3-CD1 3.85Å; W215-I253 HydrophobicContact CE3-CG2 4.49Å; W215-I253 HydrophobicContact CG-CD1 4.49Å; W215-I253 HydrophobicContact CH2-CG2 3.93Å; W215-I253 HydrophobicContact CZ3-CD1 4.2Å; W215-I253 HydrophobicContact CZ3-CG2 3.79Å; W215-K256 HydrophobicContact CZ3-CG 4.19Å; W215-T264 HydrophobicContact CE3-CG2 4.16Å; W215-G265 PolarHBondContact N-O 3.23Å
216	I	98.8	Very high	98.6	Very high	7 Å²	7	26 Å²	26	4%	0.036	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	106.8	-175.5	-49.2	-51.9	0	0	0	110	C179 F180 K213 T214 S219 G265 I267	C179-I216 HydrophobicContact CB-CG2 3.91Å; F180-I216 WeakPolarHBondContact O-CG2 3.38Å; K213-I216 HydrophobicContact CB-CD1 3.9Å; K213-I216 HydrophobicContact CB-CG1 3.81Å; T214-I216 VanDerWaalsContact C-N 3.3Å; T214-I216 WeakPolarHBondContact O-CD1 3.38Å; T214-I216 PolarHBondContact O-N 3.48Å; I216-S219 PolarHBondContact O-N 2.86Å; I216-S219 PolarHBondContact O-OG 2.68Å; I216-G265 PolarHBondContact N-O 3.45Å; I216-G265 PolarHBondContact O-N 3.26Å; I216-I267 HydrophobicContact CB-CD1 4.47Å; I216-I267 HydrophobicContact CB-CG1 4.48Å; I216-I267 HydrophobicContact CG1-CD1 4.24Å; I216-I267 HydrophobicContact CG1-CG1 4.28Å; I216-I267 HydrophobicContact CG2-CD1 3.93Å; I216-I267 HydrophobicContact CG2-CG1 4.36Å
217	T	98.8	Very high	98.6	Very high	21 Å²	21	25 Å²	25	13%	0.129	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.2	140.9	170.9	-64.4	0	0	0	0	110.5	V146 C179 W215 S219 S262 A263	V146-T217 HydrophobicContact CG2-CG2 3.83Å; C179-T217 VanDerWaalsContact CB-O 3.26Å; C179-T217 WeakPolarHBondContact CB-O 3.31Å; W215-T217 PolarHBondContact O-N 2.61Å; T217-S219 PolarHBondContact O-N 2.78Å; T217-S219 VanDerWaalsContact O-N 3.16Å; T217-S262 WeakPolarHBondContact CG2-OG 3.49Å; T217-A263 CarbonylContact C-O 3.49Å; T217-A263 WeakPolarHBondContact CA-O 3.29Å
218	N	98.6	Very high	98.6	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.134	C	C	.	.	T	Hydrogen-bonded Turn	trans	69	-15.2	-174.8	-55.6	-19.6	0	0	0	116.1	V146 L177 G178 C179 P220 V221 A222 A263	V146-N218 WeakPolarHBondContact CG1-ND2 3.4Å; L177-N218 HydrophobicContact CD1-CB 4.4Å; L177-N218 WeakPolarHBondContact CD1-ND2 3.42Å; L177-N218 HydrophobicContact CD2-CB 4.07Å; L177-N218 HydrophobicContact CG-CB 4.11Å; G178-N218 WeakPolarHBondContact O-CB 2.91Å; G178-N218 PolarHBondContact O-ND2 2.84Å; C179-N218 HydrophobicContact CB-CB 4.04Å; N218-P220 VanDerWaalsContact C-N 3.33Å; N218-P220 VanDerWaalsContact O-N 3.09Å; N218-V221 CarbonylContact O-C 3.6Å; N218-V221 VanDerWaalsContact O-CG2 3.31Å; N218-V221 WeakPolarHBondContact O-CG2 3.01Å; N218-V221 PolarHBondContact O-N 3.24Å; N218-A222 HydrophobicContact CB-CB 4.39Å; N218-A222 WeakPolarHBondContact O-CB 3.5Å; N218-A222 PolarHBondContact O-N 2.93Å; N218-A263 PolarHBondContact N-O 2.94Å
219	S	98.7	Very high	98.6	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	13%	0.125	C	C	.	.	G	3₁₀ helix	trans	-53.4	-38.8	-168.8	79.4	0	0	0	0	115.2	I216 T217 V221 R243 T250 G265 M266	I216-S219 PolarHBondContact O-N 2.86Å; I216-S219 PolarHBondContact O-OG 2.68Å; T217-S219 PolarHBondContact O-N 2.78Å; T217-S219 VanDerWaalsContact O-N 3.16Å; S219-V221 PolarHBondContact O-N 3.1Å; S219-V221 VanDerWaalsContact O-N 3.15Å; S219-R243 PolarHBondContact O-NH2 3.19Å; S219-T250 WeakPolarHBondContact O-CB 3.05Å; S219-T250 WeakPolarHBondContact O-CG2 3.39Å; S219-T250 PolarHBondContact O-OG1 3.42Å; S219-G265 VanDerWaalsContact OG-C 3.25Å; S219-G265 WeakPolarHBondContact OG-CA 3.3Å; S219-M266 WeakPolarHBondContact CB-O 3.34Å; S219-M266 PolarHBondContact OG-N 2.7Å; S219-M266 PolarHBondContact OG-O 2.94Å
220	P	98.6	Very high	98.6	Very high	25 Å²	25	24.4 Å²	24.4	16%	0.162	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-65.1	-21.5	-179.3	-24	37.2	0	0	0	114.5	N218 R243 T250 K252	N218-P220 VanDerWaalsContact C-N 3.33Å; N218-P220 VanDerWaalsContact O-N 3.09Å; P220-R243 PolarHBondContact O-NH1 3.21Å; P220-R243 PolarHBondContact O-NH2 2.85Å; P220-T250 WeakPolarHBondContact CA-O 3.19Å; P220-K252 HydrophobicContact CB-CB 4.26Å; P220-K252 HydrophobicContact CG-CB 4.01Å; P220-K252 HydrophobicContact CG-CG 4.41Å
221	V	98.3	Very high	98.5	Very high	57 Å²	57	22 Å²	22	35%	0.345	12%	0.118	S	C	.	.	G	3₁₀ helix	trans	-124.9	4	-173.1	-66.3	0	0	0	0	113.2	F95 L177 N218 S219 A263	F95-V221 HydrophobicContact CD1-CG2 3.9Å; F95-V221 HydrophobicContact CE1-CG2 3.83Å; L177-V221 HydrophobicContact CD2-CG2 3.77Å; N218-V221 CarbonylContact O-C 3.6Å; N218-V221 VanDerWaalsContact O-CG2 3.31Å; N218-V221 WeakPolarHBondContact O-CG2 3.01Å; N218-V221 PolarHBondContact O-N 3.24Å; S219-V221 PolarHBondContact O-N 3.1Å; S219-V221 VanDerWaalsContact O-N 3.15Å; V221-A263 HydrophobicContact CG2-CB 3.76Å
222	A	98.6	Very high	98.2	Very high	3 Å²	3	26.5 Å²	26.5	3%	0.025	14%	0.138	C	C	.	.			trans	-78.9	140.8	-179.1	0	0	0	0	0	111.7	L177 C179 N218 R243	L177-A222 CarbonylContact O-C 3.56Å; L177-A222 WeakPolarHBondContact O-CA 3.41Å; C179-A222 HydrophobicContact CB-CB 3.8Å; N218-A222 HydrophobicContact CB-CB 4.39Å; N218-A222 WeakPolarHBondContact O-CB 3.5Å; N218-A222 PolarHBondContact O-N 2.93Å; A222-R243 VanDerWaalsContact O-CZ 3.29Å; A222-R243 PolarHBondContact O-NE 2.91Å; A222-R243 PolarHBondContact O-NH2 2.85Å
223	D	98.8	Very high	97.9	Very high	58 Å²	58	29 Å²	29	31%	0.31	15%	0.148	S	C	.	.	S	Bend	trans	-81	-35.3	174.1	-58.3	-69	0	0	0	111.1	R97 I176 L177 R243	R97-D223 IonicContact NH2-OD2 3.52Å; R97-D223 PolarHBondContact NH2-OD2 3.13Å; I176-D223 VanDerWaalsContact CA-OD2 3.26Å; I176-D223 WeakPolarHBondContact CA-OD2 3.29Å; I176-D223 HydrophobicContact CB-CB 3.95Å; I176-D223 HydrophobicContact CG2-CB 4.13Å; L177-D223 PolarHBondContact N-OD2 3.44Å; L177-D223 PolarHBondContact O-N 3.04Å; D223-R243 PolarHBondContact O-N 3.3Å
224	I	98.8	Very high	97.6	Very high	4 Å²	4	31.3 Å²	31.3	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	157.4	175.7	68.3	171.4	0	0	0	112.5	V151 I155 W167 L171 L177 G178 C179 I240 L241 E242	V151-I224 HydrophobicContact CG1-CD1 3.95Å; V151-I224 HydrophobicContact CG1-CG1 4.39Å; I155-I224 HydrophobicContact CD1-CD1 4.19Å; W167-I224 HydrophobicContact CD2-CD1 4.4Å; W167-I224 HydrophobicContact CE3-CD1 4.22Å; W167-I224 HydrophobicContact CE3-CG2 4.08Å; W167-I224 HydrophobicContact CH2-CG2 3.64Å; W167-I224 HydrophobicContact CZ2-CG2 4.34Å; W167-I224 HydrophobicContact CZ3-CG2 3.49Å; W167-I224 VanDerWaalsContact CZ3-CG2 3.49Å; L171-I224 HydrophobicContact CD1-CD1 4.12Å; L171-I224 HydrophobicContact CD2-CD1 4.07Å; L171-I224 HydrophobicContact CD2-CG1 4.49Å; L171-I224 HydrophobicContact CG-CD1 4.49Å; L177-I224 PolarHBondContact O-N 3.3Å; G178-I224 CarbonylContact C-O 3.53Å; G178-I224 WeakPolarHBondContact CA-O 3.42Å; C179-I224 PolarHBondContact N-O 2.94Å; C179-I224 PolarHBondContact SG-O 3.08Å; I224-I240 HydrophobicContact CB-CG2 4.48Å; I224-I240 HydrophobicContact CD1-CG2 4.44Å; I224-L241 CarbonylContact C-O 3.58Å; I224-L241 VanDerWaalsContact CA-O 3.23Å; I224-L241 WeakPolarHBondContact CA-O 3.48Å; I224-E242 HydrophobicContact CG2-CG 4.36Å
225	A	98.9	Very high	97.5	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	126.6	173.2	0	0	0	0	0	110.7	C179 V227 I240 L241 F248 I267	C179-A225 WeakPolarHBondContact O-CA 3.15Å; C179-A225 WeakPolarHBondContact SG-CB 3.22Å; A225-V227 HydrophobicContact CB-CG2 3.93Å; A225-I240 WeakPolarHBondContact O-CA 3.3Å; A225-L241 HydrophobicContact CB-CB 4.43Å; A225-L241 PolarHBondContact N-O 3.16Å; A225-L241 PolarHBondContact O-N 3.28Å; A225-F248 HydrophobicContact CB-CE2 4.28Å; A225-F248 HydrophobicContact CB-CZ 3.84Å; A225-I267 HydrophobicContact CB-CD1 4.03Å
226	V	98.9	Very high	97.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	105.9	165.5	179.2	0	0	0	0	107.5	V151 P154 I155 C179 F180 G181 F239 L280	V151-V226 HydrophobicContact CG1-CG2 4.13Å; P154-V226 HydrophobicContact CB-CG1 4.43Å; P154-V226 HydrophobicContact CG-CG1 4.21Å; I155-V226 HydrophobicContact CD1-CG2 4.44Å; I155-V226 HydrophobicContact CG1-CG2 4.44Å; C179-V226 PolarHBondContact O-N 3.39Å; F180-V226 CarbonylContact C-O 3.49Å; F180-V226 WeakPolarHBondContact CA-O 3.44Å; F180-V226 HydrophobicContact CD2-CB 4.35Å; F180-V226 HydrophobicContact CD2-CG1 4.31Å; G181-V226 PolarHBondContact N-O 3.49Å; V226-F239 CarbonylContact C-O 3.51Å; V226-F239 WeakPolarHBondContact CA-O 3.42Å; V226-L280 HydrophobicContact CG1-CD1 4.1Å
227	V	98.9	Very high	97.4	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	136.9	-174.8	178	0	0	0	0	110.9	A225 G238 F239 L241 I267 M269	A225-V227 HydrophobicContact CB-CG2 3.93Å; V227-G238 CarbonylContact O-C 3.59Å; V227-G238 WeakPolarHBondContact O-CA 3.42Å; V227-F239 PolarHBondContact N-O 3.11Å; V227-F239 PolarHBondContact O-N 3.49Å; V227-L241 HydrophobicContact CB-CD1 4.01Å; V227-L241 HydrophobicContact CG2-CD1 4.03Å; V227-L241 HydrophobicContact CG2-CD2 4.35Å; V227-I267 HydrophobicContact CG2-CD1 4.2Å; V227-M269 HydrophobicContact CB-SD 4.49Å; V227-M269 HydrophobicContact CG1-CE 3.93Å; V227-M269 HydrophobicContact CG1-SD 3.75Å; V227-M269 HydrophobicContact CG2-SD 4.3Å
228	W	98.8	Very high	97.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	127.9	172.2	-57.7	89	0	0	0	111.1	Y158 F180 G181 L182 M194 K213 V236 C237 V283 P289	Y158-W228 HydrophobicContact CD2-CH2 4.27Å; Y158-W228 HydrophobicContact CE2-CH2 4.44Å; F180-W228 AromaticContact CD2-NE1 3.65Å; F180-W228 AromaticContact CE2-CD1 3.77Å; F180-W228 AromaticContact CE2-CE2 3.8Å; F180-W228 HydrophobicContact CE2-CZ2 4.17Å; F180-W228 AromaticContact CE2-NE1 2.87Å; F180-W228 AromaticContact CZ-CD1 3.67Å; F180-W228 AromaticContact CZ-NE1 3.07Å; G181-W228 PolarHBondContact O-N 3.23Å; L182-W228 HydrophobicContact CD1-CB 3.91Å; L182-W228 HydrophobicContact CD1-CG 4.11Å; M194-W228 HydrophobicContact CE-CB 4.39Å; K213-W228 WeakPolarHBondContact CE-O 3.25Å; K213-W228 PolarHBondContact NZ-O 3.46Å; W228-V236 HydrophobicContact CB-CG1 3.91Å; W228-V236 HydrophobicContact CE3-CG1 4.02Å; W228-C237 VanDerWaalsContact CA-O 3.31Å; W228-C237 WeakPolarHBondContact CA-O 3.46Å; W228-V283 HydrophobicContact CH2-CG1 3.99Å; W228-V283 HydrophobicContact CZ3-CG1 3.95Å; W228-P289 HydrophobicContact CD2-CB 3.91Å; W228-P289 HydrophobicContact CD2-CG 4.01Å; W228-P289 HydrophobicContact CE3-CB 4.5Å; W228-P289 HydrophobicContact CE3-CG 4.16Å; W228-P289 HydrophobicContact CG-CB 4.15Å; W228-P289 HydrophobicContact CG-CG 4.39Å; W228-P289 HydrophobicContact CZ2-CB 4.12Å
229	A	98.6	Very high	97.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	154.5	-178.2	0	0	0	0	0	111	T196 A198 V236 C237 F239	T196-A229 HydrophobicContact CG2-CB 3.64Å; A198-A229 HydrophobicContact CB-CB 4.1Å; A229-V236 CarbonylContact O-C 3.52Å; A229-V236 WeakPolarHBondContact O-CA 3.41Å; A229-C237 PolarHBondContact N-O 3.18Å; A229-C237 PolarHBondContact O-N 3.23Å; A229-F239 HydrophobicContact CB-CD2 4.36Å; A229-F239 HydrophobicContact CB-CE2 4.12Å
230	K	98.3	Very high	97.4	Very high	36 Å²	36	27.7 Å²	27.7	16%	0.157	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	121.6	172.4	-76.7	178.4	-178.6	159.2	0	110.6	G192 G193 M194 T196 R197 A198 K235 V236	G192-K230 WeakPolarHBondContact O-CE 3.39Å; G192-K230 PolarHBondContact O-NZ 2.97Å; G193-K230 PolarHBondContact O-NZ 3.1Å; G193-K230 VanDerWaalsContact O-NZ 3.11Å; M194-K230 HydrophobicContact CG-CD 4.18Å; M194-K230 HydrophobicContact CG-CG 3.88Å; M194-K230 VanDerWaalsContact O-CD 3.26Å; M194-K230 WeakPolarHBondContact O-CD 3.41Å; M194-K230 WeakPolarHBondContact O-CE 3.33Å; M194-K230 PolarHBondContact O-NZ 3.08Å; M194-K230 HydrophobicContact SD-CG 4.43Å; T196-K230 PolarHBondContact O-N 3.28Å; R197-K230 CarbonylContact C-O 3.4Å; R197-K230 VanDerWaalsContact CA-O 3.31Å; R197-K230 WeakPolarHBondContact CA-O 3.22Å; A198-K230 PolarHBondContact N-O 2.96Å; K230-K235 CarbonylContact C-O 3.49Å; K230-K235 WeakPolarHBondContact CA-O 3.49Å; K230-V236 HydrophobicContact CG-CG2 4.26Å
231	C	96.1	Very high	97.4	Very high	15 Å²	15	26.5 Å²	26.5	10%	0.101	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	168.9	168.7	-74.3	0	0	0	0	111.4	A198 D233 G234 K235 C237	A198-C231 WeakPolarHBondContact O-CA 3.37Å; C231-D233 WeakPolarHBondContact CB-OD1 3.31Å; C231-D233 PolarHBondContact O-N 2.94Å; C231-D233 VanDerWaalsContact O-N 3.15Å; C231-G234 WeakPolarHBondContact O-CA 3.5Å; C231-G234 PolarHBondContact O-N 3.08Å; C231-K235 PolarHBondContact N-O 3.3Å; C231-C237 HydrophobicContact CB-CB 4.43Å; C231-C237 WeakPolarHBondContact CB-SG 3.41Å; C231-C237 WeakPolarHBondContact SG-CB 3.43Å; C231-C237 CovalentContact SG-SG 2.06Å; C231-C237 PolarHBondContact SG-SG 3.42Å
232	D	92.6	Very high	97.5	Very high	116 Å²	116	26.7 Å²	26.7	62%	0.62	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-25.3	-179.8	-68.9	-45	0	0	0	113.7	F200 G234	F200-D232 PolarHBondContact N-OD2 3.4Å; F200-D232 VanDerWaalsContact N-OD2 3.12Å; D232-G234 PolarHBondContact O-N 2.92Å
233	D	92.1	Very high	97.4	Very high	93 Å²	93	31.7 Å²	31.7	50%	0.497	17%	0.166	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.4	5.8	174.6	76.6	-18.7	0	0	0	113.7	C231 K235	C231-D233 WeakPolarHBondContact CB-OD1 3.31Å; C231-D233 PolarHBondContact O-N 2.94Å; C231-D233 VanDerWaalsContact O-N 3.15Å; D233-K235 PolarHBondContact O-N 3.49Å; D233-K235 WeakPolarHBondContact OD1-CB 3.38Å; D233-K235 PolarHBondContact OD1-N 2.92Å; D233-K235 VanDerWaalsContact OD2-CD 3.32Å; D233-K235 WeakPolarHBondContact OD2-CD 3.43Å; D233-K235 WeakPolarHBondContact OD2-CE 3.34Å; D233-K235 WeakPolarHBondContact OD2-CG 3.14Å; D233-K235 IonicContact OD2-NZ 3.1Å; D233-K235 PolarHBondContact OD2-NZ 3.4Å
234	G	92.8	Very high	97.3	Very high	47 Å²	47	32.4 Å²	32.4	49%	0.485	19%	0.187	S	C	.	.	S	Bend	trans	78.3	-4.6	-179.2	0	0	0	0	0	114.4	C231 D232	C231-G234 WeakPolarHBondContact O-CA 3.5Å; C231-G234 PolarHBondContact O-N 3.08Å; D232-G234 PolarHBondContact O-N 2.92Å
235	K	95.3	Very high	97.3	Very high	105 Å²	105	34.1 Å²	34.1	46%	0.457	20%	0.195	S	C	.	.			trans	-83	149.4	179.7	-58.8	-172.5	-163.5	116.5	0	111	K230 C231 D233 S284	K230-K235 CarbonylContact C-O 3.49Å; K230-K235 WeakPolarHBondContact CA-O 3.49Å; C231-K235 PolarHBondContact N-O 3.3Å; D233-K235 PolarHBondContact O-N 3.49Å; D233-K235 WeakPolarHBondContact OD1-CB 3.38Å; D233-K235 PolarHBondContact OD1-N 2.92Å; D233-K235 VanDerWaalsContact OD2-CD 3.32Å; D233-K235 WeakPolarHBondContact OD2-CD 3.43Å; D233-K235 WeakPolarHBondContact OD2-CE 3.34Å; D233-K235 WeakPolarHBondContact OD2-CG 3.14Å; D233-K235 IonicContact OD2-NZ 3.1Å; D233-K235 PolarHBondContact OD2-NZ 3.4Å; K235-S284 WeakPolarHBondContact CB-OG 3.27Å; K235-S284 WeakPolarHBondContact CD-OG 3.29Å
236	V	97.7	Very high	97.3	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.042	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	127.3	173.3	179.7	0	0	0	0	109.2	M194 W228 A229 K230 G285 L286	M194-V236 HydrophobicContact CE-CB 4.38Å; M194-V236 HydrophobicContact CE-CG1 3.68Å; M194-V236 HydrophobicContact CE-CG2 3.71Å; M194-V236 HydrophobicContact SD-CG1 4.05Å; M194-V236 HydrophobicContact SD-CG2 4.01Å; W228-V236 HydrophobicContact CB-CG1 3.91Å; W228-V236 HydrophobicContact CE3-CG1 4.02Å; A229-V236 CarbonylContact O-C 3.52Å; A229-V236 WeakPolarHBondContact O-CA 3.41Å; K230-V236 HydrophobicContact CG-CG2 4.26Å; V236-G285 PolarHBondContact O-N 3.41Å; V236-L286 HydrophobicContact CG2-CD2 4.1Å
237	C	97.9	Very high	97.3	Very high	15 Å²	15	44.5 Å²	44.5	10%	0.101	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	152.3	179.9	-59.6	0	0	0	0	109.5	W228 A229 C231 F239 L279	W228-C237 VanDerWaalsContact CA-O 3.31Å; W228-C237 WeakPolarHBondContact CA-O 3.46Å; A229-C237 PolarHBondContact N-O 3.18Å; A229-C237 PolarHBondContact O-N 3.23Å; C231-C237 HydrophobicContact CB-CB 4.43Å; C231-C237 WeakPolarHBondContact CB-SG 3.41Å; C231-C237 WeakPolarHBondContact SG-CB 3.43Å; C231-C237 CovalentContact SG-SG 2.06Å; C231-C237 PolarHBondContact SG-SG 3.42Å; C237-F239 HydrophobicContact CB-CD2 4.46Å; C237-F239 HydrophobicContact CB-CE2 3.55Å; C237-F239 HydrophobicContact CB-CZ 3.8Å; C237-L279 HydrophobicContact CB-CD1 4.01Å
238	G	98.5	Very high	97.2	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	135.9	177.5	0	0	0	0	0	111.8	V227 L280	V227-G238 CarbonylContact O-C 3.59Å; V227-G238 WeakPolarHBondContact O-CA 3.42Å; G238-L280 PolarHBondContact O-N 2.89Å
239	F	98.8	Very high	97.2	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	144.3	-177	-60.1	-90.3	0	0	0	111	A198 F207 L209 V226 V227 A229 C237 L241 V274 N278 L279	A198-F239 HydrophobicContact CB-CE1 4.33Å; A198-F239 HydrophobicContact CB-CE2 3.57Å; A198-F239 HydrophobicContact CB-CZ 3.43Å; A198-F239 VanDerWaalsContact CB-CZ 3.43Å; F207-F239 HydrophobicContact CB-CE1 3.97Å; F207-F239 AromaticContact CD1-CE1 3.88Å; F207-F239 HydrophobicContact CD1-CE1 3.88Å; F207-F239 AromaticContact CD1-CZ 3.98Å; F207-F239 HydrophobicContact CD1-CZ 3.98Å; F207-F239 AromaticContact CD2-CE1 3.77Å; F207-F239 HydrophobicContact CD2-CE1 3.77Å; F207-F239 HydrophobicContact CE1-CE1 4.29Å; F207-F239 HydrophobicContact CE1-CZ 4.3Å; F207-F239 HydrophobicContact CE2-CE1 4.2Å; F207-F239 AromaticContact CG-CE1 3.6Å; F207-F239 HydrophobicContact CG-CE1 3.6Å; F207-F239 HydrophobicContact CG-CZ 4.16Å; F207-F239 HydrophobicContact CZ-CE1 4.44Å; L209-F239 HydrophobicContact CD1-CD1 4.34Å; L209-F239 HydrophobicContact CD1-CE1 4.38Å; L209-F239 HydrophobicContact CD1-CG 4.44Å; L209-F239 HydrophobicContact CD2-CB 4.2Å; L209-F239 HydrophobicContact CD2-CD2 4.03Å; L209-F239 HydrophobicContact CD2-CG 4.09Å; V226-F239 CarbonylContact C-O 3.51Å; V226-F239 WeakPolarHBondContact CA-O 3.42Å; V227-F239 PolarHBondContact N-O 3.11Å; V227-F239 PolarHBondContact O-N 3.49Å; A229-F239 HydrophobicContact CB-CD2 4.36Å; A229-F239 HydrophobicContact CB-CE2 4.12Å; C237-F239 HydrophobicContact CB-CD2 4.46Å; C237-F239 HydrophobicContact CB-CE2 3.55Å; C237-F239 HydrophobicContact CB-CZ 3.8Å; F239-L241 HydrophobicContact CB-CD1 3.62Å; F239-V274 HydrophobicContact CD1-CG1 4.32Å; F239-N278 WeakPolarHBondContact CA-O 3.49Å; F239-L279 HydrophobicContact CD1-CB 4.41Å; F239-L279 HydrophobicContact CD1-CD1 3.99Å; F239-L279 HydrophobicContact CE1-CB 4.35Å; F239-L279 HydrophobicContact CE1-CD1 3.5Å; F239-L279 HydrophobicContact CE2-CD1 4.42Å; F239-L279 HydrophobicContact CZ-CD1 3.74Å
240	I	98.9	Very high	97.2	Very high	0 Å²	0	50 Å²	50	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	114.7	171.2	-53.1	174.4	0	0	0	108.5	I155 Q163 W167 I224 A225 N278 L280	I155-I240 HydrophobicContact CD1-CD1 4.2Å; I155-I240 HydrophobicContact CG1-CD1 3.94Å; Q163-I240 HydrophobicContact CG-CD1 4.4Å; W167-I240 HydrophobicContact CZ2-CG2 4.18Å; I224-I240 HydrophobicContact CB-CG2 4.48Å; I224-I240 HydrophobicContact CD1-CG2 4.44Å; A225-I240 WeakPolarHBondContact O-CA 3.3Å; I240-N278 HydrophobicContact CB-CB 4.48Å; I240-N278 PolarHBondContact N-O 3.07Å; I240-N278 WeakPolarHBondContact O-CB 3.31Å; I240-N278 PolarHBondContact O-ND2 2.96Å; I240-L280 HydrophobicContact CD1-CD2 4.06Å; I240-L280 HydrophobicContact CG1-CD2 4.21Å
241	L	98.8	Very high	97.2	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	146.6	175.5	-73.7	69.5	0	0	0	109.3	L209 I224 A225 V227 F239 M245 F248 M269 V272 V274	L209-L241 HydrophobicContact CD2-CD1 3.95Å; L209-L241 HydrophobicContact CD2-CD2 4.24Å; I224-L241 CarbonylContact C-O 3.58Å; I224-L241 VanDerWaalsContact CA-O 3.23Å; I224-L241 WeakPolarHBondContact CA-O 3.48Å; A225-L241 HydrophobicContact CB-CB 4.43Å; A225-L241 PolarHBondContact N-O 3.16Å; A225-L241 PolarHBondContact O-N 3.28Å; V227-L241 HydrophobicContact CB-CD1 4.01Å; V227-L241 HydrophobicContact CG2-CD1 4.03Å; V227-L241 HydrophobicContact CG2-CD2 4.35Å; F239-L241 HydrophobicContact CB-CD1 3.62Å; L241-M245 HydrophobicContact CB-SD 4.17Å; L241-M245 HydrophobicContact CG-SD 4.37Å; L241-F248 HydrophobicContact CB-CD2 4.39Å; L241-F248 HydrophobicContact CB-CE2 4.04Å; L241-F248 HydrophobicContact CB-CZ 4.45Å; L241-F248 HydrophobicContact CD2-CD2 3.63Å; L241-F248 HydrophobicContact CD2-CE2 3.72Å; L241-M269 HydrophobicContact CD2-CG 4.09Å; L241-M269 HydrophobicContact CD2-SD 3.87Å; L241-V272 HydrophobicContact CD2-CG1 4.16Å; L241-V274 HydrophobicContact CD1-CG2 4.16Å; L241-V274 HydrophobicContact CD2-CG2 4.33Å; L241-V274 HydrophobicContact CG-CG2 3.88Å
242	E	98.5	Very high	97.4	Very high	61 Å²	61	54.4 Å²	54.4	29%	0.285	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	140.9	178.8	-57.1	-171.1	-146.2	0	0	109.9	K166 W167 I224 G244 M245	K166-E242 IonicContact NZ-OE1 2.81Å; K166-E242 PolarHBondContact NZ-OE1 3.45Å; W167-E242 HydrophobicContact CH2-CG 3.79Å; W167-E242 WeakPolarHBondContact CH2-OE1 3.28Å; W167-E242 HydrophobicContact CZ2-CG 4.04Å; W167-E242 VanDerWaalsContact CZ2-OE1 3.3Å; W167-E242 WeakPolarHBondContact CZ2-OE1 3.49Å; I224-E242 HydrophobicContact CG2-CG 4.36Å; E242-G244 PolarHBondContact O-N 2.83Å; E242-M245 HydrophobicContact CB-CE 4.11Å; E242-M245 HydrophobicContact CB-SD 4.49Å; E242-M245 HydrophobicContact CG-CE 4.19Å; E242-M245 PolarHBondContact N-SD 3.4Å; E242-M245 VanDerWaalsContact N-SD 3.41Å; E242-M245 VanDerWaalsContact O-CG 3.32Å; E242-M245 WeakPolarHBondContact O-CG 3.42Å; E242-M245 PolarHBondContact O-N 3.41Å
243	R	97.5	Very high	97.6	Very high	109 Å²	109	50.1 Å²	50.1	41%	0.411	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	134.3	171.9	179.2	177.9	-65.2	-100.6	-13.9	109.5	S219 P220 A222 D223 T250	S219-R243 PolarHBondContact O-NH2 3.19Å; P220-R243 PolarHBondContact O-NH1 3.21Å; P220-R243 PolarHBondContact O-NH2 2.85Å; A222-R243 VanDerWaalsContact O-CZ 3.29Å; A222-R243 PolarHBondContact O-NE 2.91Å; A222-R243 PolarHBondContact O-NH2 2.85Å; D223-R243 PolarHBondContact O-N 3.3Å; R243-T250 PolarHBondContact NH1-OG1 3.44Å; R243-T250 PolarHBondContact NH2-OG1 3.49Å; R243-T250 VanDerWaalsContact NH2-OG1 3.07Å
244	G	97.2	Very high	97.9	Very high	72 Å²	72	51.5 Å²	51.5	74%	0.742	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	100.9	-9.1	-178.6	0	0	0	0	0	114.1	E242	E242-G244 PolarHBondContact O-N 2.83Å
245	M	98.6	Very high	98.2	Very high	40 Å²	40	52 Å²	52	20%	0.197	29%	0.287	C	S	.	.			trans	-57	138.1	166.5	-72.9	177.8	167.7	0	0	110.7	L241 E242 G247 F248 V272	L241-M245 HydrophobicContact CB-SD 4.17Å; L241-M245 HydrophobicContact CG-SD 4.37Å; E242-M245 HydrophobicContact CB-CE 4.11Å; E242-M245 HydrophobicContact CB-SD 4.49Å; E242-M245 HydrophobicContact CG-CE 4.19Å; E242-M245 PolarHBondContact N-SD 3.4Å; E242-M245 VanDerWaalsContact N-SD 3.41Å; E242-M245 VanDerWaalsContact O-CG 3.32Å; E242-M245 WeakPolarHBondContact O-CG 3.42Å; E242-M245 PolarHBondContact O-N 3.41Å; M245-G247 PolarHBondContact O-N 3.13Å; M245-F248 HydrophobicContact CB-CB 4.09Å; M245-F248 WeakPolarHBondContact O-CB 3.31Å; M245-F248 PolarHBondContact O-N 3.33Å; M245-V272 HydrophobicContact CB-CG1 4.07Å; M245-V272 HydrophobicContact SD-CG1 4.3Å
246	K	98.6	Very high	98.4	Very high	194 Å²	194	47.9 Å²	47.9	84%	0.843	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	136.2	177.9	-174.4	-176.3	175.5	-168.6	0	109.6	F248	K246-F248 PolarHBondContact O-N 3.5Å
247	G	98.3	Very high	98.4	Very high	25 Å²	25	54.7 Å²	54.7	26%	0.258	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.4	-3.1	-178.6	0	0	0	0	0	114.9	M245 D270 V272	M245-G247 PolarHBondContact O-N 3.13Å; G247-D270 WeakPolarHBondContact CA-O 3.37Å; G247-D270 PolarHBondContact O-N 2.94Å; G247-V272 VanDerWaalsContact C-CG2 3.43Å; G247-V272 WeakPolarHBondContact O-CG2 3.45Å
248	F	98.6	Very high	98.4	Very high	19 Å²	19	55 Å²	55	8%	0.083	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	114.7	-179.4	-177.9	-101.3	0	0	0	111.5	A225 L241 M245 K246 T250 I267 M269 V272	A225-F248 HydrophobicContact CB-CE2 4.28Å; A225-F248 HydrophobicContact CB-CZ 3.84Å; L241-F248 HydrophobicContact CB-CD2 4.39Å; L241-F248 HydrophobicContact CB-CE2 4.04Å; L241-F248 HydrophobicContact CB-CZ 4.45Å; L241-F248 HydrophobicContact CD2-CD2 3.63Å; L241-F248 HydrophobicContact CD2-CE2 3.72Å; M245-F248 HydrophobicContact CB-CB 4.09Å; M245-F248 WeakPolarHBondContact O-CB 3.31Å; M245-F248 PolarHBondContact O-N 3.33Å; K246-F248 PolarHBondContact O-N 3.5Å; F248-T250 HydrophobicContact CE1-CG2 3.81Å; F248-T250 HydrophobicContact CZ-CG2 3.87Å; F248-I267 HydrophobicContact CD2-CG2 4.04Å; F248-I267 HydrophobicContact CE2-CG2 3.32Å; F248-I267 HydrophobicContact CZ-CG2 4Å; F248-M269 HydrophobicContact CD2-CG 4.09Å; F248-V272 HydrophobicContact CB-CG1 4.38Å; F248-V272 HydrophobicContact CB-CG2 4.02Å
249	T	98.6	Very high	98.4	Very high	75 Å²	75	55.5 Å²	55.5	46%	0.46	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	152.7	178.1	66	0	0	0	0	112.5	I268	T249-I268 PolarHBondContact N-O 3.22Å; T249-I268 PolarHBondContact O-N 3.26Å; T249-I268 WeakPolarHBondContact OG1-CB 3.11Å
250	T	98.6	Very high	98.4	Very high	20 Å²	20	57.3 Å²	57.3	12%	0.123	31%	0.311	C	S	.	.			trans	-135	67.1	-173.3	49.5	0	0	0	0	112.5	S219 P220 R243 F248 M266 I267	S219-T250 WeakPolarHBondContact O-CB 3.05Å; S219-T250 WeakPolarHBondContact O-CG2 3.39Å; S219-T250 PolarHBondContact O-OG1 3.42Å; P220-T250 WeakPolarHBondContact CA-O 3.19Å; R243-T250 PolarHBondContact NH1-OG1 3.44Å; R243-T250 PolarHBondContact NH2-OG1 3.49Å; R243-T250 VanDerWaalsContact NH2-OG1 3.07Å; F248-T250 HydrophobicContact CE1-CG2 3.81Å; F248-T250 HydrophobicContact CZ-CG2 3.87Å; T250-M266 VanDerWaalsContact CA-O 3.3Å; T250-M266 WeakPolarHBondContact CA-O 3.28Å; T250-I267 HydrophobicContact CG2-CG1 4.29Å
251	P	98.4	Very high	98.4	Very high	53 Å²	53	57.3 Å²	57.3	34%	0.344	31%	0.311	S	S	.	.	P	Polyproline II helix	trans	-66.4	144.4	-178	28.6	-33.8	0	0	0	111.6	G265 M266 I268	P251-G265 CarbonylContact O-C 3.48Å; P251-G265 WeakPolarHBondContact O-CA 3.39Å; P251-M266 HydrophobicContact CG-CB 3.98Å; P251-M266 HydrophobicContact CG-CG 4.48Å; P251-M266 HydrophobicContact CG-SD 4.45Å; P251-M266 PolarHBondContact O-N 3.25Å; P251-I268 HydrophobicContact CG-CD1 3.79Å; P251-I268 HydrophobicContact CG-CG1 4.45Å
252	K	98.5	Very high	98.4	Very high	91 Å²	91	57.6 Å²	57.6	40%	0.396	31%	0.313	S	S	.	.	B	Isolated β-bridge	trans	-73.5	143.6	175.7	179.9	176.5	169.8	-129.3	0	110.7	P220 E254	P220-K252 HydrophobicContact CB-CB 4.26Å; P220-K252 HydrophobicContact CG-CB 4.01Å; P220-K252 HydrophobicContact CG-CG 4.41Å; K252-E254 VanDerWaalsContact CD-OE1 3.24Å; K252-E254 WeakPolarHBondContact CD-OE1 3.48Å; K252-E254 WeakPolarHBondContact CE-OE1 3.29Å; K252-E254 IonicContact NZ-OE1 3.3Å; K252-E254 PolarHBondContact NZ-OE1 2.94Å; K252-E254 IonicContact NZ-OE2 3.46Å; K252-E254 PolarHBondContact NZ-OE2 3.33Å
253	I	98.6	Very high	98.4	Very high	27 Å²	27	55.1 Å²	55.1	14%	0.138	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-89.8	125	167.6	-69.1	169.1	0	0	0	108.4	W215 K256 T264 M266	W215-I253 HydrophobicContact CD2-CD1 4.01Å; W215-I253 HydrophobicContact CE3-CD1 3.85Å; W215-I253 HydrophobicContact CE3-CG2 4.49Å; W215-I253 HydrophobicContact CG-CD1 4.49Å; W215-I253 HydrophobicContact CH2-CG2 3.93Å; W215-I253 HydrophobicContact CZ3-CD1 4.2Å; W215-I253 HydrophobicContact CZ3-CG2 3.79Å; I253-K256 HydrophobicContact CG2-CG 4.39Å; I253-T264 PolarHBondContact N-O 3.31Å; I253-M266 HydrophobicContact CD1-CG 4.26Å; I253-M266 HydrophobicContact CG1-CG 4.25Å
254	E	98.4	Very high	98.5	Very high	121 Å²	121	50.4 Å²	50.4	57%	0.565	29%	0.286	S	S	*	.	P	Polyproline II helix	trans	-96.8	166.3	176.3	-61.6	-60.6	159	0	0	111.8	K252	K252-E254 VanDerWaalsContact CD-OE1 3.24Å; K252-E254 WeakPolarHBondContact CD-OE1 3.48Å; K252-E254 WeakPolarHBondContact CE-OE1 3.29Å; K252-E254 IonicContact NZ-OE1 3.3Å; K252-E254 PolarHBondContact NZ-OE1 2.94Å; K252-E254 IonicContact NZ-OE2 3.46Å; K252-E254 PolarHBondContact NZ-OE2 3.33Å
255	G	98.1	Very high	98.5	Very high	57 Å²	57	47 Å²	47	59%	0.588	25%	0.251	S	S	*	.			trans	78.7	17.5	172.7	0	0	0	0	0	114.7	F257	G255-F257 PolarHBondContact O-N 2.97Å
256	K	98.7	Very high	98.5	Very high	19 Å²	19	47.4 Å²	47.4	8%	0.083	25%	0.253	C	S	.	.			trans	-70.1	127.2	176.7	-76.9	169.8	53.5	-163.6	0	110.7	W215 I253 S258 L259 R260 S262 T264	W215-K256 HydrophobicContact CZ3-CG 4.19Å; I253-K256 HydrophobicContact CG2-CG 4.39Å; K256-S258 WeakPolarHBondContact CE-O 3.43Å; K256-L259 PolarHBondContact NZ-O 3.21Å; K256-R260 VanDerWaalsContact O-CG 3.22Å; K256-R260 WeakPolarHBondContact O-CG 3.38Å; K256-R260 PolarHBondContact O-NH1 3.16Å; K256-S262 PolarHBondContact NZ-O 3.4Å; K256-T264 PolarHBondContact NZ-OG1 3.32Å
257	F	98.6	Very high	98.5	Very high	150 Å²	150	38.2 Å²	38.2	66%	0.658	21%	0.213	S	C	*	.	S	Bend	trans	-96.4	0.8	167.6	-83.5	-75.4	0	0	0	113.2	G255 M408	G255-F257 PolarHBondContact O-N 2.97Å; F257-M408 HydrophobicContact CB-CE 3.59Å; F257-M408 HydrophobicContact CD1-CE 3.49Å; F257-M408 VanDerWaalsContact CD1-CE 3.49Å; F257-M408 HydrophobicContact CG-CE 3.98Å; F257-M408 WeakPolarHBondContact O-CB 3.49Å; F257-M408 WeakPolarHBondContact O-CE 3.49Å
258	S	98.8	Very high	98.6	Very high	22 Å²	22	39.9 Å²	39.9	15%	0.154	22%	0.215	C	C	.	.	S	Bend	trans	-133.6	144.7	-179.8	-172.5	0	0	0	0	110.4	K256 R260 M408 N409 A412	K256-S258 WeakPolarHBondContact CE-O 3.43Å; S258-R260 VanDerWaalsContact C-N 3.28Å; S258-R260 PolarHBondContact O-N 3.38Å; S258-M408 WeakPolarHBondContact CB-O 3.08Å; S258-M408 PolarHBondContact OG-O 3.4Å; S258-N409 VanDerWaalsContact OG-CA 3.3Å; S258-N409 WeakPolarHBondContact OG-CA 3.23Å; S258-N409 PolarHBondContact OG-O 3.37Å; S258-A412 WeakPolarHBondContact OG-CB 3.2Å
259	L	98.7	Very high	98.6	Very high	10 Å²	10	39.2 Å²	39.2	5%	0.052	21%	0.212	C	C	.	.	S	Bend	trans	55.3	42.4	-178.8	-49.2	176.9	0	0	0	112.2	S138 K256 A261 S262 N409 A412 V413 Y416	S138-L259 VanDerWaalsContact CB-CD2 3.47Å; K256-L259 PolarHBondContact NZ-O 3.21Å; L259-A261 VanDerWaalsContact C-N 3.29Å; L259-A261 PolarHBondContact O-N 3.46Å; L259-S262 WeakPolarHBondContact O-CB 3.24Å; L259-S262 PolarHBondContact O-N 2.92Å; L259-N409 VanDerWaalsContact CA-OD1 3.31Å; L259-N409 WeakPolarHBondContact CA-OD1 3.26Å; L259-N409 HydrophobicContact CD2-CB 3.96Å; L259-N409 PolarHBondContact N-OD1 3.32Å; L259-A412 HydrophobicContact CD1-CB 3.83Å; L259-A412 HydrophobicContact CG-CB 3.97Å; L259-V413 HydrophobicContact CD2-CG2 4.28Å; L259-Y416 HydrophobicContact CD1-CD1 4.24Å; L259-Y416 HydrophobicContact CD1-CE1 3.79Å
260	R	98.8	Very high	98.6	Very high	39 Å²	39	40.9 Å²	40.9	15%	0.147	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-31	-172.8	-69.2	171.2	62.5	78.4	0.9	112.8	N90 R91 E93 K256 S258 S262	N90-R260 VanDerWaalsContact O-CB 3.23Å; N90-R260 WeakPolarHBondContact O-CB 3.23Å; N90-R260 PolarHBondContact O-NE 3.3Å; R91-R260 PolarHBondContact O-NH2 3.43Å; E93-R260 VanDerWaalsContact CA-O 3.3Å; E93-R260 WeakPolarHBondContact CA-O 3.34Å; E93-R260 HydrophobicContact CG-CB 3.76Å; E93-R260 HydrophobicContact CG-CG 3.97Å; E93-R260 VanDerWaalsContact CG-CZ 3.4Å; E93-R260 IonicContact OE1-CZ 3.63Å; E93-R260 IonicContact OE1-NH1 2.82Å; E93-R260 PolarHBondContact OE1-NH1 2.85Å; E93-R260 IonicContact OE1-NH2 3.76Å; E93-R260 PolarHBondContact OE1-NH2 2.06Å; E93-R260 IonicContact OE2-NH1 3.35Å; K256-R260 VanDerWaalsContact O-CG 3.22Å; K256-R260 WeakPolarHBondContact O-CG 3.38Å; K256-R260 PolarHBondContact O-NH1 3.16Å; S258-R260 VanDerWaalsContact C-N 3.28Å; S258-R260 PolarHBondContact O-N 3.38Å; R260-S262 PolarHBondContact O-N 2.9Å
261	A	98.6	Very high	98.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	2.3	174.8	0	0	0	0	0	114.2	I86 A89 Y140 L259	I86-A261 HydrophobicContact CD1-CB 3.55Å; A89-A261 HydrophobicContact CB-CB 4.1Å; Y140-A261 HydrophobicContact CE1-CB 3.97Å; L259-A261 VanDerWaalsContact C-N 3.29Å; L259-A261 PolarHBondContact O-N 3.46Å
262	S	98.2	Very high	98.6	Very high	5 Å²	5	43.9 Å²	43.9	4%	0.035	23%	0.226	C	C	.	.	S	Bend	trans	-112.6	135.9	176.3	176.3	0	0	0	0	110.9	T217 K256 L259 R260	T217-S262 WeakPolarHBondContact CG2-OG 3.49Å; K256-S262 PolarHBondContact NZ-O 3.4Å; L259-S262 WeakPolarHBondContact O-CB 3.24Å; L259-S262 PolarHBondContact O-N 2.92Å; R260-S262 PolarHBondContact O-N 2.9Å
263	A	98.2	Very high	98.6	Very high	10 Å²	10	43.8 Å²	43.8	8%	0.083	23%	0.227	C	C	.	.			trans	-73.6	126.8	173	0	0	0	0	0	109.8	F95 T217 N218 V221	F95-A263 HydrophobicContact CB-CB 4.1Å; F95-A263 HydrophobicContact CD1-CB 4.14Å; F95-A263 HydrophobicContact CG-CB 4.25Å; T217-A263 CarbonylContact C-O 3.49Å; T217-A263 WeakPolarHBondContact CA-O 3.29Å; N218-A263 PolarHBondContact N-O 2.94Å; V221-A263 HydrophobicContact CG2-CB 3.76Å
264	T	98.8	Very high	98.6	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.055	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	138.5	178	-50.3	0	0	0	0	109.1	W215 I253 K256	W215-T264 HydrophobicContact CE3-CG2 4.16Å; I253-T264 PolarHBondContact N-O 3.31Å; K256-T264 PolarHBondContact NZ-OG1 3.32Å
265	G	98.6	Very high	98.6	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.4	-158.8	-177.3	0	0	0	0	0	113.1	W215 I216 S219 P251	W215-G265 PolarHBondContact N-O 3.23Å; I216-G265 PolarHBondContact N-O 3.45Å; I216-G265 PolarHBondContact O-N 3.26Å; S219-G265 VanDerWaalsContact OG-C 3.25Å; S219-G265 WeakPolarHBondContact OG-CA 3.3Å; P251-G265 CarbonylContact O-C 3.48Å; P251-G265 WeakPolarHBondContact O-CA 3.39Å
266	M	98.8	Very high	98.6	Very high	50 Å²	50	38.8 Å²	38.8	25%	0.246	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	169.7	172.6	-57	178.8	70	0	0	110	K213 S219 T250 P251 I253 I268	K213-M266 CarbonylContact O-C 3.43Å; K213-M266 WeakPolarHBondContact O-CA 3.49Å; K213-M266 VanDerWaalsContact O-CB 3.24Å; K213-M266 WeakPolarHBondContact O-CB 3.26Å; S219-M266 WeakPolarHBondContact CB-O 3.34Å; S219-M266 PolarHBondContact OG-N 2.7Å; S219-M266 PolarHBondContact OG-O 2.94Å; T250-M266 VanDerWaalsContact CA-O 3.3Å; T250-M266 WeakPolarHBondContact CA-O 3.28Å; P251-M266 HydrophobicContact CG-CB 3.98Å; P251-M266 HydrophobicContact CG-CG 4.48Å; P251-M266 HydrophobicContact CG-SD 4.45Å; P251-M266 PolarHBondContact O-N 3.25Å; I253-M266 HydrophobicContact CD1-CG 4.26Å; I253-M266 HydrophobicContact CG1-CG 4.25Å; M266-I268 HydrophobicContact CB-CG1 4.47Å
267	I	98.8	Very high	98.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	119.3	161	-61.7	168.8	0	0	0	105.7	S212 K213 I216 A225 V227 F248 T250 M269	S212-I267 CarbonylContact C-O 3.53Å; S212-I267 WeakPolarHBondContact CA-O 3.43Å; K213-I267 HydrophobicContact CB-CB 4.03Å; K213-I267 HydrophobicContact CG-CB 4.31Å; K213-I267 PolarHBondContact N-O 3.05Å; K213-I267 PolarHBondContact O-N 2.88Å; I216-I267 HydrophobicContact CB-CD1 4.47Å; I216-I267 HydrophobicContact CB-CG1 4.48Å; I216-I267 HydrophobicContact CG1-CD1 4.24Å; I216-I267 HydrophobicContact CG1-CG1 4.28Å; I216-I267 HydrophobicContact CG2-CD1 3.93Å; I216-I267 HydrophobicContact CG2-CG1 4.36Å; A225-I267 HydrophobicContact CB-CD1 4.03Å; V227-I267 HydrophobicContact CG2-CD1 4.2Å; F248-I267 HydrophobicContact CD2-CG2 4.04Å; F248-I267 HydrophobicContact CE2-CG2 3.32Å; F248-I267 HydrophobicContact CZ-CG2 4Å; T250-I267 HydrophobicContact CG2-CG1 4.29Å; I267-M269 HydrophobicContact CG2-CE 4.33Å; I267-M269 HydrophobicContact CG2-CG 4.05Å; I267-M269 HydrophobicContact CG2-SD 4.24Å
268	I	98.8	Very high	98.5	Very high	61 Å²	61	37.2 Å²	37.2	31%	0.313	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	127.5	176.1	-56.4	172.3	0	0	0	107.1	T249 P251 M266	T249-I268 PolarHBondContact N-O 3.22Å; T249-I268 PolarHBondContact O-N 3.26Å; T249-I268 WeakPolarHBondContact OG1-CB 3.11Å; P251-I268 HydrophobicContact CG-CD1 3.79Å; P251-I268 HydrophobicContact CG-CG1 4.45Å; M266-I268 HydrophobicContact CB-CG1 4.47Å
269	M	98.8	Very high	98.5	Very high	4 Å²	4	37.9 Å²	37.9	2%	0.02	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	108.1	179.5	-64.7	161	-67.7	0	0	107.9	T196 L209 T210 G211 K213 V227 L241 F248 I267 V272	T196-M269 HydrophobicContact CG2-CE 3.53Å; L209-M269 HydrophobicContact CB-SD 4.28Å; L209-M269 HydrophobicContact CD2-SD 4.09Å; T210-M269 WeakPolarHBondContact CA-O 3Å; G211-M269 PolarHBondContact N-O 3.06Å; G211-M269 PolarHBondContact O-N 3.31Å; K213-M269 HydrophobicContact CG-CE 4.21Å; V227-M269 HydrophobicContact CB-SD 4.49Å; V227-M269 HydrophobicContact CG1-CE 3.93Å; V227-M269 HydrophobicContact CG1-SD 3.75Å; V227-M269 HydrophobicContact CG2-SD 4.3Å; L241-M269 HydrophobicContact CD2-CG 4.09Å; L241-M269 HydrophobicContact CD2-SD 3.87Å; F248-M269 HydrophobicContact CD2-CG 4.09Å; I267-M269 HydrophobicContact CG2-CE 4.33Å; I267-M269 HydrophobicContact CG2-CG 4.05Å; I267-M269 HydrophobicContact CG2-SD 4.24Å; M269-V272 HydrophobicContact CB-CB 4.5Å; M269-V272 HydrophobicContact CB-CG2 3.76Å; M269-V272 HydrophobicContact CG-CG2 4.07Å
270	D	98.6	Very high	98.5	Very high	110 Å²	110	37.4 Å²	37.4	59%	0.588	19%	0.186	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	95.9	173.8	-175.4	25.9	0	0	0	108.7	G247 V272	G247-D270 WeakPolarHBondContact CA-O 3.37Å; G247-D270 PolarHBondContact O-N 2.94Å; D270-V272 VanDerWaalsContact C-N 3.32Å; D270-V272 PolarHBondContact O-N 3.27Å
271	E	98.4	Very high	98.4	Very high	136 Å²	136	39 Å²	39	64%	0.636	20%	0.201	S	C	*	.	E	Extended strand (participates in β ladder)	trans	48.6	50	-178.6	-60.2	-174.6	175.8	0	0	113.3	T208 L209 T210 E273	T208-E271 HydrophobicContact CG2-CB 3.83Å; T208-E271 HydrophobicContact CG2-CG 4.32Å; L209-E271 WeakPolarHBondContact O-CA 3.09Å; L209-E271 PolarHBondContact O-N 2.67Å; T210-E271 PolarHBondContact OG1-N 3.18Å; E271-E273 PolarHBondContact O-N 3.03Å
272	V	98.8	Very high	98.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.7	116.7	-178.7	-177.1	0	0	0	0	109.7	T208 L209 L241 M245 G247 F248 M269 D270 V274	T208-V272 WeakPolarHBondContact CA-O 3.44Å; L209-V272 HydrophobicContact CB-CB 4.44Å; L209-V272 PolarHBondContact N-O 3.17Å; L209-V272 PolarHBondContact O-N 3.4Å; L241-V272 HydrophobicContact CD2-CG1 4.16Å; M245-V272 HydrophobicContact CB-CG1 4.07Å; M245-V272 HydrophobicContact SD-CG1 4.3Å; G247-V272 VanDerWaalsContact C-CG2 3.43Å; G247-V272 WeakPolarHBondContact O-CG2 3.45Å; F248-V272 HydrophobicContact CB-CG1 4.38Å; F248-V272 HydrophobicContact CB-CG2 4.02Å; M269-V272 HydrophobicContact CB-CB 4.5Å; M269-V272 HydrophobicContact CB-CG2 3.76Å; M269-V272 HydrophobicContact CG-CG2 4.07Å; D270-V272 VanDerWaalsContact C-N 3.32Å; D270-V272 PolarHBondContact O-N 3.27Å; V272-V274 HydrophobicContact CG1-CG2 4.04Å; V272-V274 PolarHBondContact O-N 3.46Å
273	E	98.6	Very high	98.3	Very high	89 Å²	89	45.5 Å²	45.5	42%	0.416	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	117.6	173.5	-69.1	-64.2	139.7	0	0	110.9	T206 T208 E271	T206-E273 VanDerWaalsContact CB-OE2 3.26Å; T206-E273 WeakPolarHBondContact CB-OE2 3.29Å; T206-E273 PolarHBondContact OG1-OE2 3.27Å; T208-E273 WeakPolarHBondContact CB-OE1 3.07Å; T208-E273 WeakPolarHBondContact CG2-OE1 3.28Å; T208-E273 PolarHBondContact OG1-OE1 3.28Å; E271-E273 PolarHBondContact O-N 3.03Å
274	V	98.6	Very high	98	Very high	0 Å²	0	48 Å²	48	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	122	-178.9	-178.1	0	0	0	0	109.1	T206 F207 L209 F239 L241 V272 N278	T206-V274 CarbonylContact C-O 3.52Å; T206-V274 WeakPolarHBondContact CA-O 3.41Å; F207-V274 PolarHBondContact N-O 3.38Å; F207-V274 PolarHBondContact O-N 3.48Å; L209-V274 HydrophobicContact CD1-CB 4.15Å; L209-V274 HydrophobicContact CD1-CG2 3.86Å; L209-V274 HydrophobicContact CD2-CG2 4.33Å; F239-V274 HydrophobicContact CD1-CG1 4.32Å; L241-V274 HydrophobicContact CD1-CG2 4.16Å; L241-V274 HydrophobicContact CD2-CG2 4.33Å; L241-V274 HydrophobicContact CG-CG2 3.88Å; V272-V274 HydrophobicContact CG1-CG2 4.04Å; V272-V274 PolarHBondContact O-N 3.46Å; V274-N278 HydrophobicContact CG1-CB 3.64Å
275	P	98.1	Very high	97.8	Very high	37 Å²	37	48.5 Å²	48.5	24%	0.24	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	148.2	177	-24.1	34.5	0	0	0	113.2	E277 N278	P275-E277 HydrophobicContact CB-CG 4.09Å; P275-E277 WeakPolarHBondContact CB-OE1 3.29Å; P275-E277 WeakPolarHBondContact CB-OE2 3.43Å; P275-E277 PolarHBondContact O-N 3.27Å; P275-N278 WeakPolarHBondContact O-CB 3.48Å; P275-N278 PolarHBondContact O-N 3.43Å
276	E	97.9	Very high	97.6	Very high	63 Å²	63	50.9 Å²	50.9	29%	0.294	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-56.3	-34	178.9	-176.7	-179.5	-167.4	0	0	112.2	F200 R205 F207 N278 L279	F200-E276 HydrophobicContact CE2-CG 4.49Å; R205-E276 IonicContact CZ-OE2 3.25Å; R205-E276 VanDerWaalsContact CZ-OE2 3.25Å; R205-E276 IonicContact NE-OE2 2.86Å; R205-E276 PolarHBondContact NE-OE2 2.94Å; R205-E276 IonicContact NH2-OE1 2.86Å; R205-E276 IonicContact NH2-OE2 3.69Å; R205-E276 PolarHBondContact NH2-OE2 3.06Å; R205-E276 VanDerWaalsContact O-CB 3.29Å; R205-E276 WeakPolarHBondContact O-CB 3.49Å; R205-E276 PolarHBondContact O-N 3.01Å; F207-E276 HydrophobicContact CE2-CB 4.49Å; F207-E276 HydrophobicContact CE2-CG 4.33Å; E276-N278 PolarHBondContact O-N 3.35Å; E276-N278 VanDerWaalsContact O-N 3.11Å; E276-L279 VanDerWaalsContact O-CB 3.26Å; E276-L279 WeakPolarHBondContact O-CB 3.48Å; E276-L279 PolarHBondContact O-N 3.43Å
277	E	98	Very high	97.4	Very high	127 Å²	127	51.1 Å²	51.1	59%	0.593	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-65.6	-9.8	176.5	67.3	-91.2	-156.1	0	0	114.6	Q163 P275	Q163-E277 PolarHBondContact NE2-O 3.44Å; P275-E277 HydrophobicContact CB-CG 4.09Å; P275-E277 WeakPolarHBondContact CB-OE1 3.29Å; P275-E277 WeakPolarHBondContact CB-OE2 3.43Å; P275-E277 PolarHBondContact O-N 3.27Å
278	N	98.5	Very high	97.3	Very high	9 Å²	9	51.1 Å²	51.1	5%	0.048	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-95.4	-3.1	174.9	-79.4	22.9	0	0	0	113.1	F239 I240 V274 P275 E276	F239-N278 WeakPolarHBondContact CA-O 3.49Å; I240-N278 HydrophobicContact CB-CB 4.48Å; I240-N278 PolarHBondContact N-O 3.07Å; I240-N278 WeakPolarHBondContact O-CB 3.31Å; I240-N278 PolarHBondContact O-ND2 2.96Å; V274-N278 HydrophobicContact CG1-CB 3.64Å; P275-N278 WeakPolarHBondContact O-CB 3.48Å; P275-N278 PolarHBondContact O-N 3.43Å; E276-N278 PolarHBondContact O-N 3.35Å; E276-N278 VanDerWaalsContact O-N 3.11Å
279	L	98.4	Very high	97.2	Very high	36 Å²	36	48.2 Å²	48.2	19%	0.188	27%	0.267	C	S	.	.	B	Isolated β-bridge	trans	-69.6	140.6	168.9	177.6	70.2	0	0	0	109.9	Q163 F207 C237 F239 E276 P281	Q163-L279 PolarHBondContact NE2-O 2.77Å; F207-L279 HydrophobicContact CE2-CB 4.48Å; F207-L279 HydrophobicContact CE2-CD2 4.25Å; F207-L279 HydrophobicContact CZ-CD2 4.18Å; C237-L279 HydrophobicContact CB-CD1 4.01Å; F239-L279 HydrophobicContact CD1-CB 4.41Å; F239-L279 HydrophobicContact CD1-CD1 3.99Å; F239-L279 HydrophobicContact CE1-CB 4.35Å; F239-L279 HydrophobicContact CE1-CD1 3.5Å; F239-L279 HydrophobicContact CE2-CD1 4.42Å; F239-L279 HydrophobicContact CZ-CD1 3.74Å; E276-L279 VanDerWaalsContact O-CB 3.26Å; E276-L279 WeakPolarHBondContact O-CB 3.48Å; E276-L279 PolarHBondContact O-N 3.43Å; L279-P281 WeakPolarHBondContact O-CD 3.17Å
280	L	98.6	Very high	97	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	28%	0.282	C	S	.	.			trans	-84.6	99.9	169.5	-64.9	177.6	0	0	0	109.4	P154 V226 G238 I240 K282 V283	P154-L280 HydrophobicContact CB-CD1 4.14Å; V226-L280 HydrophobicContact CG1-CD1 4.1Å; G238-L280 PolarHBondContact O-N 2.89Å; I240-L280 HydrophobicContact CD1-CD2 4.06Å; I240-L280 HydrophobicContact CG1-CD2 4.21Å; L280-K282 PolarHBondContact O-N 2.81Å; L280-V283 HydrophobicContact CB-CG1 4.3Å
281	P	97.4	Very high	96.8	Very high	71 Å²	71	47.3 Å²	47.3	46%	0.461	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83	-17.6	-161.8	32.3	-34.9	0	0	0	114.1	Y158 T160 L279 V283	Y158-P281 VanDerWaalsContact O-CD 3.29Å; Y158-P281 WeakPolarHBondContact O-CD 3.47Å; T160-P281 HydrophobicContact CG2-CG 3.56Å; L279-P281 WeakPolarHBondContact O-CD 3.17Å; P281-V283 VanDerWaalsContact C-N 3.25Å; P281-V283 PolarHBondContact O-N 3.02Å
282	K	97.1	Very high	96.8	Very high	115 Å²	115	40.9 Å²	40.9	50%	0.5	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.1	16.3	-173.6	-56.2	170.4	-179.3	161.8	0	112.9	Y158 G159 E161 L280	Y158-K282 WeakPolarHBondContact O-CB 3.23Å; Y158-K282 PolarHBondContact O-N 2.82Å; Y158-K282 VanDerWaalsContact O-N 3.1Å; G159-K282 WeakPolarHBondContact O-CE 3.32Å; G159-K282 PolarHBondContact O-NZ 3.25Å; E161-K282 IonicContact OE1-NZ 2.84Å; L280-K282 PolarHBondContact O-N 2.81Å
283	V	95.9	Very high	96.8	Very high	27 Å²	27	41.6 Å²	41.6	16%	0.164	24%	0.238	C	C	.	.			trans	-148	146.2	-179.1	74.4	0	0	0	0	112.3	Y158 W228 L280 P281	Y158-V283 HydrophobicContact CD1-CB 3.77Å; Y158-V283 HydrophobicContact CD1-CG1 4.32Å; Y158-V283 HydrophobicContact CD1-CG2 4.08Å; Y158-V283 HydrophobicContact CD2-CB 4.21Å; Y158-V283 HydrophobicContact CD2-CG1 3.92Å; Y158-V283 HydrophobicContact CD2-CG2 4.41Å; Y158-V283 HydrophobicContact CE1-CB 4.4Å; Y158-V283 HydrophobicContact CE1-CG2 4.21Å; Y158-V283 HydrophobicContact CG-CB 3.68Å; Y158-V283 HydrophobicContact CG-CG1 3.7Å; Y158-V283 HydrophobicContact CG-CG2 4.21Å; W228-V283 HydrophobicContact CH2-CG1 3.99Å; W228-V283 HydrophobicContact CZ3-CG1 3.95Å; L280-V283 HydrophobicContact CB-CG1 4.3Å; P281-V283 VanDerWaalsContact C-N 3.25Å; P281-V283 PolarHBondContact O-N 3.02Å
284	S	92.1	Very high	96.7	Very high	63 Å²	63	38.8 Å²	38.8	44%	0.441	23%	0.225	S	C	.	.			trans	-149.8	150.9	174.7	-174	0	0	0	0	110.2	K235	K235-S284 WeakPolarHBondContact CB-OG 3.27Å; K235-S284 WeakPolarHBondContact CD-OG 3.29Å
285	G	95.9	Very high	96.6	Very high	19 Å²	19	39.8 Å²	39.8	20%	0.196	23%	0.23	C	C	.	.	S	Bend	trans	73.4	-171.7	-177.7	0	0	0	0	0	113.3	V236 G287 P289	V236-G285 PolarHBondContact O-N 3.41Å; G285-G287 PolarHBondContact O-N 3.05Å; G285-P289 WeakPolarHBondContact O-CD 3.44Å
286	L	94.4	Very high	96.6	Very high	51 Å²	51	38 Å²	38	27%	0.267	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.4	-176.2	-68.7	173.4	0	0	0	114.1	P191 M194 V236 G288 P289 F290	P191-L286 HydrophobicContact CB-CD2 4.26Å; P191-L286 HydrophobicContact CG-CD2 4.31Å; M194-L286 HydrophobicContact CE-CD2 4.43Å; V236-L286 HydrophobicContact CG2-CD2 4.1Å; L286-G288 VanDerWaalsContact C-N 3.26Å; L286-G288 PolarHBondContact O-N 3.07Å; L286-P289 HydrophobicContact CD2-CG 4.43Å; L286-P289 VanDerWaalsContact O-CD 3.29Å; L286-P289 WeakPolarHBondContact O-CD 3.41Å; L286-P289 WeakPolarHBondContact O-CG 3.42Å; L286-F290 HydrophobicContact CB-CD2 4.11Å; L286-F290 HydrophobicContact CB-CE2 3.89Å; L286-F290 HydrophobicContact CB-CZ 4.2Å; L286-F290 HydrophobicContact CD1-CE2 4.26Å; L286-F290 HydrophobicContact CD1-CZ 4.18Å; L286-F290 VanDerWaalsContact O-CB 3.23Å; L286-F290 WeakPolarHBondContact O-CB 3.42Å; L286-F290 WeakPolarHBondContact O-CG 3.29Å; L286-F290 PolarHBondContact O-N 3.18Å
287	G	94.5	Very high	96.6	Very high	54 Å²	54	36 Å²	36	56%	0.557	21%	0.209	S	C	*	.	H	α-helix	trans	-59.3	-35.5	177.9	0	0	0	0	0	113.2	G285 G291	G285-G287 PolarHBondContact O-N 3.05Å; G287-G291 PolarHBondContact O-N 2.9Å
288	G	96.4	Very high	96.7	Very high	0 Å²	0	30 Å²	30	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-61.9	177	0	0	0	0	0	114.4	L286 F290 G291 C292	L286-G288 VanDerWaalsContact C-N 3.26Å; L286-G288 PolarHBondContact O-N 3.07Å; G288-F290 VanDerWaalsContact C-N 3.26Å; G288-F290 PolarHBondContact O-N 3Å; G288-G291 PolarHBondContact O-N 3.45Å; G288-C292 PolarHBondContact O-N 3.5Å; G288-C292 PolarHBondContact O-SG 3.33Å
289	P	96.6	Very high	96.7	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-61.4	-36.5	178.3	21	-29.5	0	0	0	111.5	F180 L182 W228 G285 L286 G291 C292 L293	F180-P289 HydrophobicContact CZ-CB 4.06Å; L182-P289 HydrophobicContact CD1-CB 3.94Å; L182-P289 HydrophobicContact CD1-CG 4.24Å; L182-P289 HydrophobicContact CD2-CB 3.95Å; W228-P289 HydrophobicContact CD2-CB 3.91Å; W228-P289 HydrophobicContact CD2-CG 4.01Å; W228-P289 HydrophobicContact CE3-CB 4.5Å; W228-P289 HydrophobicContact CE3-CG 4.16Å; W228-P289 HydrophobicContact CG-CB 4.15Å; W228-P289 HydrophobicContact CG-CG 4.39Å; W228-P289 HydrophobicContact CZ2-CB 4.12Å; G285-P289 WeakPolarHBondContact O-CD 3.44Å; L286-P289 HydrophobicContact CD2-CG 4.43Å; L286-P289 VanDerWaalsContact O-CD 3.29Å; L286-P289 WeakPolarHBondContact O-CD 3.41Å; L286-P289 WeakPolarHBondContact O-CG 3.42Å; P289-G291 PolarHBondContact O-N 3.26Å; P289-C292 WeakPolarHBondContact O-CB 3.43Å; P289-C292 PolarHBondContact O-N 2.94Å; P289-L293 VanDerWaalsContact O-CG 3.29Å; P289-L293 WeakPolarHBondContact O-CG 3.39Å; P289-L293 PolarHBondContact O-N 3.26Å
290	F	95.4	Very high	96.7	Very high	77 Å²	77	27.9 Å²	27.9	34%	0.338	17%	0.17	S	C	.	.	H	α-helix	trans	-67.5	-35.2	178.7	-70.3	-5.5	0	0	0	113.5	P191 L286 G288 C292 L293 N294	P191-F290 HydrophobicContact CG-CE1 3.59Å; P191-F290 HydrophobicContact CG-CZ 3.79Å; L286-F290 HydrophobicContact CB-CD2 4.11Å; L286-F290 HydrophobicContact CB-CE2 3.89Å; L286-F290 HydrophobicContact CB-CZ 4.2Å; L286-F290 HydrophobicContact CD1-CE2 4.26Å; L286-F290 HydrophobicContact CD1-CZ 4.18Å; L286-F290 VanDerWaalsContact O-CB 3.23Å; L286-F290 WeakPolarHBondContact O-CB 3.42Å; L286-F290 WeakPolarHBondContact O-CG 3.29Å; L286-F290 PolarHBondContact O-N 3.18Å; G288-F290 VanDerWaalsContact C-N 3.26Å; G288-F290 PolarHBondContact O-N 3Å; F290-C292 VanDerWaalsContact C-N 3.32Å; F290-C292 PolarHBondContact O-N 3.34Å; F290-L293 HydrophobicContact CD1-CD1 3.95Å; F290-L293 HydrophobicContact CE1-CD1 4.4Å; F290-L293 PolarHBondContact O-N 2.85Å; F290-N294 WeakPolarHBondContact O-CB 3.3Å; F290-N294 PolarHBondContact O-N 3.38Å; F290-N294 PolarHBondContact O-ND2 3.25Å
291	G	94.5	Very high	96.7	Very high	19 Å²	19	27.9 Å²	27.9	20%	0.196	17%	0.17	C	C	.	.	H	α-helix	trans	-59.2	-43.7	170.7	0	0	0	0	0	112.1	G287 G288 P289 N294 N295	G287-G291 PolarHBondContact O-N 2.9Å; G288-G291 PolarHBondContact O-N 3.45Å; P289-G291 PolarHBondContact O-N 3.26Å; G291-N294 PolarHBondContact O-N 2.99Å; G291-N295 PolarHBondContact O-N 3.38Å; G291-N295 PolarHBondContact O-ND2 3.42Å
292	C	97.7	Very high	96.8	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-63.3	-48.8	175.9	-53.8	0	0	0	0	111.8	L150 P154 F180 G288 P289 F290 N294 N295 A296	L150-C292 HydrophobicContact CD2-CB 3.87Å; P154-C292 VanDerWaalsContact CB-SG 3.59Å; F180-C292 HydrophobicContact CE2-CB 4.11Å; F180-C292 HydrophobicContact CZ-CB 4.24Å; G288-C292 PolarHBondContact O-N 3.5Å; G288-C292 PolarHBondContact O-SG 3.33Å; P289-C292 WeakPolarHBondContact O-CB 3.43Å; P289-C292 PolarHBondContact O-N 2.94Å; F290-C292 VanDerWaalsContact C-N 3.32Å; F290-C292 PolarHBondContact O-N 3.34Å; C292-N294 VanDerWaalsContact C-N 3.28Å; C292-N294 PolarHBondContact O-N 3.24Å; C292-N295 PolarHBondContact O-N 3.01Å; C292-N295 VanDerWaalsContact O-N 3.13Å; C292-A296 PolarHBondContact O-N 3.19Å; C292-A296 VanDerWaalsContact O-N 3.1Å
293	L	97.4	Very high	96.9	Very high	16 Å²	16	19 Å²	19	8%	0.084	12%	0.124	C	C	.	.	H	α-helix	trans	-60.4	-37.6	179.7	-67	174.2	0	0	0	111.6	L150 F180 L182 P289 F290 N295 A296 R297 E417	L150-L293 HydrophobicContact CD2-CD2 4.23Å; F180-L293 HydrophobicContact CE1-CD2 4.37Å; L182-L293 HydrophobicContact CD2-CD1 3.94Å; P289-L293 VanDerWaalsContact O-CG 3.29Å; P289-L293 WeakPolarHBondContact O-CG 3.39Å; P289-L293 PolarHBondContact O-N 3.26Å; F290-L293 HydrophobicContact CD1-CD1 3.95Å; F290-L293 HydrophobicContact CE1-CD1 4.4Å; F290-L293 PolarHBondContact O-N 2.85Å; L293-N295 VanDerWaalsContact C-N 3.31Å; L293-N295 PolarHBondContact O-N 3.13Å; L293-A296 PolarHBondContact O-N 2.85Å; L293-R297 VanDerWaalsContact O-CB 3.28Å; L293-R297 WeakPolarHBondContact O-CB 3.19Å; L293-R297 VanDerWaalsContact O-CD 3.29Å; L293-R297 WeakPolarHBondContact O-CD 3.42Å; L293-R297 WeakPolarHBondContact O-CG 3.41Å; L293-R297 PolarHBondContact O-N 3.09Å; L293-E417 HydrophobicContact CD2-CG 3.89Å
294	N	97.8	Very high	97	Very high	29 Å²	29	17.8 Å²	17.8	16%	0.155	12%	0.116	C	C	.	.	H	α-helix	trans	-61.6	-39.4	177.2	-74.3	-17.7	0	0	0	112.3	F290 G291 C292 R297 Y298 I370	F290-N294 WeakPolarHBondContact O-CB 3.3Å; F290-N294 PolarHBondContact O-N 3.38Å; F290-N294 PolarHBondContact O-ND2 3.25Å; G291-N294 PolarHBondContact O-N 2.99Å; C292-N294 VanDerWaalsContact C-N 3.28Å; C292-N294 PolarHBondContact O-N 3.24Å; N294-R297 PolarHBondContact OD1-NH1 3.42Å; N294-Y298 PolarHBondContact O-N 3.35Å; N294-Y298 VanDerWaalsContact O-N 3.12Å; N294-I370 HydrophobicContact CB-CD1 3.77Å
295	N	95.8	Very high	97.4	Very high	21 Å²	21	14.8 Å²	14.8	11%	0.112	10%	0.095	C	C	.	.	H	α-helix	trans	-67.1	-40.5	174.5	-73.9	-50.5	0	0	0	112.6	Y123 H153 G291 C292 L293 G299	Y123-N295 WeakPolarHBondContact CE1-OD1 3.39Å; Y123-N295 PolarHBondContact OH-OD1 2.9Å; H153-N295 PolarHBondContact CD2-ND2 3.22Å; H153-N295 PolarHBondContact CE1-ND2 3.42Å; H153-N295 PolarHBondContact NE2-ND2 3.43Å; G291-N295 PolarHBondContact O-N 3.38Å; G291-N295 PolarHBondContact O-ND2 3.42Å; C292-N295 PolarHBondContact O-N 3.01Å; C292-N295 VanDerWaalsContact O-N 3.13Å; L293-N295 VanDerWaalsContact C-N 3.31Å; L293-N295 PolarHBondContact O-N 3.13Å; N295-G299 PolarHBondContact O-N 3.4Å
296	A	98.3	Very high	97.5	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-66.7	-46	177.1	0	0	0	0	0	111.9	L150 C292 L293 Y298 G299 I300 E417	L150-A296 HydrophobicContact CD1-CB 4.41Å; L150-A296 HydrophobicContact CD2-CB 3.71Å; L150-A296 HydrophobicContact CG-CB 4.03Å; C292-A296 PolarHBondContact O-N 3.19Å; C292-A296 VanDerWaalsContact O-N 3.1Å; L293-A296 PolarHBondContact O-N 2.85Å; A296-Y298 VanDerWaalsContact C-N 3.29Å; A296-Y298 PolarHBondContact O-N 3.24Å; A296-G299 PolarHBondContact O-N 3.05Å; A296-I300 WeakPolarHBondContact O-CG1 3.46Å; A296-I300 PolarHBondContact O-N 3.17Å; A296-E417 WeakPolarHBondContact CB-OE2 3.5Å
297	R	98.8	Very high	97.7	Very high	22 Å²	22	11.5 Å²	11.5	8%	0.083	7%	0.073	C	C	.	.	H	α-helix	trans	-57.6	-38.2	176.4	-71.8	163.6	172.9	158.9	0.4	113.2	L293 N294 I300 A301 I370 K374 E417	L293-R297 VanDerWaalsContact O-CB 3.28Å; L293-R297 WeakPolarHBondContact O-CB 3.19Å; L293-R297 VanDerWaalsContact O-CD 3.29Å; L293-R297 WeakPolarHBondContact O-CD 3.42Å; L293-R297 WeakPolarHBondContact O-CG 3.41Å; L293-R297 PolarHBondContact O-N 3.09Å; N294-R297 PolarHBondContact OD1-NH1 3.42Å; R297-I300 PolarHBondContact O-N 3.26Å; R297-A301 PolarHBondContact O-N 3.19Å; R297-I370 HydrophobicContact CB-CG2 3.49Å; R297-I370 VanDerWaalsContact CB-CG2 3.49Å; R297-K374 HydrophobicContact CB-CB 4.29Å; R297-K374 HydrophobicContact CB-CG 4.05Å; R297-K374 HydrophobicContact CG-CG 4.1Å; R297-E417 HydrophobicContact CG-CB 4.17Å; R297-E417 VanDerWaalsContact CZ-O 3.26Å; R297-E417 PolarHBondContact N-OE2 2.8Å; R297-E417 PolarHBondContact NE-O 3.32Å; R297-E417 PolarHBondContact NH2-O 2.93Å
298	Y	98.8	Very high	97.9	Very high	1 Å²	1	8.9 Å²	8.9	0%	0.004	5%	0.047	C	C	.	.	H	α-helix	trans	-60.7	-48.1	173.8	167.4	-98.4	0	0	0	111.5	Y123 Y126 N294 A296 I300 A301 W302 L356 G357 I360	Y123-Y298 AromaticContact CD1-CD1 3.91Å; Y123-Y298 HydrophobicContact CD1-CD1 3.91Å; Y123-Y298 AromaticContact CD1-CE1 3.88Å; Y123-Y298 HydrophobicContact CD1-CE1 3.88Å; Y123-Y298 HydrophobicContact CG-CE1 4.45Å; Y123-Y298 WeakPolarHBondContact O-CE1 3.31Å; Y123-Y298 VanDerWaalsContact O-CZ 3.3Å; Y123-Y298 PolarHBondContact O-OH 3.21Å; Y126-Y298 AromaticContact CD1-CD1 3.8Å; Y126-Y298 HydrophobicContact CD1-CD1 3.8Å; Y126-Y298 AromaticContact CD1-CE1 3.88Å; Y126-Y298 HydrophobicContact CD1-CE1 3.88Å; Y126-Y298 AromaticContact CE1-CD1 3.95Å; Y126-Y298 HydrophobicContact CE1-CD1 3.95Å; Y126-Y298 HydrophobicContact CE1-CE1 4.47Å; N294-Y298 PolarHBondContact O-N 3.35Å; N294-Y298 VanDerWaalsContact O-N 3.12Å; A296-Y298 VanDerWaalsContact C-N 3.29Å; A296-Y298 PolarHBondContact O-N 3.24Å; Y298-I300 VanDerWaalsContact C-N 3.31Å; Y298-I300 PolarHBondContact O-N 3.29Å; Y298-A301 PolarHBondContact O-N 2.94Å; Y298-W302 AromaticContact CE2-CD1 3.76Å; Y298-W302 AromaticContact CE2-NE1 3.53Å; Y298-W302 AromaticContact CZ-CD1 3.63Å; Y298-W302 AromaticContact CZ-NE1 3.36Å; Y298-W302 PolarHBondContact O-N 3.26Å; Y298-W302 PolarHBondContact OH-NE1 2.87Å; Y298-L356 HydrophobicContact CD2-CD2 3.88Å; Y298-L356 HydrophobicContact CD2-CG 3.99Å; Y298-L356 HydrophobicContact CE2-CD2 4.44Å; Y298-L356 HydrophobicContact CE2-CG 4.19Å; Y298-G357 VanDerWaalsContact OH-CA 3.28Å; Y298-G357 WeakPolarHBondContact OH-CA 3.46Å; Y298-I360 HydrophobicContact CD1-CD1 4.31Å; Y298-I360 HydrophobicContact CD2-CD1 3.35Å; Y298-I360 HydrophobicContact CE2-CD1 3.71Å; Y298-I360 HydrophobicContact CG-CD1 3.68Å
299	G	98.7	Very high	98	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-61.8	-37.8	175.6	0	0	0	0	0	112.7	A130 N295 A296 W302 G303	A130-G299 WeakPolarHBondContact CB-O 3.39Å; N295-G299 PolarHBondContact O-N 3.4Å; A296-G299 PolarHBondContact O-N 3.05Å; G299-W302 PolarHBondContact O-N 3.38Å; G299-G303 PolarHBondContact O-N 3.01Å
300	I	98.9	Very high	98.2	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-64.2	-41.2	175.9	-69.5	170.6	0	0	0	112	A296 R297 Y298 W302 G303 S304 C378 V413 Y416 E417	A296-I300 WeakPolarHBondContact O-CG1 3.46Å; A296-I300 PolarHBondContact O-N 3.17Å; R297-I300 PolarHBondContact O-N 3.26Å; Y298-I300 VanDerWaalsContact C-N 3.31Å; Y298-I300 PolarHBondContact O-N 3.29Å; I300-W302 PolarHBondContact O-N 3.32Å; I300-G303 PolarHBondContact O-N 3.26Å; I300-S304 PolarHBondContact O-N 3.15Å; I300-S304 PolarHBondContact O-OG 3.43Å; I300-C378 VanDerWaalsContact CG2-SG 3.54Å; I300-V413 HydrophobicContact CG2-CG1 3.61Å; I300-Y416 HydrophobicContact CD1-CD2 4.46Å; I300-Y416 HydrophobicContact CD1-CE2 3.47Å; I300-Y416 VanDerWaalsContact CD1-CE2 3.47Å; I300-E417 HydrophobicContact CD1-CB 4.26Å; I300-E417 HydrophobicContact CD1-CG 4.35Å; I300-E417 WeakPolarHBondContact CD1-OE2 3.48Å
301	A	98.9	Very high	98.3	Very high	1 Å²	1	7 Å²	7	1%	0.008	4%	0.039	C	C	.	.	H	α-helix	trans	-59.3	-37.3	180	0	0	0	0	0	112.1	R297 Y298 L305 L373 S377	R297-A301 PolarHBondContact O-N 3.19Å; Y298-A301 PolarHBondContact O-N 2.94Å; A301-L305 WeakPolarHBondContact O-CD1 3.5Å; A301-L373 HydrophobicContact CB-CB 4.14Å; A301-S377 WeakPolarHBondContact O-CB 3.12Å; A301-S377 PolarHBondContact O-OG 3.11Å; A301-S377 VanDerWaalsContact O-OG 3.09Å
302	W	98.9	Very high	98.5	Very high	0 Å²	0	6.6 Å²	6.6	0%	0	3%	0.031	C	C	.	.	H	α-helix	trans	-73.6	-48.7	171	-84.5	94.4	0	0	0	112.7	V124 G127 L128 R131 Y298 G299 I300 S304 L305 G306 L350 C353 L354	V124-W302 HydrophobicContact CG1-CZ2 4.47Å; G127-W302 VanDerWaalsContact O-CB 3.27Å; G127-W302 WeakPolarHBondContact O-CB 3.5Å; L128-W302 HydrophobicContact CD2-CE3 4.48Å; L128-W302 HydrophobicContact CD2-CH2 4.1Å; L128-W302 HydrophobicContact CD2-CZ3 3.71Å; L128-W302 HydrophobicContact CG-CH2 4.48Å; L128-W302 HydrophobicContact CG-CZ3 4.34Å; R131-W302 HydrophobicContact CB-CE3 4.3Å; Y298-W302 AromaticContact CE2-CD1 3.76Å; Y298-W302 AromaticContact CE2-NE1 3.53Å; Y298-W302 AromaticContact CZ-CD1 3.63Å; Y298-W302 AromaticContact CZ-NE1 3.36Å; Y298-W302 PolarHBondContact O-N 3.26Å; Y298-W302 PolarHBondContact OH-NE1 2.87Å; G299-W302 PolarHBondContact O-N 3.38Å; I300-W302 PolarHBondContact O-N 3.32Å; W302-S304 PolarHBondContact O-N 3.29Å; W302-L305 WeakPolarHBondContact O-CB 3.47Å; W302-L305 PolarHBondContact O-N 3.38Å; W302-G306 PolarHBondContact O-N 3.36Å; W302-L350 HydrophobicContact CE3-CD2 4.2Å; W302-L350 HydrophobicContact CZ3-CD2 4.04Å; W302-C353 HydrophobicContact CD2-CB 3.82Å; W302-C353 HydrophobicContact CG-CB 4.02Å; W302-C353 HydrophobicContact CZ2-CB 4.03Å; W302-C353 PolarHBondContact NE1-O 3.49Å; W302-L354 HydrophobicContact CH2-CB 4.37Å; W302-L354 HydrophobicContact CZ2-CB 4.27Å
303	G	98.9	Very high	98.6	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.044	C	C	.	.	H	α-helix	trans	-56.9	-47.9	-175.9	0	0	0	0	0	112.7	A130 E134 G299 I300 L305 G306 A307	A130-G303 WeakPolarHBondContact O-CA 3.36Å; E134-G303 VanDerWaalsContact CB-O 3.23Å; E134-G303 WeakPolarHBondContact CB-O 3.38Å; E134-G303 WeakPolarHBondContact CG-O 3.33Å; E134-G303 WeakPolarHBondContact OE2-CA 3.46Å; G299-G303 PolarHBondContact O-N 3.01Å; I300-G303 PolarHBondContact O-N 3.26Å; G303-L305 PolarHBondContact O-N 2.98Å; G303-L305 VanDerWaalsContact O-N 3.13Å; G303-G306 WeakPolarHBondContact O-CA 3.3Å; G303-G306 PolarHBondContact O-N 3.3Å; G303-A307 PolarHBondContact O-N 3.36Å
304	S	98.9	Very high	98.7	Very high	0 Å²	0	10 Å²	10	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-59.4	-32.7	-177.9	63.8	0	0	0	0	112.2	E134 I300 W302 G306 A307 A308 S377 S381	E134-S304 PolarHBondContact OE2-N 3.12Å; E134-S304 VanDerWaalsContact OE2-N 3.09Å; I300-S304 PolarHBondContact O-N 3.15Å; I300-S304 PolarHBondContact O-OG 3.43Å; W302-S304 PolarHBondContact O-N 3.29Å; S304-G306 VanDerWaalsContact C-N 3.31Å; S304-G306 PolarHBondContact O-N 2.96Å; S304-A307 PolarHBondContact O-N 3.47Å; S304-A308 PolarHBondContact O-N 3.42Å; S304-S377 VanDerWaalsContact OG-CB 3.32Å; S304-S377 WeakPolarHBondContact OG-CB 3.32Å; S304-S377 PolarHBondContact OG-O 3.09Å; S304-S381 WeakPolarHBondContact O-CB 3.43Å; S304-S381 PolarHBondContact O-OG 3.08Å; S304-S381 PolarHBondContact OG-OG 2.71Å
305	L	98.9	Very high	98.7	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.005	4%	0.044	C	C	.	.	H	α-helix	trans	-68.2	-30.4	175.6	-64.2	169.4	0	0	0	112.1	A301 W302 G303 A308 E309 G349 L350	A301-L305 WeakPolarHBondContact O-CD1 3.5Å; W302-L305 WeakPolarHBondContact O-CB 3.47Å; W302-L305 PolarHBondContact O-N 3.38Å; G303-L305 PolarHBondContact O-N 2.98Å; G303-L305 VanDerWaalsContact O-N 3.13Å; L305-A308 PolarHBondContact O-N 3.09Å; L305-E309 WeakPolarHBondContact O-CB 3.23Å; L305-E309 VanDerWaalsContact O-CG 3.29Å; L305-E309 WeakPolarHBondContact O-CG 3.39Å; L305-E309 PolarHBondContact O-N 3.42Å; L305-G349 VanDerWaalsContact CD1-C 3.45Å; L305-L350 HydrophobicContact CB-CD2 4.22Å; L305-L350 HydrophobicContact CD1-CD2 3.97Å; L305-L350 HydrophobicContact CD1-CG 4.16Å
306	G	98.9	Very high	98.9	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61.8	-43.9	170.7	0	0	0	0	0	112.6	R131 R135 W302 G303 S304 E309 F310	R131-G306 WeakPolarHBondContact O-CA 3.4Å; R135-G306 WeakPolarHBondContact CA-O 3.33Å; W302-G306 PolarHBondContact O-N 3.36Å; G303-G306 WeakPolarHBondContact O-CA 3.3Å; G303-G306 PolarHBondContact O-N 3.3Å; S304-G306 VanDerWaalsContact C-N 3.31Å; S304-G306 PolarHBondContact O-N 2.96Å; G306-E309 PolarHBondContact O-N 2.68Å; G306-F310 PolarHBondContact O-N 3.15Å
307	A	98.9	Very high	98.9	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.4	-39.3	172.8	0	0	0	0	0	112.2	E134 G303 S304 F310 C311 H406 L410	E134-A307 HydrophobicContact CG-CB 3.99Å; G303-A307 PolarHBondContact O-N 3.36Å; S304-A307 PolarHBondContact O-N 3.47Å; A307-F310 WeakPolarHBondContact O-CB 3.34Å; A307-F310 PolarHBondContact O-N 2.99Å; A307-C311 PolarHBondContact O-N 3.31Å; A307-C311 PolarHBondContact O-SG 3.47Å; A307-H406 WeakPolarHBondContact CB-ND1 3.3Å; A307-L410 HydrophobicContact CB-CD1 4.24Å; A307-L410 HydrophobicContact CB-CD2 4.41Å
308	A	98.9	Very high	98.9	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-62.2	-44.4	175.8	0	0	0	0	0	112	S304 L305 C311 F312 I346 I384	S304-A308 PolarHBondContact O-N 3.42Å; L305-A308 PolarHBondContact O-N 3.09Å; A308-C311 PolarHBondContact O-N 3.38Å; A308-F312 WeakPolarHBondContact O-CB 3.18Å; A308-F312 PolarHBondContact O-N 3.17Å; A308-I346 HydrophobicContact CB-CD1 4.13Å; A308-I346 HydrophobicContact CB-CG1 4.02Å; A308-I384 HydrophobicContact CB-CB 4.4Å; A308-I384 HydrophobicContact CB-CD1 4.05Å; A308-I384 HydrophobicContact CB-CG2 4.1Å
309	E	98.9	Very high	98.9	Very high	4 Å²	4	15.3 Å²	15.3	2%	0.019	7%	0.072	C	C	.	.	H	α-helix	trans	-62.8	-41.1	174.8	-75.9	173.6	148.4	0	0	112.3	R131 R135 L305 G306 C311 F312 H313 I346 L350	R131-E309 IonicContact CZ-OE1 3.42Å; R131-E309 IonicContact CZ-OE2 2.64Å; R131-E309 VanDerWaalsContact CZ-OE2 3.24Å; R131-E309 IonicContact NE-OE1 2.7Å; R131-E309 PolarHBondContact NE-OE1 3Å; R131-E309 IonicContact NE-OE2 3.39Å; R131-E309 PolarHBondContact NE-OE2 3.35Å; R131-E309 VanDerWaalsContact NH2-CD 3.28Å; R131-E309 IonicContact NH2-OE1 2.68Å; R131-E309 PolarHBondContact NH2-OE1 3.23Å; R131-E309 IonicContact NH2-OE2 2.71Å; R131-E309 PolarHBondContact NH2-OE2 3.05Å; R131-E309 VanDerWaalsContact NH2-OE2 3.1Å; R135-E309 IonicContact CZ-OE2 3.34Å; R135-E309 IonicContact NH1-OE2 3.79Å; R135-E309 PolarHBondContact NH1-OE2 3.02Å; R135-E309 IonicContact NH2-OE2 3.31Å; R135-E309 PolarHBondContact NH2-OE2 3.37Å; L305-E309 WeakPolarHBondContact O-CB 3.23Å; L305-E309 VanDerWaalsContact O-CG 3.29Å; L305-E309 WeakPolarHBondContact O-CG 3.39Å; L305-E309 PolarHBondContact O-N 3.42Å; G306-E309 PolarHBondContact O-N 2.68Å; E309-C311 VanDerWaalsContact C-N 3.34Å; E309-C311 PolarHBondContact O-N 3.17Å; E309-F312 PolarHBondContact O-N 2.92Å; E309-H313 WeakPolarHBondContact O-CB 3.42Å; E309-H313 PolarHBondContact O-CD2 3Å; E309-H313 PolarHBondContact O-N 3.25Å; E309-I346 HydrophobicContact CG-CD1 4.08Å; E309-I346 HydrophobicContact CG-CG2 3.56Å; E309-L350 WeakPolarHBondContact OE1-CD1 3.02Å
310	F	98.9	Very high	98.9	Very high	33 Å²	33	18.6 Å²	18.6	15%	0.145	9%	0.089	C	C	.	.	H	α-helix	trans	-56.4	-50.7	172.6	179	-83.2	0	0	0	110.6	M83 R135 G306 A307 F312 H313 A314 H402 H406	M83-F310 HydrophobicContact CE-CE2 3.84Å; M83-F310 HydrophobicContact CE-CZ 4.07Å; R135-F310 HydrophobicContact CG-CB 4.07Å; R135-F310 HydrophobicContact CG-CD2 4.46Å; R135-F310 WeakPolarHBondContact O-CD2 3.43Å; G306-F310 PolarHBondContact O-N 3.15Å; A307-F310 WeakPolarHBondContact O-CB 3.34Å; A307-F310 PolarHBondContact O-N 2.99Å; F310-F312 PolarHBondContact O-N 3Å; F310-H313 PolarHBondContact O-N 3.46Å; F310-A314 HydrophobicContact CE1-CB 4.24Å; F310-A314 VanDerWaalsContact O-CB 3.3Å; F310-A314 WeakPolarHBondContact O-CB 3.38Å; F310-A314 PolarHBondContact O-N 3.49Å; F310-H402 HydrophobicContact CE1-CB 3.62Å; F310-H402 HydrophobicContact CZ-CB 3.62Å; F310-H402 AromaticContact CZ-CD2 3.95Å; F310-H406 AromaticContact CD1-CD2 3.43Å; F310-H406 VanDerWaalsContact CD1-CD2 3.43Å; F310-H406 WeakPolarHBondContact CD1-CD2 3.27Å; F310-H406 AromaticContact CD1-NE2 3.45Å; F310-H406 WeakPolarHBondContact CD1-NE2 3.28Å; F310-H406 AromaticContact CE1-CD2 3.78Å; F310-H406 AromaticContact CE1-NE2 3.86Å; F310-H406 AromaticContact CG-NE2 3.76Å
311	C	98.9	Very high	98.9	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-60.5	-44.7	-179.8	-68	0	0	0	0	111.9	A307 A308 E309 A315 I384 A388 H406	A307-C311 PolarHBondContact O-N 3.31Å; A307-C311 PolarHBondContact O-SG 3.47Å; A308-C311 PolarHBondContact O-N 3.38Å; E309-C311 VanDerWaalsContact C-N 3.34Å; E309-C311 PolarHBondContact O-N 3.17Å; C311-A315 VanDerWaalsContact O-CB 3.24Å; C311-A315 WeakPolarHBondContact O-CB 3.37Å; C311-A315 PolarHBondContact O-N 2.89Å; C311-I384 HydrophobicContact CB-CG2 4.36Å; C311-A388 HydrophobicContact CB-CB 3.8Å; C311-H406 VanDerWaalsContact SG-CB 3.58Å
312	F	98.9	Very high	98.9	Very high	10 Å²	10	28.9 Å²	28.9	4%	0.044	14%	0.136	C	C	.	.	H	α-helix	trans	-61.3	-49.3	176.5	169.4	-136.4	0	0	0	111.7	W53 A308 E309 F310 A315 R316 M339 M342 L343 I346	W53-F312 AromaticContact CE3-CE1 3.76Å; W53-F312 HydrophobicContact CE3-CE1 3.76Å; W53-F312 AromaticContact CE3-CZ 3.85Å; W53-F312 HydrophobicContact CE3-CZ 3.85Å; W53-F312 AromaticContact CZ3-CE1 3.78Å; W53-F312 HydrophobicContact CZ3-CE1 3.78Å; W53-F312 HydrophobicContact CZ3-CZ 4.03Å; A308-F312 WeakPolarHBondContact O-CB 3.18Å; A308-F312 PolarHBondContact O-N 3.17Å; E309-F312 PolarHBondContact O-N 2.92Å; F310-F312 PolarHBondContact O-N 3Å; F312-A315 PolarHBondContact O-N 3.25Å; F312-R316 HydrophobicContact CE2-CB 4.36Å; F312-R316 VanDerWaalsContact O-CB 3.26Å; F312-R316 WeakPolarHBondContact O-CB 3.28Å; F312-R316 PolarHBondContact O-N 2.96Å; F312-M339 HydrophobicContact CE2-CB 4.04Å; F312-M339 HydrophobicContact CE2-CG 4.1Å; F312-M342 HydrophobicContact CB-CB 4.28Å; F312-M342 HydrophobicContact CB-SD 4.14Å; F312-M342 HydrophobicContact CD2-CB 3.9Å; F312-M342 HydrophobicContact CD2-SD 3.82Å; F312-M342 HydrophobicContact CG-CB 4.11Å; F312-M342 HydrophobicContact CG-SD 4.39Å; F312-L343 HydrophobicContact CE1-CB 4.41Å; F312-L343 HydrophobicContact CE1-CD1 4.4Å; F312-L343 HydrophobicContact CZ-CB 4.28Å; F312-I346 HydrophobicContact CB-CD1 3.96Å; F312-I346 HydrophobicContact CD1-CD1 4.15Å; F312-I346 HydrophobicContact CG-CD1 4.36Å
313	H	98.9	Very high	98.9	Very high	59 Å²	59	32.8 Å²	32.8	27%	0.273	16%	0.156	S	C	.	.	H	α-helix	trans	-63.9	-44.3	-178.7	-68	177.2	0	0	0	111.8	W53 E309 F310 R316 Q317	W53-H313 AromaticContact CH2-CD2 3.98Å; W53-H313 AromaticContact CZ3-CD2 3.53Å; W53-H313 AromaticContact CZ3-NE2 3.67Å; E309-H313 WeakPolarHBondContact O-CB 3.42Å; E309-H313 PolarHBondContact O-CD2 3Å; E309-H313 PolarHBondContact O-N 3.25Å; F310-H313 PolarHBondContact O-N 3.46Å; H313-R316 PolarHBondContact O-N 3.4Å; H313-Q317 WeakPolarHBondContact O-CB 3.26Å; H313-Q317 PolarHBondContact O-N 3.21Å
314	A	98.8	Very high	98.8	Very high	29 Å²	29	36.9 Å²	36.9	24%	0.24	18%	0.175	C	C	.	.	H	α-helix	trans	-64.1	-45.8	177.6	0	0	0	0	0	111.7	F310 Q317 Y318 I403	F310-A314 HydrophobicContact CE1-CB 4.24Å; F310-A314 VanDerWaalsContact O-CB 3.3Å; F310-A314 WeakPolarHBondContact O-CB 3.38Å; F310-A314 PolarHBondContact O-N 3.49Å; A314-Q317 PolarHBondContact O-N 3.45Å; A314-Y318 VanDerWaalsContact O-CB 3.28Å; A314-Y318 WeakPolarHBondContact O-CB 3.4Å; A314-Y318 PolarHBondContact O-N 2.85Å; A314-I403 HydrophobicContact CB-CD1 3.91Å; A314-I403 HydrophobicContact CB-CG1 4.21Å
315	A	98.8	Very high	98.8	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-65.6	-40	177.4	0	0	0	0	0	112.4	C311 F312 T319 A388 M391 L392 I403	C311-A315 VanDerWaalsContact O-CB 3.24Å; C311-A315 WeakPolarHBondContact O-CB 3.37Å; C311-A315 PolarHBondContact O-N 2.89Å; F312-A315 PolarHBondContact O-N 3.25Å; A315-T319 WeakPolarHBondContact O-CB 3.35Å; A315-T319 VanDerWaalsContact O-CG2 3.28Å; A315-T319 WeakPolarHBondContact O-CG2 3.43Å; A315-T319 PolarHBondContact O-N 3.26Å; A315-T319 PolarHBondContact O-OG1 3.02Å; A315-A388 HydrophobicContact CB-CB 3.89Å; A315-M391 HydrophobicContact CB-CB 4.48Å; A315-M391 HydrophobicContact CB-CE 4Å; A315-M391 HydrophobicContact CB-SD 4.17Å; A315-L392 HydrophobicContact CB-CD1 4.22Å; A315-I403 HydrophobicContact CB-CD1 4.43Å
316	R	98.8	Very high	98.7	Very high	61 Å²	61	49.6 Å²	49.6	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-59.9	-50.3	173.8	-180	-172.9	171.7	-73.7	-2.5	110.9	F312 H313 T319 L320 M339	F312-R316 HydrophobicContact CE2-CB 4.36Å; F312-R316 VanDerWaalsContact O-CB 3.26Å; F312-R316 WeakPolarHBondContact O-CB 3.28Å; F312-R316 PolarHBondContact O-N 2.96Å; H313-R316 PolarHBondContact O-N 3.4Å; R316-T319 PolarHBondContact O-N 3.23Å; R316-T319 PolarHBondContact O-OG1 3.02Å; R316-T319 VanDerWaalsContact O-OG1 3.1Å; R316-L320 HydrophobicContact CG-CD1 4.25Å; R316-L320 WeakPolarHBondContact O-CG 3.28Å; R316-L320 PolarHBondContact O-N 3.29Å; R316-L320 VanDerWaalsContact O-N 3.12Å; R316-M339 HydrophobicContact CB-SD 4.08Å; R316-M339 HydrophobicContact CG-SD 3.93Å
317	Q	98.9	Very high	98.7	Very high	90 Å²	90	51.1 Å²	51.1	42%	0.421	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-47.8	-179.2	-170.6	56.2	47	0	0	110.9	H313 A314 T319 L320 D321	H313-Q317 WeakPolarHBondContact O-CB 3.26Å; H313-Q317 PolarHBondContact O-N 3.21Å; A314-Q317 PolarHBondContact O-N 3.45Å; Q317-T319 VanDerWaalsContact C-N 3.31Å; Q317-T319 PolarHBondContact O-N 3.44Å; Q317-L320 WeakPolarHBondContact O-CB 3.48Å; Q317-L320 PolarHBondContact O-N 2.93Å; Q317-L320 VanDerWaalsContact O-N 3.12Å; Q317-D321 PolarHBondContact NE2-OD1 2.79Å; Q317-D321 PolarHBondContact NE2-OD2 3.44Å; Q317-D321 VanDerWaalsContact O-CG 3.29Å; Q317-D321 PolarHBondContact O-N 3.4Å
318	Y	98.8	Very high	98.7	Very high	34 Å²	34	53.4 Å²	53.4	13%	0.133	28%	0.275	C	S	.	.	H	α-helix	trans	-56.9	-42.5	177.5	-177.3	-93.8	0	0	0	112.7	A314 L320 D321 R322 L329 L392 N395 Y401	A314-Y318 VanDerWaalsContact O-CB 3.28Å; A314-Y318 WeakPolarHBondContact O-CB 3.4Å; A314-Y318 PolarHBondContact O-N 2.85Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 2.98Å; Y318-D321 PolarHBondContact O-N 2.79Å; Y318-R322 HydrophobicContact CD1-CB 4.24Å; Y318-R322 HydrophobicContact CE1-CB 3.97Å; Y318-R322 HydrophobicContact CE1-CG 4.05Å; Y318-R322 WeakPolarHBondContact O-CB 3.39Å; Y318-R322 PolarHBondContact O-N 3.41Å; Y318-L329 HydrophobicContact CE1-CD1 4.35Å; Y318-L392 HydrophobicContact CD1-CB 4.44Å; Y318-L392 HydrophobicContact CD1-CD1 4.01Å; Y318-L392 HydrophobicContact CD1-CG 3.76Å; Y318-L392 HydrophobicContact CD2-CG 4.2Å; Y318-L392 HydrophobicContact CE1-CB 4.22Å; Y318-L392 HydrophobicContact CE1-CG 3.98Å; Y318-L392 HydrophobicContact CE2-CG 4.4Å; Y318-L392 HydrophobicContact CG-CD1 4.14Å; Y318-L392 HydrophobicContact CG-CG 3.86Å; Y318-L392 PolarHBondContact OH-O 3.38Å; Y318-N395 PolarHBondContact OH-ND2 3.34Å; Y318-Y401 HydrophobicContact CD2-CD1 4.35Å; Y318-Y401 HydrophobicContact CD2-CE1 4.05Å; Y318-Y401 HydrophobicContact CE2-CD1 4.36Å; Y318-Y401 AromaticContact CE2-CE1 3.76Å; Y318-Y401 HydrophobicContact CE2-CE1 3.76Å
319	T	98.8	Very high	98.7	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-75.3	-21.2	-179.1	54.6	0	0	0	0	113.8	A315 R316 Q317 L329 A330 M335 M391	A315-T319 WeakPolarHBondContact O-CB 3.35Å; A315-T319 VanDerWaalsContact O-CG2 3.28Å; A315-T319 WeakPolarHBondContact O-CG2 3.43Å; A315-T319 PolarHBondContact O-N 3.26Å; A315-T319 PolarHBondContact O-OG1 3.02Å; R316-T319 PolarHBondContact O-N 3.23Å; R316-T319 PolarHBondContact O-OG1 3.02Å; R316-T319 VanDerWaalsContact O-OG1 3.1Å; Q317-T319 VanDerWaalsContact C-N 3.31Å; Q317-T319 PolarHBondContact O-N 3.44Å; T319-L329 HydrophobicContact CG2-CB 4.02Å; T319-L329 HydrophobicContact CG2-CD1 4.34Å; T319-L329 PolarHBondContact O-N 3.41Å; T319-A330 WeakPolarHBondContact O-CB 3.36Å; T319-A330 PolarHBondContact O-N 2.93Å; T319-M335 HydrophobicContact CG2-SD 4.13Å; T319-M391 HydrophobicContact CG2-CB 4.42Å; T319-M391 HydrophobicContact CG2-CE 3.88Å
320	L	98.8	Very high	98.7	Very high	69 Å²	69	54.9 Å²	54.9	36%	0.361	28%	0.284	S	S	.	.	H	α-helix	trans	-73.9	-39.7	168.5	-72.1	167.5	0	0	0	111.5	R316 Q317 Y318 A330	R316-L320 HydrophobicContact CG-CD1 4.25Å; R316-L320 WeakPolarHBondContact O-CG 3.28Å; R316-L320 PolarHBondContact O-N 3.29Å; R316-L320 VanDerWaalsContact O-N 3.12Å; Q317-L320 WeakPolarHBondContact O-CB 3.48Å; Q317-L320 PolarHBondContact O-N 2.93Å; Q317-L320 VanDerWaalsContact O-N 3.12Å; Y318-L320 VanDerWaalsContact C-N 3.34Å; Y318-L320 PolarHBondContact O-N 2.98Å; L320-A330 HydrophobicContact CD2-CB 3.78Å; L320-A330 HydrophobicContact CG-CB 4.12Å
321	D	98.8	Very high	98.7	Very high	106 Å²	106	61.7 Å²	61.7	57%	0.567	31%	0.309	S	S	*	.	H	α-helix	trans	-83	-35.3	-174.9	-61.4	-24.1	0	0	0	112.5	Q317 Y318 I323	Q317-D321 PolarHBondContact NE2-OD1 2.79Å; Q317-D321 PolarHBondContact NE2-OD2 3.44Å; Q317-D321 VanDerWaalsContact O-CG 3.29Å; Q317-D321 PolarHBondContact O-N 3.4Å; Y318-D321 PolarHBondContact O-N 2.79Å; D321-I323 PolarHBondContact O-N 2.85Å
322	R	98.6	Very high	98.7	Very high	110 Å²	110	65 Å²	65	42%	0.415	33%	0.327	S	S	.	.			trans	-78.6	122.8	-177.1	-176.8	64.3	179.7	-145.9	0.8	111.2	Y318 L329	Y318-R322 HydrophobicContact CD1-CB 4.24Å; Y318-R322 HydrophobicContact CE1-CB 3.97Å; Y318-R322 HydrophobicContact CE1-CG 4.05Å; Y318-R322 WeakPolarHBondContact O-CB 3.39Å; Y318-R322 PolarHBondContact O-N 3.41Å; R322-L329 HydrophobicContact CB-CD1 3.88Å; R322-L329 HydrophobicContact CB-CG 4.27Å; R322-L329 HydrophobicContact CG-CD1 3.64Å; R322-L329 HydrophobicContact CG-CG 4.13Å; R322-L329 WeakPolarHBondContact O-CG 3.35Å; R322-L329 PolarHBondContact O-N 3.14Å
323	I	98.6	Very high	98.7	Very high	82 Å²	82	72.7 Å²	72.7	42%	0.421	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	132.6	177	-53.3	-56.5	0	0	0	111	D321 V327 P328	D321-I323 PolarHBondContact O-N 2.85Å; I323-V327 WeakPolarHBondContact CA-O 3.3Å; I323-P328 HydrophobicContact CD1-CB 4.21Å; I323-P328 HydrophobicContact CD1-CG 3.74Å
324	Q	98.1	Very high	98.7	Very high	86 Å²	86	76.3 Å²	76.3	40%	0.402	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	146.6	165.4	-75.8	-64.8	-73.8	0	0	109.1	G326 V327 L329	Q324-G326 PolarHBondContact O-N 3.12Å; Q324-G326 VanDerWaalsContact O-N 3.11Å; Q324-V327 PolarHBondContact N-O 3.04Å; Q324-V327 PolarHBondContact O-N 3.29Å; Q324-V327 VanDerWaalsContact O-N 3.08Å; Q324-L329 HydrophobicContact CB-CD2 3.79Å; Q324-L329 HydrophobicContact CG-CD2 3.88Å
325	F	98.1	Very high	98.6	Very high	198 Å²	198	76.6 Å²	76.6	87%	0.868	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	36.1	-177	-50.6	-74.2	0	0	0	112.9	V327	F325-V327 VanDerWaalsContact C-N 3.31Å; F325-V327 PolarHBondContact O-N 2.78Å
326	G	98.3	Very high	98.6	Very high	71 Å²	71	81.6 Å²	81.6	73%	0.732	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	6.1	178.1	0	0	0	0	0	116.2	Q324	Q324-G326 PolarHBondContact O-N 3.12Å; Q324-G326 VanDerWaalsContact O-N 3.11Å
327	V	98.6	Very high	98.7	Very high	31 Å²	31	84.5 Å²	84.5	19%	0.188	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	157.9	-178.1	-60.4	0	0	0	0	112.5	I323 Q324 F325 R331	I323-V327 WeakPolarHBondContact CA-O 3.3Å; Q324-V327 PolarHBondContact N-O 3.04Å; Q324-V327 PolarHBondContact O-N 3.29Å; Q324-V327 VanDerWaalsContact O-N 3.08Å; F325-V327 VanDerWaalsContact C-N 3.31Å; F325-V327 PolarHBondContact O-N 2.78Å; V327-R331 VanDerWaalsContact CG1-NH1 3.3Å
328	P	98.8	Very high	98.7	Very high	48 Å²	48	82.6 Å²	82.6	31%	0.312	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.4	140.1	169.4	-26.5	35.7	0	0	0	112.3	I323 A330 R331	I323-P328 HydrophobicContact CD1-CB 4.21Å; I323-P328 HydrophobicContact CD1-CG 3.74Å; P328-A330 PolarHBondContact O-N 2.7Å; P328-R331 VanDerWaalsContact O-CB 3.28Å; P328-R331 WeakPolarHBondContact O-CB 3.42Å; P328-R331 PolarHBondContact O-N 2.79Å
329	L	98.8	Very high	98.6	Very high	25 Å²	25	82.3 Å²	82.3	13%	0.131	41%	0.409	C	S	.	.	G	3₁₀ helix	trans	-55.4	-37.3	174.8	-69.9	-179.9	0	0	0	111.9	Y318 T319 R322 Q324 R331 N332 M335	Y318-L329 HydrophobicContact CE1-CD1 4.35Å; T319-L329 HydrophobicContact CG2-CB 4.02Å; T319-L329 HydrophobicContact CG2-CD1 4.34Å; T319-L329 PolarHBondContact O-N 3.41Å; R322-L329 HydrophobicContact CB-CD1 3.88Å; R322-L329 HydrophobicContact CB-CG 4.27Å; R322-L329 HydrophobicContact CG-CD1 3.64Å; R322-L329 HydrophobicContact CG-CG 4.13Å; R322-L329 WeakPolarHBondContact O-CG 3.35Å; R322-L329 PolarHBondContact O-N 3.14Å; Q324-L329 HydrophobicContact CB-CD2 3.79Å; Q324-L329 HydrophobicContact CG-CD2 3.88Å; L329-R331 PolarHBondContact O-N 3.1Å; L329-N332 WeakPolarHBondContact O-CB 3.47Å; L329-N332 PolarHBondContact O-N 3.34Å; L329-N332 PolarHBondContact O-ND2 2.93Å; L329-M335 HydrophobicContact CB-CG 4.46Å; L329-M335 HydrophobicContact CD1-CE 4.5Å; L329-M335 VanDerWaalsContact O-CG 3.29Å; L329-M335 WeakPolarHBondContact O-CG 3.34Å
330	A	98.6	Very high	98.7	Very high	11 Å²	11	84.7 Å²	84.7	9%	0.091	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-61.3	-14.3	179.1	0	0	0	0	0	114.2	T319 L320 P328 N332 Q336 M339	T319-A330 WeakPolarHBondContact O-CB 3.36Å; T319-A330 PolarHBondContact O-N 2.93Å; L320-A330 HydrophobicContact CD2-CB 3.78Å; L320-A330 HydrophobicContact CG-CB 4.12Å; P328-A330 PolarHBondContact O-N 2.7Å; A330-N332 VanDerWaalsContact C-N 3.29Å; A330-Q336 VanDerWaalsContact O-CG 3.28Å; A330-Q336 WeakPolarHBondContact O-CG 3.47Å; A330-Q336 PolarHBondContact O-NE2 2.92Å; A330-M339 HydrophobicContact CB-CE 4.15Å
331	R	98.6	Very high	98.7	Very high	176 Å²	176	85 Å²	85	66%	0.664	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-69.5	-27.3	173.1	-175.9	177.8	173.5	-179.3	-2.9	112.4	V327 P328 L329 Q336	V327-R331 VanDerWaalsContact CG1-NH1 3.3Å; P328-R331 VanDerWaalsContact O-CB 3.28Å; P328-R331 WeakPolarHBondContact O-CB 3.42Å; P328-R331 PolarHBondContact O-N 2.79Å; L329-R331 PolarHBondContact O-N 3.1Å; R331-Q336 PolarHBondContact O-NE2 3.1Å
332	N	98.8	Very high	98.7	Very high	69 Å²	69	80.2 Å²	80.2	37%	0.369	40%	0.404	S	S	.	.	S	Bend	trans	-76.5	137.3	-171.7	-60.4	-73.9	0	0	0	111.7	L329 A330 L334 M335 Q336	L329-N332 WeakPolarHBondContact O-CB 3.47Å; L329-N332 PolarHBondContact O-N 3.34Å; L329-N332 PolarHBondContact O-ND2 2.93Å; A330-N332 VanDerWaalsContact C-N 3.29Å; N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 3.43Å; N332-M335 HydrophobicContact CB-CG 4.39Å; N332-M335 WeakPolarHBondContact O-CB 3.46Å; N332-M335 PolarHBondContact O-N 2.66Å; N332-Q336 PolarHBondContact O-N 2.81Å; N332-Q336 VanDerWaalsContact O-N 3.11Å
333	Q	98.8	Very high	98.7	Very high	171 Å²	171	76.6 Å²	76.6	80%	0.799	39%	0.393	S	S	*	.	H	α-helix	trans	-54.7	-40.6	-178.3	-70.1	178.6	-21.1	0	0	113	M335 Q336 K337	Q333-M335 VanDerWaalsContact C-N 3.31Å; Q333-M335 PolarHBondContact O-N 3.41Å; Q333-Q336 PolarHBondContact O-N 3.39Å; Q333-K337 PolarHBondContact O-N 3.33Å
334	L	98.8	Very high	98.7	Very high	135 Å²	135	76.2 Å²	76.2	71%	0.707	40%	0.395	S	S	*	.	H	α-helix	trans	-64.3	-34.2	178.8	-63.4	179.7	0	0	0	112.7	N332 K338	N332-L334 VanDerWaalsContact C-N 3.27Å; N332-L334 PolarHBondContact O-N 3.43Å; L334-K338 WeakPolarHBondContact O-CG 3.49Å; L334-K338 PolarHBondContact O-N 3.31Å
335	M	98.6	Very high	98.7	Very high	36 Å²	36	74.5 Å²	74.5	18%	0.177	39%	0.387	C	S	.	.	H	α-helix	trans	-71.3	-42	174.6	-67.4	-60.8	-178.6	0	0	111	T319 L329 N332 Q333 K338 M339 M391	T319-M335 HydrophobicContact CG2-SD 4.13Å; L329-M335 HydrophobicContact CB-CG 4.46Å; L329-M335 HydrophobicContact CD1-CE 4.5Å; L329-M335 VanDerWaalsContact O-CG 3.29Å; L329-M335 WeakPolarHBondContact O-CG 3.34Å; N332-M335 HydrophobicContact CB-CG 4.39Å; N332-M335 WeakPolarHBondContact O-CB 3.46Å; N332-M335 PolarHBondContact O-N 2.66Å; Q333-M335 VanDerWaalsContact C-N 3.31Å; Q333-M335 PolarHBondContact O-N 3.41Å; M335-K338 PolarHBondContact O-N 2.92Å; M335-M339 HydrophobicContact CB-CE 4.43Å; M335-M339 WeakPolarHBondContact O-CG 3.38Å; M335-M339 PolarHBondContact O-N 3.47Å; M335-M339 VanDerWaalsContact O-N 3.08Å; M335-M391 HydrophobicContact SD-CB 4.25Å; M335-M391 HydrophobicContact SD-CE 4.08Å; M335-M391 HydrophobicContact SD-CG 3.82Å
336	Q	98.8	Very high	98.8	Very high	105 Å²	105	65.4 Å²	65.4	49%	0.491	35%	0.347	S	S	.	.	H	α-helix	trans	-65.3	-39	178.1	-65.7	-176.3	12.4	0	0	112.6	A330 R331 N332 Q333 M339 A340	A330-Q336 VanDerWaalsContact O-CG 3.28Å; A330-Q336 WeakPolarHBondContact O-CG 3.47Å; A330-Q336 PolarHBondContact O-NE2 2.92Å; R331-Q336 PolarHBondContact O-NE2 3.1Å; N332-Q336 PolarHBondContact O-N 2.81Å; N332-Q336 VanDerWaalsContact O-N 3.11Å; Q333-Q336 PolarHBondContact O-N 3.39Å; Q336-M339 HydrophobicContact CG-CE 4.17Å; Q336-M339 PolarHBondContact O-N 2.89Å; Q336-A340 PolarHBondContact O-N 2.95Å
337	K	98.9	Very high	98.8	Very high	121 Å²	121	63 Å²	63	53%	0.526	32%	0.318	S	S	.	.	H	α-helix	trans	-57.8	-50.2	173.6	-173.5	-164.2	176	-59.3	0	111.1	Q333 M339 A340 D341	Q333-K337 PolarHBondContact O-N 3.33Å; K337-M339 VanDerWaalsContact C-N 3.29Å; K337-M339 PolarHBondContact O-N 2.84Å; K337-A340 WeakPolarHBondContact O-CB 3.21Å; K337-A340 PolarHBondContact O-N 3.43Å; K337-A340 VanDerWaalsContact O-N 3.1Å; K337-D341 IonicContact NZ-OD1 3.44Å; K337-D341 PolarHBondContact NZ-OD1 2.94Å; K337-D341 IonicContact NZ-OD2 2.62Å; K337-D341 PolarHBondContact NZ-OD2 3.46Å; K337-D341 VanDerWaalsContact O-CG 3.3Å; K337-D341 PolarHBondContact O-N 3.37Å
338	K	98.9	Very high	98.8	Very high	51 Å²	51	66 Å²	66	22%	0.222	33%	0.332	C	S	.	.	H	α-helix	trans	-57.1	-43.8	178	-69.4	-179.1	-177.9	-143.5	0	111.5	L334 M335 A340 D341 M342 M391	L334-K338 WeakPolarHBondContact O-CG 3.49Å; L334-K338 PolarHBondContact O-N 3.31Å; M335-K338 PolarHBondContact O-N 2.92Å; K338-A340 PolarHBondContact O-N 2.95Å; K338-D341 PolarHBondContact O-N 3.5Å; K338-M342 VanDerWaalsContact O-CG 3.23Å; K338-M342 WeakPolarHBondContact O-CG 3.28Å; K338-M342 PolarHBondContact O-N 2.9Å; K338-M391 HydrophobicContact CB-SD 3.83Å; K338-M391 HydrophobicContact CD-CG 3.61Å; K338-M391 HydrophobicContact CD-SD 3.8Å; K338-M391 HydrophobicContact CG-SD 4.48Å
339	M	98.8	Very high	98.8	Very high	28 Å²	28	63.7 Å²	63.7	14%	0.138	32%	0.318	C	S	.	.	H	α-helix	trans	-64.1	-37.8	176.4	-71.6	-173.3	-79.4	0	0	112.9	F312 R316 A330 M335 Q336 K337 M342 L343 M391	F312-M339 HydrophobicContact CE2-CB 4.04Å; F312-M339 HydrophobicContact CE2-CG 4.1Å; R316-M339 HydrophobicContact CB-SD 4.08Å; R316-M339 HydrophobicContact CG-SD 3.93Å; A330-M339 HydrophobicContact CB-CE 4.15Å; M335-M339 HydrophobicContact CB-CE 4.43Å; M335-M339 WeakPolarHBondContact O-CG 3.38Å; M335-M339 PolarHBondContact O-N 3.47Å; M335-M339 VanDerWaalsContact O-N 3.08Å; Q336-M339 HydrophobicContact CG-CE 4.17Å; Q336-M339 PolarHBondContact O-N 2.89Å; K337-M339 VanDerWaalsContact C-N 3.29Å; K337-M339 PolarHBondContact O-N 2.84Å; M339-M342 PolarHBondContact O-N 3.32Å; M339-L343 WeakPolarHBondContact O-CB 3.47Å; M339-L343 PolarHBondContact O-N 3.38Å; M339-M391 HydrophobicContact CG-CE 4.07Å
340	A	98.9	Very high	98.8	Very high	50 Å²	50	63 Å²	63	41%	0.413	31%	0.314	S	S	.	.	H	α-helix	trans	-65.1	-42.4	176	0	0	0	0	0	111.9	Q336 K337 K338 T344	Q336-A340 PolarHBondContact O-N 2.95Å; K337-A340 WeakPolarHBondContact O-CB 3.21Å; K337-A340 PolarHBondContact O-N 3.43Å; K337-A340 VanDerWaalsContact O-N 3.1Å; K338-A340 PolarHBondContact O-N 2.95Å; A340-T344 WeakPolarHBondContact O-CB 3.07Å; A340-T344 PolarHBondContact O-N 3.48Å; A340-T344 PolarHBondContact O-OG1 3.02Å
341	D	98.9	Very high	98.8	Very high	76 Å²	76	64.4 Å²	64.4	41%	0.406	32%	0.319	S	S	.	.	H	α-helix	trans	-63	-46.4	176.3	-60.1	-28.4	0	0	0	110.7	K337 K338 T344 E345	K337-D341 IonicContact NZ-OD1 3.44Å; K337-D341 PolarHBondContact NZ-OD1 2.94Å; K337-D341 IonicContact NZ-OD2 2.62Å; K337-D341 PolarHBondContact NZ-OD2 3.46Å; K337-D341 VanDerWaalsContact O-CG 3.3Å; K337-D341 PolarHBondContact O-N 3.37Å; K338-D341 PolarHBondContact O-N 3.5Å; D341-T344 PolarHBondContact O-N 3.26Å; D341-E345 WeakPolarHBondContact O-CG 3.4Å; D341-E345 PolarHBondContact O-N 3.47Å; D341-E345 VanDerWaalsContact O-N 3.1Å
342	M	98.9	Very high	98.9	Very high	4 Å²	4	57.6 Å²	57.6	2%	0.02	30%	0.3	C	S	.	.	H	α-helix	trans	-58.7	-50.8	177.5	-68.1	174.7	-178.1	0	0	112.1	F312 K338 M339 T344 E345 I346 I384 Q387 A388 M391	F312-M342 HydrophobicContact CB-CB 4.28Å; F312-M342 HydrophobicContact CB-SD 4.14Å; F312-M342 HydrophobicContact CD2-CB 3.9Å; F312-M342 HydrophobicContact CD2-SD 3.82Å; F312-M342 HydrophobicContact CG-CB 4.11Å; F312-M342 HydrophobicContact CG-SD 4.39Å; K338-M342 VanDerWaalsContact O-CG 3.23Å; K338-M342 WeakPolarHBondContact O-CG 3.28Å; K338-M342 PolarHBondContact O-N 2.9Å; M339-M342 PolarHBondContact O-N 3.32Å; M342-T344 VanDerWaalsContact C-N 3.32Å; M342-T344 PolarHBondContact O-N 2.86Å; M342-E345 PolarHBondContact O-N 2.87Å; M342-I346 WeakPolarHBondContact O-CB 3.43Å; M342-I346 WeakPolarHBondContact O-CD1 3.44Å; M342-I346 VanDerWaalsContact O-CG1 3.26Å; M342-I346 WeakPolarHBondContact O-CG1 3.5Å; M342-I346 PolarHBondContact O-N 3.44Å; M342-I346 VanDerWaalsContact O-N 3.09Å; M342-I384 HydrophobicContact CB-CG1 4.4Å; M342-I384 HydrophobicContact CB-CG2 4.42Å; M342-I384 HydrophobicContact CE-CG2 4.5Å; M342-I384 HydrophobicContact CG-CB 4.39Å; M342-I384 HydrophobicContact CG-CG1 4.05Å; M342-I384 HydrophobicContact CG-CG2 3.88Å; M342-I384 HydrophobicContact SD-CG2 4.27Å; M342-Q387 HydrophobicContact CE-CB 3.56Å; M342-A388 HydrophobicContact CE-CB 3.96Å; M342-M391 HydrophobicContact CE-SD 3.6Å; M342-M391 HydrophobicContact SD-SD 4.46Å
343	L	98.9	Very high	98.9	Very high	35 Å²	35	54.3 Å²	54.3	18%	0.183	28%	0.282	C	S	.	.	H	α-helix	trans	-58.3	-45.4	179.2	174.2	60.4	0	0	0	111.5	F51 W53 F312 M339 T347	F51-L343 HydrophobicContact CE1-CD2 4.13Å; F51-L343 HydrophobicContact CZ-CD2 4.08Å; W53-L343 WeakPolarHBondContact O-CD1 3.32Å; F312-L343 HydrophobicContact CE1-CB 4.41Å; F312-L343 HydrophobicContact CE1-CD1 4.4Å; F312-L343 HydrophobicContact CZ-CB 4.28Å; M339-L343 WeakPolarHBondContact O-CB 3.47Å; M339-L343 PolarHBondContact O-N 3.38Å; L343-T347 VanDerWaalsContact O-CB 3.24Å; L343-T347 WeakPolarHBondContact O-CB 3.32Å; L343-T347 PolarHBondContact O-N 2.87Å; L343-T347 PolarHBondContact O-OG1 3.45Å
344	T	98.9	Very high	98.9	Very high	73 Å²	73	46.7 Å²	46.7	45%	0.448	25%	0.247	S	C	.	.	H	α-helix	trans	-61.1	-51.8	-177.3	-59.8	0	0	0	0	111.1	A340 D341 M342 T347 I348	A340-T344 WeakPolarHBondContact O-CB 3.07Å; A340-T344 PolarHBondContact O-N 3.48Å; A340-T344 PolarHBondContact O-OG1 3.02Å; D341-T344 PolarHBondContact O-N 3.26Å; M342-T344 VanDerWaalsContact C-N 3.32Å; M342-T344 PolarHBondContact O-N 2.86Å; T344-T347 PolarHBondContact O-N 3.3Å; T344-I348 HydrophobicContact CG2-CD1 3.81Å; T344-I348 WeakPolarHBondContact O-CG1 3.46Å; T344-I348 PolarHBondContact O-N 3.01Å
345	E	98.9	Very high	98.9	Very high	51 Å²	51	45.3 Å²	45.3	24%	0.238	24%	0.237	C	C	.	.	H	α-helix	trans	-68.8	-39.2	-175.1	-66.4	-70.4	178.9	0	0	112.3	D341 M342 G349 K380 I384	D341-E345 WeakPolarHBondContact O-CG 3.4Å; D341-E345 PolarHBondContact O-N 3.47Å; D341-E345 VanDerWaalsContact O-N 3.1Å; M342-E345 PolarHBondContact O-N 2.87Å; E345-G349 PolarHBondContact O-N 2.88Å; E345-K380 HydrophobicContact CB-CB 4.46Å; E345-K380 VanDerWaalsContact CD-NZ 3.25Å; E345-K380 HydrophobicContact CG-CD 4.17Å; E345-K380 IonicContact OE1-NZ 2.76Å; E345-K380 PolarHBondContact OE1-NZ 2.96Å; E345-K380 VanDerWaalsContact OE2-CD 3.3Å; E345-K380 WeakPolarHBondContact OE2-CD 3.38Å; E345-K380 WeakPolarHBondContact OE2-CE 3.33Å; E345-K380 IonicContact OE2-NZ 3.3Å; E345-K380 PolarHBondContact OE2-NZ 3.31Å; E345-I384 HydrophobicContact CB-CD1 4.2Å
346	I	98.9	Very high	98.9	Very high	7 Å²	7	43.8 Å²	43.8	4%	0.036	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-48.1	174	-70.5	166	0	0	0	110.3	A308 E309 F312 M342 I348 G349 L350 I384	A308-I346 HydrophobicContact CB-CD1 4.13Å; A308-I346 HydrophobicContact CB-CG1 4.02Å; E309-I346 HydrophobicContact CG-CD1 4.08Å; E309-I346 HydrophobicContact CG-CG2 3.56Å; F312-I346 HydrophobicContact CB-CD1 3.96Å; F312-I346 HydrophobicContact CD1-CD1 4.15Å; F312-I346 HydrophobicContact CG-CD1 4.36Å; M342-I346 WeakPolarHBondContact O-CB 3.43Å; M342-I346 WeakPolarHBondContact O-CD1 3.44Å; M342-I346 VanDerWaalsContact O-CG1 3.26Å; M342-I346 WeakPolarHBondContact O-CG1 3.5Å; M342-I346 PolarHBondContact O-N 3.44Å; M342-I346 VanDerWaalsContact O-N 3.09Å; I346-I348 PolarHBondContact O-N 3.48Å; I346-G349 PolarHBondContact O-N 3.41Å; I346-L350 HydrophobicContact CG2-CD1 3.79Å; I346-L350 HydrophobicContact CG2-CG 4.32Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.2Å; I346-I384 HydrophobicContact CD1-CD1 4.18Å; I346-I384 HydrophobicContact CG1-CD1 3.76Å
347	T	98.9	Very high	98.9	Very high	20 Å²	20	38.8 Å²	38.8	12%	0.123	21%	0.206	C	C	.	.	H	α-helix	trans	-63.1	-44.7	-176.1	-58.4	0	0	0	0	111.5	L57 L343 T344 L350 Q351	L57-T347 HydrophobicContact CB-CG2 3.88Å; L57-T347 HydrophobicContact CD1-CG2 3.67Å; L57-T347 HydrophobicContact CG-CG2 3.51Å; L343-T347 VanDerWaalsContact O-CB 3.24Å; L343-T347 WeakPolarHBondContact O-CB 3.32Å; L343-T347 PolarHBondContact O-N 2.87Å; L343-T347 PolarHBondContact O-OG1 3.45Å; T344-T347 PolarHBondContact O-N 3.3Å; T347-L350 PolarHBondContact O-N 3.17Å; T347-Q351 WeakPolarHBondContact O-CG 3.27Å; T347-Q351 PolarHBondContact O-N 2.91Å
348	I	98.9	Very high	98.9	Very high	93 Å²	93	36.6 Å²	36.6	48%	0.477	19%	0.194	S	C	.	.	H	α-helix	trans	-62.8	-45.1	175.3	-68	168.9	0	0	0	110.6	T344 I346 L350 Q351 A352	T344-I348 HydrophobicContact CG2-CD1 3.81Å; T344-I348 WeakPolarHBondContact O-CG1 3.46Å; T344-I348 PolarHBondContact O-N 3.01Å; I346-I348 PolarHBondContact O-N 3.48Å; I348-L350 PolarHBondContact O-N 3.41Å; I348-Q351 PolarHBondContact O-N 3.29Å; I348-A352 WeakPolarHBondContact O-CB 3.49Å; I348-A352 PolarHBondContact O-N 3.33Å
349	G	98.9	Very high	98.9	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.01	19%	0.193	C	C	.	.	H	α-helix	trans	-58.8	-45.4	178.9	0	0	0	0	0	112.8	L305 E345 I346 A352 C353	L305-G349 VanDerWaalsContact CD1-C 3.45Å; E345-G349 PolarHBondContact O-N 2.88Å; I346-G349 PolarHBondContact O-N 3.41Å; G349-A352 PolarHBondContact O-N 3.27Å; G349-C353 WeakPolarHBondContact O-CB 3.14Å; G349-C353 PolarHBondContact O-N 3.41Å; G349-C353 PolarHBondContact O-SG 2.9Å
350	L	98.9	Very high	98.9	Very high	9 Å²	9	35.8 Å²	35.8	5%	0.047	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-44.6	-179.7	-72.6	170.5	0	0	0	112.4	L59 W302 L305 E309 I346 T347 I348 A352 C353 L354	L59-L350 HydrophobicContact CD2-CB 4.31Å; L59-L350 HydrophobicContact CD2-CD1 4.3Å; L59-L350 HydrophobicContact CD2-CD2 4.37Å; W302-L350 HydrophobicContact CE3-CD2 4.2Å; W302-L350 HydrophobicContact CZ3-CD2 4.04Å; L305-L350 HydrophobicContact CB-CD2 4.22Å; L305-L350 HydrophobicContact CD1-CD2 3.97Å; L305-L350 HydrophobicContact CD1-CG 4.16Å; E309-L350 WeakPolarHBondContact OE1-CD1 3.02Å; I346-L350 HydrophobicContact CG2-CD1 3.79Å; I346-L350 HydrophobicContact CG2-CG 4.32Å; I346-L350 WeakPolarHBondContact O-CG 3.41Å; I346-L350 PolarHBondContact O-N 3.2Å; T347-L350 PolarHBondContact O-N 3.17Å; I348-L350 PolarHBondContact O-N 3.41Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 2.84Å; L350-C353 PolarHBondContact O-N 3.28Å; L350-L354 WeakPolarHBondContact O-CB 3.5Å; L350-L354 PolarHBondContact O-N 3.43Å
351	Q	98.9	Very high	98.8	Very high	42 Å²	42	36.5 Å²	36.5	20%	0.196	19%	0.189	C	C	.	.	H	α-helix	trans	-61.6	-41.6	176.1	-71.7	-61.2	-49.7	0	0	111.8	L57 Q62 T347 I348 L354 Q355	L57-Q351 HydrophobicContact CB-CG 4.18Å; L57-Q351 HydrophobicContact CD1-CG 3.78Å; Q62-Q351 VanDerWaalsContact OE1-OE1 3.14Å; T347-Q351 WeakPolarHBondContact O-CG 3.27Å; T347-Q351 PolarHBondContact O-N 2.91Å; I348-Q351 PolarHBondContact O-N 3.29Å; Q351-L354 PolarHBondContact O-N 2.92Å; Q351-Q355 PolarHBondContact O-N 3.37Å
352	A	98.9	Very high	98.8	Very high	32 Å²	32	35.4 Å²	35.4	26%	0.264	19%	0.191	S	C	.	.	H	α-helix	trans	-64.8	-43.3	176.8	0	0	0	0	0	111.7	I348 G349 L350 Q355 L356 L373	I348-A352 WeakPolarHBondContact O-CB 3.49Å; I348-A352 PolarHBondContact O-N 3.33Å; G349-A352 PolarHBondContact O-N 3.27Å; L350-A352 VanDerWaalsContact C-N 3.32Å; L350-A352 PolarHBondContact O-N 2.84Å; A352-Q355 PolarHBondContact O-N 3.09Å; A352-L356 PolarHBondContact O-N 3.03Å; A352-L373 HydrophobicContact CB-CD1 3.9Å; A352-L373 HydrophobicContact CB-CD2 3.66Å; A352-L373 HydrophobicContact CB-CG 4.48Å; A352-L373 WeakPolarHBondContact O-CD1 3.44Å
353	C	98.9	Very high	98.7	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-65.5	-39.4	178.5	-70	0	0	0	0	112.2	W302 G349 L350 L356 G357	W302-C353 HydrophobicContact CD2-CB 3.82Å; W302-C353 HydrophobicContact CG-CB 4.02Å; W302-C353 HydrophobicContact CZ2-CB 4.03Å; W302-C353 PolarHBondContact NE1-O 3.49Å; G349-C353 WeakPolarHBondContact O-CB 3.14Å; G349-C353 PolarHBondContact O-N 3.41Å; G349-C353 PolarHBondContact O-SG 2.9Å; L350-C353 PolarHBondContact O-N 3.28Å; C353-L356 PolarHBondContact O-N 2.59Å; C353-G357 PolarHBondContact O-N 3.45Å
354	L	98.9	Very high	98.7	Very high	11 Å²	11	50.2 Å²	50.2	6%	0.058	25%	0.254	C	S	.	.	H	α-helix	trans	-57.8	-52.9	171.4	177.7	68.6	0	0	0	111.1	L59 Q62 L63 V124 W302 L350 Q351 L356 G357 R358	L59-L354 HydrophobicContact CD1-CB 4.2Å; L59-L354 HydrophobicContact CD1-CD1 4.48Å; L59-L354 HydrophobicContact CD1-CD2 3.81Å; L59-L354 HydrophobicContact CD1-CG 4.38Å; Q62-L354 HydrophobicContact CB-CD2 3.62Å; Q62-L354 HydrophobicContact CG-CD2 4.27Å; L63-L354 HydrophobicContact CD2-CD1 3.96Å; V124-L354 HydrophobicContact CG1-CD1 3.73Å; V124-L354 HydrophobicContact CG2-CD1 3.97Å; W302-L354 HydrophobicContact CH2-CB 4.37Å; W302-L354 HydrophobicContact CZ2-CB 4.27Å; L350-L354 WeakPolarHBondContact O-CB 3.5Å; L350-L354 PolarHBondContact O-N 3.43Å; Q351-L354 PolarHBondContact O-N 2.92Å; L354-L356 VanDerWaalsContact C-N 3.29Å; L354-L356 PolarHBondContact O-N 2.92Å; L354-G357 PolarHBondContact O-N 3.04Å; L354-G357 VanDerWaalsContact O-N 3.1Å; L354-R358 WeakPolarHBondContact O-CG 3.28Å; L354-R358 PolarHBondContact O-N 3.35Å
355	Q	98.9	Very high	98.7	Very high	107 Å²	107	48.3 Å²	48.3	50%	0.5	25%	0.246	S	C	.	.	H	α-helix	trans	-59.5	-41.4	-179.8	176.6	57.8	14.7	0	0	111.8	Q351 A352 R358 L359	Q351-Q355 PolarHBondContact O-N 3.37Å; A352-Q355 PolarHBondContact O-N 3.09Å; Q355-R358 PolarHBondContact O-N 3.14Å; Q355-L359 HydrophobicContact CG-CD1 4.17Å; Q355-L359 VanDerWaalsContact O-CG 3.32Å; Q355-L359 WeakPolarHBondContact O-CG 3.35Å; Q355-L359 PolarHBondContact O-N 3.18Å
356	L	98.9	Very high	98.6	Very high	4 Å²	4	47.5 Å²	47.5	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-62.2	-44	175.1	179.2	58.2	0	0	0	111.6	Y298 A352 C353 L354 R358 L359 I360 A365 M369 I370 L373	Y298-L356 HydrophobicContact CD2-CD2 3.88Å; Y298-L356 HydrophobicContact CD2-CG 3.99Å; Y298-L356 HydrophobicContact CE2-CD2 4.44Å; Y298-L356 HydrophobicContact CE2-CG 4.19Å; A352-L356 PolarHBondContact O-N 3.03Å; C353-L356 PolarHBondContact O-N 2.59Å; L354-L356 VanDerWaalsContact C-N 3.29Å; L354-L356 PolarHBondContact O-N 2.92Å; L356-R358 VanDerWaalsContact C-N 3.35Å; L356-R358 PolarHBondContact O-N 3.37Å; L356-L359 PolarHBondContact O-N 2.93Å; L356-L359 VanDerWaalsContact O-N 3.14Å; L356-I360 HydrophobicContact CD1-CD1 4.28Å; L356-I360 HydrophobicContact CD1-CG1 4.21Å; L356-I360 HydrophobicContact CG-CD1 4.04Å; L356-I360 HydrophobicContact CG-CG1 4.43Å; L356-I360 WeakPolarHBondContact O-CG1 3.41Å; L356-I360 PolarHBondContact O-N 3.35Å; L356-A365 HydrophobicContact CD1-CB 3.95Å; L356-M369 HydrophobicContact CD1-CB 3.71Å; L356-M369 HydrophobicContact CD1-SD 4.43Å; L356-I370 HydrophobicContact CD1-CG1 4.32Å; L356-I370 HydrophobicContact CD2-CG1 4.01Å; L356-L373 HydrophobicContact CB-CD1 3.65Å; L356-L373 HydrophobicContact CD2-CB 4.25Å; L356-L373 HydrophobicContact CD2-CD1 3.64Å; L356-L373 HydrophobicContact CD2-CG 4.12Å; L356-L373 HydrophobicContact CG-CD1 4.28Å
357	G	98.8	Very high	98.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-56.2	-48.2	175.6	0	0	0	0	0	112.1	Y298 C353 L354 L359 I360 D361	Y298-G357 VanDerWaalsContact OH-CA 3.28Å; Y298-G357 WeakPolarHBondContact OH-CA 3.46Å; C353-G357 PolarHBondContact O-N 3.45Å; L354-G357 PolarHBondContact O-N 3.04Å; L354-G357 VanDerWaalsContact O-N 3.1Å; G357-L359 VanDerWaalsContact C-N 3.32Å; G357-L359 PolarHBondContact O-N 3.47Å; G357-I360 PolarHBondContact O-N 2.91Å; G357-I360 VanDerWaalsContact O-N 3.15Å; G357-D361 PolarHBondContact O-N 2.84Å
358	R	98.8	Very high	98.6	Very high	74 Å²	74	52.4 Å²	52.4	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-60.1	-39.3	175.3	-62	-60.3	-176.8	-146.3	-2.2	112.6	Q62 E67 V124 L354 Q355 L356 A362	Q62-R358 PolarHBondContact O-NH2 2.83Å; E67-R358 IonicContact OE1-CZ 3.55Å; E67-R358 IonicContact OE1-NH1 2.72Å; E67-R358 PolarHBondContact OE1-NH1 3.07Å; E67-R358 IonicContact OE1-NH2 3.57Å; E67-R358 IonicContact OE2-CZ 3.39Å; E67-R358 IonicContact OE2-NH1 2.68Å; E67-R358 PolarHBondContact OE2-NH1 2.88Å; E67-R358 IonicContact OE2-NH2 3.48Å; E67-R358 PolarHBondContact OE2-NH2 2.85Å; V124-R358 HydrophobicContact CG2-CG 4.32Å; L354-R358 WeakPolarHBondContact O-CG 3.28Å; L354-R358 PolarHBondContact O-N 3.35Å; Q355-R358 PolarHBondContact O-N 3.14Å; L356-R358 VanDerWaalsContact C-N 3.35Å; L356-R358 PolarHBondContact O-N 3.37Å; R358-A362 VanDerWaalsContact O-CB 3.3Å; R358-A362 WeakPolarHBondContact O-CB 3.13Å; R358-A362 PolarHBondContact O-N 3.14Å
359	L	98.8	Very high	98.6	Very high	37 Å²	37	51 Å²	51	19%	0.194	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-35.9	176.3	-72.3	170.3	0	0	0	112.4	Q355 L356 G357 A362 K363 K364 A365 M369	Q355-L359 HydrophobicContact CG-CD1 4.17Å; Q355-L359 VanDerWaalsContact O-CG 3.32Å; Q355-L359 WeakPolarHBondContact O-CG 3.35Å; Q355-L359 PolarHBondContact O-N 3.18Å; L356-L359 PolarHBondContact O-N 2.93Å; L356-L359 VanDerWaalsContact O-N 3.14Å; G357-L359 VanDerWaalsContact C-N 3.32Å; G357-L359 PolarHBondContact O-N 3.47Å; L359-A362 CarbonylContact O-C 3.55Å; L359-A362 PolarHBondContact O-N 3.43Å; L359-K363 PolarHBondContact O-N 3.38Å; L359-K363 VanDerWaalsContact O-N 3.14Å; L359-K364 HydrophobicContact CD2-CB 3.86Å; L359-K364 PolarHBondContact O-N 2.97Å; L359-A365 HydrophobicContact CB-CB 4.16Å; L359-A365 PolarHBondContact O-N 3.47Å; L359-M369 HydrophobicContact CD1-SD 3.87Å
360	I	98.4	Very high	98.6	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.128	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-48.5	175.4	-64.7	166	0	0	0	109.8	Y123 Y298 L356 G357 A362 K363 A365	Y123-I360 HydrophobicContact CD1-CB 4.44Å; Y123-I360 HydrophobicContact CD1-CD1 4.25Å; Y123-I360 HydrophobicContact CD1-CG2 3.7Å; Y123-I360 HydrophobicContact CD2-CB 4.3Å; Y123-I360 HydrophobicContact CD2-CG2 3.42Å; Y123-I360 VanDerWaalsContact CD2-CG2 3.42Å; Y123-I360 HydrophobicContact CE1-CG2 3.82Å; Y123-I360 HydrophobicContact CE2-CG2 3.55Å; Y123-I360 HydrophobicContact CG-CB 4.09Å; Y123-I360 HydrophobicContact CG-CG2 3.49Å; Y123-I360 VanDerWaalsContact CG-CG2 3.49Å; Y298-I360 HydrophobicContact CD1-CD1 4.31Å; Y298-I360 HydrophobicContact CD2-CD1 3.35Å; Y298-I360 HydrophobicContact CE2-CD1 3.71Å; Y298-I360 HydrophobicContact CG-CD1 3.68Å; L356-I360 HydrophobicContact CD1-CD1 4.28Å; L356-I360 HydrophobicContact CD1-CG1 4.21Å; L356-I360 HydrophobicContact CG-CD1 4.04Å; L356-I360 HydrophobicContact CG-CG1 4.43Å; L356-I360 WeakPolarHBondContact O-CG1 3.41Å; L356-I360 PolarHBondContact O-N 3.35Å; G357-I360 PolarHBondContact O-N 2.91Å; G357-I360 VanDerWaalsContact O-N 3.15Å; I360-A362 PolarHBondContact O-N 3.44Å; I360-K363 WeakPolarHBondContact O-CA 3.28Å; I360-K363 PolarHBondContact O-N 3.06Å; I360-A365 HydrophobicContact CB-CB 4.24Å; I360-A365 HydrophobicContact CG1-CB 3.42Å; I360-A365 VanDerWaalsContact CG1-CB 3.42Å
361	D	98.1	Very high	98.5	Very high	65 Å²	65	51.3 Å²	51.3	35%	0.348	27%	0.268	S	S	.	.	H	α-helix	trans	-57.8	-38.7	176.7	-71.2	-38.6	0	0	0	111.5	Y123 G357 K363	Y123-D361 WeakPolarHBondContact CD2-OD1 3.26Å; Y123-D361 PolarHBondContact N-OD1 3.41Å; Y123-D361 PolarHBondContact N-OD2 3.38Å; G357-D361 PolarHBondContact O-N 2.84Å; D361-K363 PolarHBondContact O-N 3.3Å
362	A	98.3	Very high	98.5	Very high	54 Å²	54	54 Å²	54	45%	0.446	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.3	1.6	175.7	0	0	0	0	0	114.6	R358 L359 I360 K364	R358-A362 VanDerWaalsContact O-CB 3.3Å; R358-A362 WeakPolarHBondContact O-CB 3.13Å; R358-A362 PolarHBondContact O-N 3.14Å; L359-A362 CarbonylContact O-C 3.55Å; L359-A362 PolarHBondContact O-N 3.43Å; I360-A362 PolarHBondContact O-N 3.44Å; A362-K364 VanDerWaalsContact C-N 3.26Å; A362-K364 HydrophobicContact CB-CD 4.24Å; A362-K364 HydrophobicContact CB-CG 4.38Å; A362-K364 PolarHBondContact O-N 2.9Å
363	K	97.6	Very high	98.5	Very high	199 Å²	199	53.1 Å²	53.1	87%	0.865	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	35	-175.6	-55	-178.5	-179.5	-180	0	114.1	L359 I360 D361	L359-K363 PolarHBondContact O-N 3.38Å; L359-K363 VanDerWaalsContact O-N 3.14Å; I360-K363 WeakPolarHBondContact O-CA 3.28Å; I360-K363 PolarHBondContact O-N 3.06Å; D361-K363 PolarHBondContact O-N 3.3Å
364	K	98.4	Very high	98.5	Very high	150 Å²	150	53.1 Å²	53.1	65%	0.652	27%	0.273	S	S	*	.			trans	-115.2	1	-179.2	-70.1	176.2	-177	-179.9	0	113.5	L359 A362	L359-K364 HydrophobicContact CD2-CB 3.86Å; L359-K364 PolarHBondContact O-N 2.97Å; A362-K364 VanDerWaalsContact C-N 3.26Å; A362-K364 HydrophobicContact CB-CD 4.24Å; A362-K364 HydrophobicContact CB-CG 4.38Å; A362-K364 PolarHBondContact O-N 2.9Å
365	A	98.1	Very high	98.5	Very high	34 Å²	34	56.4 Å²	56.4	28%	0.281	28%	0.284	S	S	.	.			trans	-79.1	133.3	178.7	0	0	0	0	0	111.8	L356 L359 I360 M369	L356-A365 HydrophobicContact CD1-CB 3.95Å; L359-A365 HydrophobicContact CB-CB 4.16Å; L359-A365 PolarHBondContact O-N 3.47Å; I360-A365 HydrophobicContact CB-CB 4.24Å; I360-A365 HydrophobicContact CG1-CB 3.42Å; I360-A365 VanDerWaalsContact CG1-CB 3.42Å; A365-M369 HydrophobicContact CB-SD 4.47Å
366	A	98	Very high	98.5	Very high	33 Å²	33	53.3 Å²	53.3	27%	0.273	27%	0.271	S	S	.	.			trans	-99.3	150.9	170.5	0	0	0	0	0	110.8	E368 M369	A366-E368 WeakPolarHBondContact CB-OE2 3.44Å; A366-E368 PolarHBondContact O-N 3.25Å; A366-E368 VanDerWaalsContact O-N 3.14Å; A366-M369 HydrophobicContact CB-CE 4.27Å; A366-M369 HydrophobicContact CB-CG 4.32Å; A366-M369 WeakPolarHBondContact O-CB 3.24Å; A366-M369 PolarHBondContact O-N 3.28Å
367	P	97.9	Very high	98.5	Very high	62 Å²	62	53.2 Å²	53.2	40%	0.403	27%	0.271	S	S	.	.	H	α-helix	trans	-54.8	-29.8	177.2	-27.5	36.4	0	0	0	114.7	M369 I370 S371	P367-M369 VanDerWaalsContact C-N 3.3Å; P367-M369 PolarHBondContact O-N 3.01Å; P367-I370 PolarHBondContact O-N 2.96Å; P367-S371 PolarHBondContact O-N 3.27Å; P367-S371 PolarHBondContact O-OG 3.14Å
368	E	98.6	Very high	98.5	Very high	68 Å²	68	53.2 Å²	53.2	32%	0.318	27%	0.271	S	S	.	.	H	α-helix	trans	-63	-37	176.1	-67.3	70.5	-158.3	0	0	111.4	A366 I370 S371 M372 L427 A430	A366-E368 WeakPolarHBondContact CB-OE2 3.44Å; A366-E368 PolarHBondContact O-N 3.25Å; A366-E368 VanDerWaalsContact O-N 3.14Å; E368-I370 VanDerWaalsContact C-N 3.32Å; E368-I370 PolarHBondContact O-N 3.47Å; E368-S371 WeakPolarHBondContact O-CB 3.48Å; E368-S371 PolarHBondContact O-N 3.46Å; E368-M372 WeakPolarHBondContact O-CB 3.29Å; E368-M372 PolarHBondContact O-N 3.33Å; E368-L427 HydrophobicContact CB-CD2 4.27Å; E368-L427 WeakPolarHBondContact O-CD2 3.45Å; E368-A430 HydrophobicContact CG-CB 3.59Å
369	M	98.8	Very high	98.5	Very high	65 Å²	65	50.2 Å²	50.2	32%	0.32	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-40.8	177.1	-55.8	177.4	-178.3	0	0	110.8	L356 L359 A365 A366 P367 M372 L373	L356-M369 HydrophobicContact CD1-CB 3.71Å; L356-M369 HydrophobicContact CD1-SD 4.43Å; L359-M369 HydrophobicContact CD1-SD 3.87Å; A365-M369 HydrophobicContact CB-SD 4.47Å; A366-M369 HydrophobicContact CB-CE 4.27Å; A366-M369 HydrophobicContact CB-CG 4.32Å; A366-M369 WeakPolarHBondContact O-CB 3.24Å; A366-M369 PolarHBondContact O-N 3.28Å; P367-M369 VanDerWaalsContact C-N 3.3Å; P367-M369 PolarHBondContact O-N 3.01Å; M369-M372 PolarHBondContact O-N 3.17Å; M369-L373 PolarHBondContact O-N 3.32Å; M369-L373 VanDerWaalsContact O-N 3.14Å
370	I	98.8	Very high	98.6	Very high	14 Å²	14	51.5 Å²	51.5	7%	0.072	27%	0.267	C	S	.	.	H	α-helix	trans	-65.6	-43.4	175.4	-60.9	167.5	0	0	0	110.2	N294 R297 L356 P367 E368 M372 L373 K374	N294-I370 HydrophobicContact CB-CD1 3.77Å; R297-I370 HydrophobicContact CB-CG2 3.49Å; R297-I370 VanDerWaalsContact CB-CG2 3.49Å; L356-I370 HydrophobicContact CD1-CG1 4.32Å; L356-I370 HydrophobicContact CD2-CG1 4.01Å; P367-I370 PolarHBondContact O-N 2.96Å; E368-I370 VanDerWaalsContact C-N 3.32Å; E368-I370 PolarHBondContact O-N 3.47Å; I370-M372 VanDerWaalsContact C-N 3.32Å; I370-M372 PolarHBondContact O-N 3.09Å; I370-L373 PolarHBondContact O-N 3.4Å; I370-K374 VanDerWaalsContact O-CB 3.28Å; I370-K374 WeakPolarHBondContact O-CB 3.32Å; I370-K374 PolarHBondContact O-N 2.91Å
371	S	98.7	Very high	98.6	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.014	26%	0.261	C	S	.	.	H	α-helix	trans	-59.5	-43.4	176.9	-69.9	0	0	0	0	112.4	P367 E368 R375 H423	P367-S371 PolarHBondContact O-N 3.27Å; P367-S371 PolarHBondContact O-OG 3.14Å; E368-S371 WeakPolarHBondContact O-CB 3.48Å; E368-S371 PolarHBondContact O-N 3.46Å; S371-R375 WeakPolarHBondContact O-CB 3.32Å; S371-R375 PolarHBondContact O-N 3.36Å; S371-H423 WeakPolarHBondContact CA-ND1 3.44Å; S371-H423 WeakPolarHBondContact CB-ND1 3.28Å; S371-H423 PolarHBondContact OG-ND1 2.98Å
372	M	98.8	Very high	98.6	Very high	98 Å²	98	47.4 Å²	47.4	48%	0.483	25%	0.245	S	C	.	.	H	α-helix	trans	-58.7	-49.5	176.2	-176.2	175.4	62.4	0	0	111.7	E368 M369 I370 N376 L427	E368-M372 WeakPolarHBondContact O-CB 3.29Å; E368-M372 PolarHBondContact O-N 3.33Å; M369-M372 PolarHBondContact O-N 3.17Å; I370-M372 VanDerWaalsContact C-N 3.32Å; I370-M372 PolarHBondContact O-N 3.09Å; M372-N376 VanDerWaalsContact O-CB 3.31Å; M372-N376 WeakPolarHBondContact O-CB 3.47Å; M372-N376 PolarHBondContact O-N 2.8Å; M372-L427 HydrophobicContact CB-CD1 4.21Å; M372-L427 HydrophobicContact CB-CD2 4.1Å
373	L	98.8	Very high	98.6	Very high	13 Å²	13	48.9 Å²	48.9	7%	0.068	25%	0.245	C	C	.	.	H	α-helix	trans	-77.8	-37.1	-175.4	-60.4	-161.9	0	0	0	113.3	A301 A352 L356 M369 I370 R375 N376 S377	A301-L373 HydrophobicContact CB-CB 4.14Å; A352-L373 HydrophobicContact CB-CD1 3.9Å; A352-L373 HydrophobicContact CB-CD2 3.66Å; A352-L373 HydrophobicContact CB-CG 4.48Å; A352-L373 WeakPolarHBondContact O-CD1 3.44Å; L356-L373 HydrophobicContact CB-CD1 3.65Å; L356-L373 HydrophobicContact CD2-CB 4.25Å; L356-L373 HydrophobicContact CD2-CD1 3.64Å; L356-L373 HydrophobicContact CD2-CG 4.12Å; L356-L373 HydrophobicContact CG-CD1 4.28Å; M369-L373 PolarHBondContact O-N 3.32Å; M369-L373 VanDerWaalsContact O-N 3.14Å; I370-L373 PolarHBondContact O-N 3.4Å; L373-R375 VanDerWaalsContact C-N 3.34Å; L373-R375 PolarHBondContact O-N 3.44Å; L373-N376 PolarHBondContact O-N 3.07Å; L373-S377 VanDerWaalsContact O-CB 3.26Å; L373-S377 WeakPolarHBondContact O-CB 3.11Å; L373-S377 PolarHBondContact O-N 3.5Å; L373-S377 PolarHBondContact O-OG 3.39Å
374	K	98.8	Very high	98.7	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	21%	0.207	C	C	.	.	H	α-helix	trans	-57.3	-51.2	172.2	-172.2	-73.3	-161.8	-169.2	0	109.9	R297 I370 C378 V413 Y416 G418 H423	R297-K374 HydrophobicContact CB-CB 4.29Å; R297-K374 HydrophobicContact CB-CG 4.05Å; R297-K374 HydrophobicContact CG-CG 4.1Å; I370-K374 VanDerWaalsContact O-CB 3.28Å; I370-K374 WeakPolarHBondContact O-CB 3.32Å; I370-K374 PolarHBondContact O-N 2.91Å; K374-C378 VanDerWaalsContact O-CB 3.26Å; K374-C378 WeakPolarHBondContact O-CB 3.26Å; K374-C378 PolarHBondContact O-N 2.91Å; K374-C378 PolarHBondContact O-SG 3.14Å; K374-V413 PolarHBondContact NZ-O 3.25Å; K374-Y416 WeakPolarHBondContact CE-O 3.16Å; K374-Y416 PolarHBondContact NZ-O 3.03Å; K374-G418 WeakPolarHBondContact CE-O 3.19Å; K374-G418 PolarHBondContact NZ-O 3.4Å; K374-H423 WeakPolarHBondContact CD-NE2 3.44Å
375	R	98.9	Very high	98.7	Very high	79 Å²	79	32.7 Å²	32.7	30%	0.298	18%	0.176	S	C	.	.	H	α-helix	trans	-57.3	-51.8	178	-177.5	-177.4	172.6	-83.3	3.9	111.5	S371 L373 G379 H420 H423	S371-R375 WeakPolarHBondContact O-CB 3.32Å; S371-R375 PolarHBondContact O-N 3.36Å; L373-R375 VanDerWaalsContact C-N 3.34Å; L373-R375 PolarHBondContact O-N 3.44Å; R375-G379 PolarHBondContact O-N 3.21Å; R375-G379 VanDerWaalsContact O-N 3.14Å; R375-H420 WeakPolarHBondContact CD-O 3.26Å; R375-H420 WeakPolarHBondContact CG-CD2 3.39Å; R375-H420 WeakPolarHBondContact CG-NE2 3.5Å; R375-H420 PolarHBondContact NE-CE1 2.98Å; R375-H420 VanDerWaalsContact NE-CE1 3.33Å; R375-H420 PolarHBondContact NE-O 3.33Å; R375-H420 PolarHBondContact NH2-CE1 2.9Å; R375-H423 HydrophobicContact CB-CB 3.83Å; R375-H423 HydrophobicContact CG-CB 4.27Å
376	N	98.9	Very high	98.8	Very high	43 Å²	43	35.7 Å²	35.7	23%	0.23	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-56.1	-176.8	-176.2	77	0	0	0	111.7	M372 L373 C378 G379 K380	M372-N376 VanDerWaalsContact O-CB 3.31Å; M372-N376 WeakPolarHBondContact O-CB 3.47Å; M372-N376 PolarHBondContact O-N 2.8Å; L373-N376 PolarHBondContact O-N 3.07Å; N376-C378 VanDerWaalsContact C-N 3.35Å; N376-C378 PolarHBondContact O-N 3.39Å; N376-G379 PolarHBondContact O-N 3.34Å; N376-K380 WeakPolarHBondContact O-CB 3.24Å; N376-K380 WeakPolarHBondContact O-CG 3.43Å; N376-K380 PolarHBondContact O-N 3.44Å
377	S	98.9	Very high	98.8	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.007	18%	0.184	C	C	.	.	H	α-helix	trans	-60.3	-43.2	-176.2	-63.8	0	0	0	0	111.9	A301 S304 L373 S381	A301-S377 WeakPolarHBondContact O-CB 3.12Å; A301-S377 PolarHBondContact O-OG 3.11Å; A301-S377 VanDerWaalsContact O-OG 3.09Å; S304-S377 VanDerWaalsContact OG-CB 3.32Å; S304-S377 WeakPolarHBondContact OG-CB 3.32Å; S304-S377 PolarHBondContact OG-O 3.09Å; L373-S377 VanDerWaalsContact O-CB 3.26Å; L373-S377 WeakPolarHBondContact O-CB 3.11Å; L373-S377 PolarHBondContact O-N 3.5Å; L373-S377 PolarHBondContact O-OG 3.39Å; S377-S381 WeakPolarHBondContact O-CB 3.21Å; S377-S381 PolarHBondContact O-N 3.46Å; S377-S381 PolarHBondContact O-OG 2.98Å
378	C	98.9	Very high	98.9	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.2	-49.8	178.3	-64.7	0	0	0	0	112.1	I300 K374 N376 S381 L382 N414	I300-C378 VanDerWaalsContact CG2-SG 3.54Å; K374-C378 VanDerWaalsContact O-CB 3.26Å; K374-C378 WeakPolarHBondContact O-CB 3.26Å; K374-C378 PolarHBondContact O-N 2.91Å; K374-C378 PolarHBondContact O-SG 3.14Å; N376-C378 VanDerWaalsContact C-N 3.35Å; N376-C378 PolarHBondContact O-N 3.39Å; C378-S381 PolarHBondContact O-N 3Å; C378-L382 WeakPolarHBondContact O-CB 3.31Å; C378-L382 PolarHBondContact O-N 3.39Å; C378-N414 HydrophobicContact CB-CB 4.42Å
379	G	98.9	Very high	98.9	Very high	11 Å²	11	35.8 Å²	35.8	11%	0.113	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-48.5	-178.9	0	0	0	0	0	112.1	R375 N376 S381 L382 D383	R375-G379 PolarHBondContact O-N 3.21Å; R375-G379 VanDerWaalsContact O-N 3.14Å; N376-G379 PolarHBondContact O-N 3.34Å; G379-S381 PolarHBondContact O-N 3.31Å; G379-L382 PolarHBondContact O-N 2.68Å; G379-D383 PolarHBondContact O-N 2.68Å
380	K	98.9	Very high	98.9	Very high	65 Å²	65	36.4 Å²	36.4	28%	0.283	17%	0.17	S	C	.	.	H	α-helix	trans	-64.4	-40.8	178.5	-63.6	-62.9	-174.2	160.3	0	112.2	E345 N376 L382 D383 I384	E345-K380 HydrophobicContact CB-CB 4.46Å; E345-K380 VanDerWaalsContact CD-NZ 3.25Å; E345-K380 HydrophobicContact CG-CD 4.17Å; E345-K380 IonicContact OE1-NZ 2.76Å; E345-K380 PolarHBondContact OE1-NZ 2.96Å; E345-K380 VanDerWaalsContact OE2-CD 3.3Å; E345-K380 WeakPolarHBondContact OE2-CD 3.38Å; E345-K380 WeakPolarHBondContact OE2-CE 3.33Å; E345-K380 IonicContact OE2-NZ 3.3Å; E345-K380 PolarHBondContact OE2-NZ 3.31Å; N376-K380 WeakPolarHBondContact O-CB 3.24Å; N376-K380 WeakPolarHBondContact O-CG 3.43Å; N376-K380 PolarHBondContact O-N 3.44Å; K380-L382 VanDerWaalsContact C-N 3.33Å; K380-L382 PolarHBondContact O-N 2.98Å; K380-D383 PolarHBondContact O-N 3.44Å; K380-I384 WeakPolarHBondContact O-CB 3.15Å; K380-I384 WeakPolarHBondContact O-CD1 3.2Å; K380-I384 WeakPolarHBondContact O-CG1 3.49Å; K380-I384 PolarHBondContact O-N 3Å
381	S	98.9	Very high	98.9	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.8	-40.3	177.6	-58.7	0	0	0	0	111.7	S304 S377 C378 G379 I384 A385	S304-S381 WeakPolarHBondContact O-CB 3.43Å; S304-S381 PolarHBondContact O-OG 3.08Å; S304-S381 PolarHBondContact OG-OG 2.71Å; S377-S381 WeakPolarHBondContact O-CB 3.21Å; S377-S381 PolarHBondContact O-N 3.46Å; S377-S381 PolarHBondContact O-OG 2.98Å; C378-S381 PolarHBondContact O-N 3Å; G379-S381 PolarHBondContact O-N 3.31Å; S381-I384 PolarHBondContact O-N 2.64Å; S381-A385 WeakPolarHBondContact O-CB 3.36Å; S381-A385 PolarHBondContact O-N 2.99Å
382	L	98.9	Very high	98.9	Very high	4 Å²	4	36.1 Å²	36.1	2%	0.021	17%	0.168	C	C	.	.	H	α-helix	trans	-63.8	-45.1	176.2	178.6	57	0	0	0	111.7	C378 G379 K380 I384 A385 R386 L410 E411 N414	C378-L382 WeakPolarHBondContact O-CB 3.31Å; C378-L382 PolarHBondContact O-N 3.39Å; G379-L382 PolarHBondContact O-N 2.68Å; K380-L382 VanDerWaalsContact C-N 3.33Å; K380-L382 PolarHBondContact O-N 2.98Å; L382-I384 VanDerWaalsContact C-N 3.34Å; L382-I384 PolarHBondContact O-N 3.37Å; L382-A385 PolarHBondContact O-N 3.12Å; L382-R386 HydrophobicContact CD1-CG 4.34Å; L382-R386 WeakPolarHBondContact O-CG 3.45Å; L382-R386 PolarHBondContact O-N 3.05Å; L382-L410 HydrophobicContact CB-CB 4.2Å; L382-L410 HydrophobicContact CD1-CB 3.83Å; L382-E411 HydrophobicContact CD1-CG 4.27Å; L382-N414 HydrophobicContact CD2-CB 4.18Å
383	D	98.9	Very high	98.9	Very high	84 Å²	84	33.6 Å²	33.6	45%	0.449	17%	0.167	S	C	.	.	H	α-helix	trans	-61.9	-42.2	176.2	-72.1	-20	0	0	0	111.8	G379 K380 R386 Q387	G379-D383 PolarHBondContact O-N 2.68Å; K380-D383 PolarHBondContact O-N 3.44Å; D383-R386 PolarHBondContact O-N 3.1Å; D383-R386 IonicContact OD1-NH1 3.61Å; D383-Q387 WeakPolarHBondContact O-CG 3.47Å; D383-Q387 PolarHBondContact O-N 3.47Å
384	I	98.9	Very high	98.9	Very high	10 Å²	10	36.1 Å²	36.1	5%	0.051	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-48.1	174.7	-72.1	166.2	0	0	0	110.9	A308 C311 M342 E345 I346 K380 S381 L382 R386 Q387 A388	A308-I384 HydrophobicContact CB-CB 4.4Å; A308-I384 HydrophobicContact CB-CD1 4.05Å; A308-I384 HydrophobicContact CB-CG2 4.1Å; C311-I384 HydrophobicContact CB-CG2 4.36Å; M342-I384 HydrophobicContact CB-CG1 4.4Å; M342-I384 HydrophobicContact CB-CG2 4.42Å; M342-I384 HydrophobicContact CE-CG2 4.5Å; M342-I384 HydrophobicContact CG-CB 4.39Å; M342-I384 HydrophobicContact CG-CG1 4.05Å; M342-I384 HydrophobicContact CG-CG2 3.88Å; M342-I384 HydrophobicContact SD-CG2 4.27Å; E345-I384 HydrophobicContact CB-CD1 4.2Å; I346-I384 HydrophobicContact CD1-CD1 4.18Å; I346-I384 HydrophobicContact CG1-CD1 3.76Å; K380-I384 WeakPolarHBondContact O-CB 3.15Å; K380-I384 WeakPolarHBondContact O-CD1 3.2Å; K380-I384 WeakPolarHBondContact O-CG1 3.49Å; K380-I384 PolarHBondContact O-N 3Å; S381-I384 PolarHBondContact O-N 2.64Å; L382-I384 VanDerWaalsContact C-N 3.34Å; L382-I384 PolarHBondContact O-N 3.37Å; I384-R386 VanDerWaalsContact C-N 3.33Å; I384-R386 PolarHBondContact O-N 3.29Å; I384-Q387 PolarHBondContact O-N 3Å; I384-A388 VanDerWaalsContact O-CB 3.32Å; I384-A388 WeakPolarHBondContact O-CB 3.46Å; I384-A388 PolarHBondContact O-N 3.34Å
385	A	98.9	Very high	98.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.5	-42.1	179.5	0	0	0	0	0	111.5	S381 L382 A388 R389 V407 L410	S381-A385 WeakPolarHBondContact O-CB 3.36Å; S381-A385 PolarHBondContact O-N 2.99Å; L382-A385 PolarHBondContact O-N 3.12Å; A385-A388 PolarHBondContact O-N 2.85Å; A385-R389 WeakPolarHBondContact O-CB 3.35Å; A385-R389 PolarHBondContact O-N 3.44Å; A385-V407 VanDerWaalsContact C-CG2 3.43Å; A385-V407 HydrophobicContact CB-CB 4.5Å; A385-V407 HydrophobicContact CB-CG2 3.74Å; A385-V407 VanDerWaalsContact O-CG2 3.28Å; A385-V407 WeakPolarHBondContact O-CG2 3.29Å; A385-L410 HydrophobicContact CB-CD1 3.72Å
386	R	98.9	Very high	98.8	Very high	97 Å²	97	34.6 Å²	34.6	37%	0.366	19%	0.194	S	C	.	.	H	α-helix	trans	-63.4	-44	176	-72.4	169.2	173.3	171.8	-6.2	111.7	L382 D383 I384 R389 D390 V407 E411	L382-R386 HydrophobicContact CD1-CG 4.34Å; L382-R386 WeakPolarHBondContact O-CG 3.45Å; L382-R386 PolarHBondContact O-N 3.05Å; D383-R386 PolarHBondContact O-N 3.1Å; D383-R386 IonicContact OD1-NH1 3.61Å; I384-R386 VanDerWaalsContact C-N 3.33Å; I384-R386 PolarHBondContact O-N 3.29Å; R386-R389 WeakPolarHBondContact O-CB 3.45Å; R386-R389 PolarHBondContact O-N 2.88Å; R386-D390 PolarHBondContact O-N 3.46Å; R386-D390 VanDerWaalsContact O-N 3.08Å; R386-V407 HydrophobicContact CG-CG1 4.01Å; R386-E411 IonicContact CZ-OE1 2.85Å; R386-E411 VanDerWaalsContact CZ-OE1 3.31Å; R386-E411 IonicContact NE-OE1 3.56Å; R386-E411 PolarHBondContact NE-OE1 2.83Å; R386-E411 VanDerWaalsContact NH2-CD 3.25Å; R386-E411 IonicContact NH2-OE1 3.72Å; R386-E411 PolarHBondContact NH2-OE1 3.11Å; R386-E411 IonicContact NH2-OE2 3.51Å; R386-E411 PolarHBondContact NH2-OE2 2.98Å
387	Q	98.9	Very high	98.8	Very high	76 Å²	76	37.9 Å²	37.9	36%	0.355	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-42.8	175.2	-72.6	-57.3	-37.9	0	0	112.1	M342 D383 I384 R389 D390 M391	M342-Q387 HydrophobicContact CE-CB 3.56Å; D383-Q387 WeakPolarHBondContact O-CG 3.47Å; D383-Q387 PolarHBondContact O-N 3.47Å; I384-Q387 PolarHBondContact O-N 3Å; Q387-R389 VanDerWaalsContact C-N 3.33Å; Q387-R389 PolarHBondContact O-N 3.28Å; Q387-D390 PolarHBondContact O-N 3.47Å; Q387-M391 VanDerWaalsContact O-CG 3.24Å; Q387-M391 WeakPolarHBondContact O-CG 3.31Å; Q387-M391 PolarHBondContact O-N 2.92Å
388	A	98.9	Very high	98.8	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-43.2	176.3	0	0	0	0	0	111	C311 A315 M342 I384 A385 D390 M391 L392 I403	C311-A388 HydrophobicContact CB-CB 3.8Å; A315-A388 HydrophobicContact CB-CB 3.89Å; M342-A388 HydrophobicContact CE-CB 3.96Å; I384-A388 VanDerWaalsContact O-CB 3.32Å; I384-A388 WeakPolarHBondContact O-CB 3.46Å; I384-A388 PolarHBondContact O-N 3.34Å; A385-A388 PolarHBondContact O-N 2.85Å; A388-D390 VanDerWaalsContact C-N 3.33Å; A388-D390 PolarHBondContact O-N 3.23Å; A388-M391 WeakPolarHBondContact O-CB 3.34Å; A388-M391 PolarHBondContact O-N 2.91Å; A388-M391 VanDerWaalsContact O-N 3.17Å; A388-L392 VanDerWaalsContact O-CD1 3.27Å; A388-L392 WeakPolarHBondContact O-CD1 3.49Å; A388-L392 PolarHBondContact O-N 3.4Å; A388-I403 HydrophobicContact CB-CD1 4.14Å; A388-I403 HydrophobicContact CB-CG2 4.01Å
389	R	98.9	Very high	98.8	Very high	89 Å²	89	41.3 Å²	41.3	34%	0.336	23%	0.232	S	C	.	.	H	α-helix	trans	-55.7	-49.7	175.5	-179.2	-74.6	-159.5	151.2	1	110.5	A385 R386 Q387 M391 L392 G396 I403 I404 V407	A385-R389 WeakPolarHBondContact O-CB 3.35Å; A385-R389 PolarHBondContact O-N 3.44Å; R386-R389 WeakPolarHBondContact O-CB 3.45Å; R386-R389 PolarHBondContact O-N 2.88Å; Q387-R389 VanDerWaalsContact C-N 3.33Å; Q387-R389 PolarHBondContact O-N 3.28Å; R389-M391 VanDerWaalsContact C-N 3.29Å; R389-M391 PolarHBondContact O-N 3.49Å; R389-L392 PolarHBondContact O-N 2.91Å; R389-G396 WeakPolarHBondContact CG-O 3.39Å; R389-I403 HydrophobicContact CB-CG2 3.8Å; R389-I404 HydrophobicContact CG-CD1 4.26Å; R389-V407 HydrophobicContact CB-CG2 3.9Å; R389-V407 HydrophobicContact CG-CG2 4.4Å
390	D	98.8	Very high	98.7	Very high	78 Å²	78	45.6 Å²	45.6	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-32.9	-179.3	-69.9	-13.3	0	0	0	112.6	R386 Q387 A388 L392 G393	R386-D390 PolarHBondContact O-N 3.46Å; R386-D390 VanDerWaalsContact O-N 3.08Å; Q387-D390 PolarHBondContact O-N 3.47Å; A388-D390 VanDerWaalsContact C-N 3.33Å; A388-D390 PolarHBondContact O-N 3.23Å; D390-L392 PolarHBondContact O-N 3.44Å; D390-G393 PolarHBondContact O-N 2.98Å; D390-G393 VanDerWaalsContact O-N 3.15Å
391	M	98.8	Very high	98.7	Very high	3 Å²	3	46.8 Å²	46.8	2%	0.015	25%	0.253	C	S	.	.	H	α-helix	trans	-63.9	-22.7	176.8	-70.8	168.4	66.5	0	0	113.4	A315 T319 M335 K338 M339 M342 Q387 A388 R389	A315-M391 HydrophobicContact CB-CB 4.48Å; A315-M391 HydrophobicContact CB-CE 4Å; A315-M391 HydrophobicContact CB-SD 4.17Å; T319-M391 HydrophobicContact CG2-CB 4.42Å; T319-M391 HydrophobicContact CG2-CE 3.88Å; M335-M391 HydrophobicContact SD-CB 4.25Å; M335-M391 HydrophobicContact SD-CE 4.08Å; M335-M391 HydrophobicContact SD-CG 3.82Å; K338-M391 HydrophobicContact CB-SD 3.83Å; K338-M391 HydrophobicContact CD-CG 3.61Å; K338-M391 HydrophobicContact CD-SD 3.8Å; K338-M391 HydrophobicContact CG-SD 4.48Å; M339-M391 HydrophobicContact CG-CE 4.07Å; M342-M391 HydrophobicContact CE-SD 3.6Å; M342-M391 HydrophobicContact SD-SD 4.46Å; Q387-M391 VanDerWaalsContact O-CG 3.24Å; Q387-M391 WeakPolarHBondContact O-CG 3.31Å; Q387-M391 PolarHBondContact O-N 2.92Å; A388-M391 WeakPolarHBondContact O-CB 3.34Å; A388-M391 PolarHBondContact O-N 2.91Å; A388-M391 VanDerWaalsContact O-N 3.17Å; R389-M391 VanDerWaalsContact C-N 3.29Å; R389-M391 PolarHBondContact O-N 3.49Å
392	L	98.8	Very high	98.7	Very high	7 Å²	7	48.6 Å²	48.6	4%	0.037	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-11.3	177.3	-87.7	67.2	0	0	0	113.4	A315 Y318 A388 R389 D390 N395 Y401 I403	A315-L392 HydrophobicContact CB-CD1 4.22Å; Y318-L392 HydrophobicContact CD1-CB 4.44Å; Y318-L392 HydrophobicContact CD1-CD1 4.01Å; Y318-L392 HydrophobicContact CD1-CG 3.76Å; Y318-L392 HydrophobicContact CD2-CG 4.2Å; Y318-L392 HydrophobicContact CE1-CB 4.22Å; Y318-L392 HydrophobicContact CE1-CG 3.98Å; Y318-L392 HydrophobicContact CE2-CG 4.4Å; Y318-L392 HydrophobicContact CG-CD1 4.14Å; Y318-L392 HydrophobicContact CG-CG 3.86Å; Y318-L392 PolarHBondContact OH-O 3.38Å; A388-L392 VanDerWaalsContact O-CD1 3.27Å; A388-L392 WeakPolarHBondContact O-CD1 3.49Å; A388-L392 PolarHBondContact O-N 3.4Å; R389-L392 PolarHBondContact O-N 2.91Å; D390-L392 PolarHBondContact O-N 3.44Å; L392-N395 PolarHBondContact O-N 3.37Å; L392-Y401 HydrophobicContact CD2-CD1 3.83Å; L392-Y401 HydrophobicContact CD2-CG 3.97Å; L392-I403 HydrophobicContact CD1-CD1 3.49Å; L392-I403 VanDerWaalsContact CD1-CD1 3.49Å; L392-I403 HydrophobicContact CD2-CD1 3.75Å; L392-I403 HydrophobicContact CG-CD1 4.28Å
393	G	98.4	Very high	98.7	Very high	44 Å²	44	48.4 Å²	48.4	45%	0.454	26%	0.26	S	S	.	.	G	3₁₀ helix	trans	60.1	-135.9	-173.7	0	0	0	0	0	111.7	D390 N395 G396	D390-G393 PolarHBondContact O-N 2.98Å; D390-G393 VanDerWaalsContact O-N 3.15Å; G393-N395 VanDerWaalsContact C-N 3.25Å; G393-N395 PolarHBondContact O-N 3.1Å; G393-G396 PolarHBondContact O-N 2.93Å
394	G	98.4	Very high	98.7	Very high	66 Å²	66	45.8 Å²	45.8	68%	0.68	25%	0.246	S	C	*	.	G	3₁₀ helix	trans	-59.2	-31	-179.1	0	0	0	0	0	114.5	G396 I397	G394-G396 PolarHBondContact O-N 2.97Å; G394-I397 WeakPolarHBondContact O-CG1 3.32Å; G394-I397 PolarHBondContact O-N 3.15Å
395	N	98.6	Very high	98.7	Very high	47 Å²	47	45.4 Å²	45.4	25%	0.251	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-67.5	-23.6	175.4	-76.4	-25.3	0	0	0	112.5	Y318 L392 G393 I397 S398 Y401	Y318-N395 PolarHBondContact OH-ND2 3.34Å; L392-N395 PolarHBondContact O-N 3.37Å; G393-N395 VanDerWaalsContact C-N 3.25Å; G393-N395 PolarHBondContact O-N 3.1Å; N395-I397 PolarHBondContact O-N 2.88Å; N395-I397 VanDerWaalsContact O-N 3.16Å; N395-S398 PolarHBondContact O-N 3.14Å; N395-S398 VanDerWaalsContact O-N 3.08Å; N395-Y401 HydrophobicContact CB-CD1 4.36Å; N395-Y401 HydrophobicContact CB-CD2 3.88Å; N395-Y401 HydrophobicContact CB-CE1 4.07Å; N395-Y401 HydrophobicContact CB-CE2 3.55Å; N395-Y401 HydrophobicContact CB-CG 4.27Å; N395-Y401 VanDerWaalsContact CG-CZ 3.47Å; N395-Y401 PolarHBondContact ND2-OH 2.99Å; N395-Y401 VanDerWaalsContact ND2-OH 3.17Å; N395-Y401 VanDerWaalsContact O-CD2 3.31Å; N395-Y401 WeakPolarHBondContact O-CD2 3.38Å
396	G	98.5	Very high	98.7	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-66.7	-13.9	-178.3	0	0	0	0	0	114	R389 G393 G394 I404	R389-G396 WeakPolarHBondContact CG-O 3.39Å; G393-G396 PolarHBondContact O-N 2.93Å; G394-G396 PolarHBondContact O-N 2.97Å; G396-I404 WeakPolarHBondContact O-CB 3.25Å
397	I	98.5	Very high	98.7	Very high	113 Å²	113	41.5 Å²	41.5	58%	0.579	23%	0.23	S	C	*	.	G	3₁₀ helix	trans	-95	-2.2	174.5	59.8	152.8	0	0	0	113.6	G394 N395	G394-I397 WeakPolarHBondContact O-CG1 3.32Å; G394-I397 PolarHBondContact O-N 3.15Å; N395-I397 PolarHBondContact O-N 2.88Å; N395-I397 VanDerWaalsContact O-N 3.16Å
398	S	98.7	Very high	98.7	Very high	40 Å²	40	40.6 Å²	40.6	28%	0.28	23%	0.227	S	C	.	.			trans	-93.3	131.8	176.2	176.6	0	0	0	0	110.6	N395 E400 Y401	N395-S398 PolarHBondContact O-N 3.14Å; N395-S398 VanDerWaalsContact O-N 3.08Å; S398-E400 PolarHBondContact O-N 3.33Å; S398-E400 WeakPolarHBondContact OG-CB 3.45Å; S398-E400 PolarHBondContact OG-N 3.24Å; S398-Y401 PolarHBondContact O-N 3.08Å; S398-Y401 VanDerWaalsContact O-N 3.14Å
399	D	98.4	Very high	98.7	Very high	33 Å²	33	40.6 Å²	40.6	18%	0.176	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-69.6	-16.3	178.5	62.3	-18.4	0	0	0	113.3	L87 R91 Y401 H402 I404	L87-D399 HydrophobicContact CD1-CB 4.25Å; L87-D399 WeakPolarHBondContact CD1-O 3.37Å; R91-D399 IonicContact CZ-OD1 2.75Å; R91-D399 IonicContact CZ-OD2 2.9Å; R91-D399 IonicContact NE-OD1 3.97Å; R91-D399 IonicContact NE-OD2 3.99Å; R91-D399 PolarHBondContact NE-OD2 2.99Å; R91-D399 IonicContact NH2-OD1 3.06Å; R91-D399 PolarHBondContact NH2-OD1 2.78Å; R91-D399 IonicContact NH2-OD2 2.68Å; R91-D399 PolarHBondContact NH2-OD2 3.14Å; R91-D399 VanDerWaalsContact NH2-OD2 3.1Å; D399-Y401 PolarHBondContact O-N 3.11Å; D399-H402 WeakPolarHBondContact O-CA 3.48Å; D399-H402 PolarHBondContact O-N 2.88Å; D399-H402 PolarHBondContact O-ND1 3.35Å; D399-I404 HydrophobicContact CB-CG2 4.25Å
400	E	98.2	Very high	98.7	Very high	101 Å²	101	36.3 Å²	36.3	47%	0.472	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-58.6	-26.6	168	-61	-64.4	157.1	0	0	112.4	L87 R91 S398	L87-E400 WeakPolarHBondContact CD2-OE2 3.4Å; R91-E400 IonicContact CZ-OE1 3.75Å; R91-E400 IonicContact NH1-OE1 3.39Å; R91-E400 IonicContact NH2-OE1 3.72Å; R91-E400 PolarHBondContact NH2-OE1 3.36Å; S398-E400 PolarHBondContact O-N 3.33Å; S398-E400 WeakPolarHBondContact OG-CB 3.45Å; S398-E400 PolarHBondContact OG-N 3.24Å
401	Y	98.5	Very high	98.7	Very high	90 Å²	90	36 Å²	36	35%	0.353	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-94.7	-0.2	175	-69.8	-93.7	0	0	0	113.1	Y318 L392 N395 S398 D399 I403	Y318-Y401 HydrophobicContact CD2-CD1 4.35Å; Y318-Y401 HydrophobicContact CD2-CE1 4.05Å; Y318-Y401 HydrophobicContact CE2-CD1 4.36Å; Y318-Y401 AromaticContact CE2-CE1 3.76Å; Y318-Y401 HydrophobicContact CE2-CE1 3.76Å; L392-Y401 HydrophobicContact CD2-CD1 3.83Å; L392-Y401 HydrophobicContact CD2-CG 3.97Å; N395-Y401 HydrophobicContact CB-CD1 4.36Å; N395-Y401 HydrophobicContact CB-CD2 3.88Å; N395-Y401 HydrophobicContact CB-CE1 4.07Å; N395-Y401 HydrophobicContact CB-CE2 3.55Å; N395-Y401 HydrophobicContact CB-CG 4.27Å; N395-Y401 VanDerWaalsContact CG-CZ 3.47Å; N395-Y401 PolarHBondContact ND2-OH 2.99Å; N395-Y401 VanDerWaalsContact ND2-OH 3.17Å; N395-Y401 VanDerWaalsContact O-CD2 3.31Å; N395-Y401 WeakPolarHBondContact O-CD2 3.38Å; S398-Y401 PolarHBondContact O-N 3.08Å; S398-Y401 VanDerWaalsContact O-N 3.14Å; D399-Y401 PolarHBondContact O-N 3.11Å; Y401-I403 PolarHBondContact O-N 3.08Å
402	H	98.7	Very high	98.7	Very high	37 Å²	37	37 Å²	37	17%	0.171	22%	0.216	C	C	.	.	S	Bend	trans	62	-23.7	174.7	-57.9	-40	0	0	0	117.8	M83 F310 D399 I404 R405 H406	M83-H402 WeakPolarHBondContact CE-CD2 3.37Å; M83-H402 WeakPolarHBondContact CE-NE2 3.5Å; F310-H402 HydrophobicContact CE1-CB 3.62Å; F310-H402 HydrophobicContact CZ-CB 3.62Å; F310-H402 AromaticContact CZ-CD2 3.95Å; D399-H402 WeakPolarHBondContact O-CA 3.48Å; D399-H402 PolarHBondContact O-N 2.88Å; D399-H402 PolarHBondContact O-ND1 3.35Å; H402-I404 PolarHBondContact O-N 3.04Å; H402-R405 WeakPolarHBondContact O-CB 3.42Å; H402-R405 PolarHBondContact O-N 3.22Å; H402-R405 VanDerWaalsContact O-N 3.17Å; H402-H406 PolarHBondContact O-CD2 3.07Å; H402-H406 PolarHBondContact O-N 3.04Å
403	I	98.7	Very high	98.7	Very high	1 Å²	1	36.7 Å²	36.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-62.9	-41.8	-175.9	-70.8	170.2	0	0	0	111.6	A314 A315 A388 R389 L392 Y401 R405 H406 V407	A314-I403 HydrophobicContact CB-CD1 3.91Å; A314-I403 HydrophobicContact CB-CG1 4.21Å; A315-I403 HydrophobicContact CB-CD1 4.43Å; A388-I403 HydrophobicContact CB-CD1 4.14Å; A388-I403 HydrophobicContact CB-CG2 4.01Å; R389-I403 HydrophobicContact CB-CG2 3.8Å; L392-I403 HydrophobicContact CD1-CD1 3.49Å; L392-I403 VanDerWaalsContact CD1-CD1 3.49Å; L392-I403 HydrophobicContact CD2-CD1 3.75Å; L392-I403 HydrophobicContact CG-CD1 4.28Å; Y401-I403 PolarHBondContact O-N 3.08Å; I403-R405 PolarHBondContact O-N 3.5Å; I403-H406 PolarHBondContact O-N 3.35Å; I403-H406 VanDerWaalsContact O-N 3.08Å; I403-V407 HydrophobicContact CG2-CG2 4.4Å; I403-V407 WeakPolarHBondContact O-CG2 3.42Å; I403-V407 PolarHBondContact O-N 3.28Å
404	I	98.9	Very high	98.7	Very high	29 Å²	29	36.1 Å²	36.1	15%	0.149	20%	0.2	C	C	.	.	H	α-helix	trans	-59.9	-36.4	177.9	-169.3	58.9	0	0	0	112.3	R389 G396 D399 H402 V407 M408	R389-I404 HydrophobicContact CG-CD1 4.26Å; G396-I404 WeakPolarHBondContact O-CB 3.25Å; D399-I404 HydrophobicContact CB-CG2 4.25Å; H402-I404 PolarHBondContact O-N 3.04Å; I404-V407 HydrophobicContact CD1-CB 4.48Å; I404-V407 PolarHBondContact O-N 3Å; I404-M408 HydrophobicContact CD1-CG 4.41Å; I404-M408 HydrophobicContact CG1-CG 4.38Å; I404-M408 HydrophobicContact CG1-SD 4.04Å; I404-M408 VanDerWaalsContact O-CG 3.24Å; I404-M408 WeakPolarHBondContact O-CG 3.38Å; I404-M408 PolarHBondContact O-N 3.42Å
405	R	98.9	Very high	98.6	Very high	2 Å²	2	37 Å²	37	1%	0.008	19%	0.193	C	C	.	.	H	α-helix	trans	-61.4	-45.4	175.2	171.4	173.6	57.9	72.6	-0.2	110.8	N90 V136 D137 H402 I403 M408 N409	N90-R405 VanDerWaalsContact CB-CD 3.46Å; N90-R405 HydrophobicContact CB-CG 4.31Å; V136-R405 PolarHBondContact O-NH1 2.79Å; D137-R405 WeakPolarHBondContact OD2-CD 3.36Å; D137-R405 IonicContact OD2-CZ 3.31Å; D137-R405 IonicContact OD2-NE 3.18Å; D137-R405 IonicContact OD2-NH1 2.67Å; D137-R405 PolarHBondContact OD2-NH1 3.31Å; H402-R405 WeakPolarHBondContact O-CB 3.42Å; H402-R405 PolarHBondContact O-N 3.22Å; H402-R405 VanDerWaalsContact O-N 3.17Å; I403-R405 PolarHBondContact O-N 3.5Å; R405-M408 PolarHBondContact O-N 3.09Å; R405-N409 VanDerWaalsContact O-CB 3.29Å; R405-N409 WeakPolarHBondContact O-CB 3.44Å; R405-N409 PolarHBondContact O-N 2.99Å; R405-N409 PolarHBondContact O-ND2 2.96Å
406	H	98.9	Very high	98.4	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.1	-40	175.3	-74.9	-73.8	0	0	0	113.1	E134 V136 A307 F310 C311 H402 I403 M408 N409 L410	E134-H406 PolarHBondContact O-CE1 2.96Å; V136-H406 PolarHBondContact O-CE1 3.04Å; V136-H406 VanDerWaalsContact O-CE1 3.28Å; V136-H406 PolarHBondContact O-NE2 3.16Å; A307-H406 WeakPolarHBondContact CB-ND1 3.3Å; F310-H406 AromaticContact CD1-CD2 3.43Å; F310-H406 VanDerWaalsContact CD1-CD2 3.43Å; F310-H406 WeakPolarHBondContact CD1-CD2 3.27Å; F310-H406 AromaticContact CD1-NE2 3.45Å; F310-H406 WeakPolarHBondContact CD1-NE2 3.28Å; F310-H406 AromaticContact CE1-CD2 3.78Å; F310-H406 AromaticContact CE1-NE2 3.86Å; F310-H406 AromaticContact CG-NE2 3.76Å; C311-H406 VanDerWaalsContact SG-CB 3.58Å; H402-H406 PolarHBondContact O-CD2 3.07Å; H402-H406 PolarHBondContact O-N 3.04Å; I403-H406 PolarHBondContact O-N 3.35Å; I403-H406 VanDerWaalsContact O-N 3.08Å; H406-M408 PolarHBondContact O-N 3.48Å; H406-N409 PolarHBondContact O-N 3.4Å; H406-L410 WeakPolarHBondContact O-CB 3.47Å; H406-L410 WeakPolarHBondContact O-CD1 3.32Å; H406-L410 VanDerWaalsContact O-CG 3.26Å; H406-L410 WeakPolarHBondContact O-CG 3.39Å; H406-L410 PolarHBondContact O-N 3.01Å
407	V	98.9	Very high	98	Very high	15 Å²	15	38.5 Å²	38.5	9%	0.091	20%	0.196	C	C	.	.	H	α-helix	trans	-54.8	-55.4	173.4	173.8	0	0	0	0	109.9	A385 R386 R389 I403 I404 N409 L410 E411	A385-V407 VanDerWaalsContact C-CG2 3.43Å; A385-V407 HydrophobicContact CB-CB 4.5Å; A385-V407 HydrophobicContact CB-CG2 3.74Å; A385-V407 VanDerWaalsContact O-CG2 3.28Å; A385-V407 WeakPolarHBondContact O-CG2 3.29Å; R386-V407 HydrophobicContact CG-CG1 4.01Å; R389-V407 HydrophobicContact CB-CG2 3.9Å; R389-V407 HydrophobicContact CG-CG2 4.4Å; I403-V407 HydrophobicContact CG2-CG2 4.4Å; I403-V407 WeakPolarHBondContact O-CG2 3.42Å; I403-V407 PolarHBondContact O-N 3.28Å; I404-V407 HydrophobicContact CD1-CB 4.48Å; I404-V407 PolarHBondContact O-N 3Å; V407-N409 VanDerWaalsContact C-N 3.34Å; V407-N409 PolarHBondContact O-N 3.33Å; V407-L410 PolarHBondContact O-N 2.9Å; V407-E411 PolarHBondContact O-N 3.37Å
408	M	98.9	Very high	97.8	Very high	56 Å²	56	34 Å²	34	28%	0.276	18%	0.177	S	C	.	.	H	α-helix	trans	-62.3	-41.9	-176.4	-66	175.2	79.4	0	0	111.8	F257 S258 I404 R405 H406 E411	F257-M408 HydrophobicContact CB-CE 3.59Å; F257-M408 HydrophobicContact CD1-CE 3.49Å; F257-M408 VanDerWaalsContact CD1-CE 3.49Å; F257-M408 HydrophobicContact CG-CE 3.98Å; F257-M408 WeakPolarHBondContact O-CB 3.49Å; F257-M408 WeakPolarHBondContact O-CE 3.49Å; S258-M408 WeakPolarHBondContact CB-O 3.08Å; S258-M408 PolarHBondContact OG-O 3.4Å; I404-M408 HydrophobicContact CD1-CG 4.41Å; I404-M408 HydrophobicContact CG1-CG 4.38Å; I404-M408 HydrophobicContact CG1-SD 4.04Å; I404-M408 VanDerWaalsContact O-CG 3.24Å; I404-M408 WeakPolarHBondContact O-CG 3.38Å; I404-M408 PolarHBondContact O-N 3.42Å; R405-M408 PolarHBondContact O-N 3.09Å; H406-M408 PolarHBondContact O-N 3.48Å; M408-E411 WeakPolarHBondContact O-CB 3.46Å; M408-E411 PolarHBondContact O-N 3.15Å
409	N	98.9	Very high	97.8	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-60.4	-46.6	175.5	-78.2	-12.8	0	0	0	112.6	D137 S258 L259 R405 H406 V407 E411 A412 V413	D137-N409 PolarHBondContact OD1-ND2 3.01Å; D137-N409 PolarHBondContact OD2-ND2 2.77Å; S258-N409 VanDerWaalsContact OG-CA 3.3Å; S258-N409 WeakPolarHBondContact OG-CA 3.23Å; S258-N409 PolarHBondContact OG-O 3.37Å; L259-N409 VanDerWaalsContact CA-OD1 3.31Å; L259-N409 WeakPolarHBondContact CA-OD1 3.26Å; L259-N409 HydrophobicContact CD2-CB 3.96Å; L259-N409 PolarHBondContact N-OD1 3.32Å; R405-N409 VanDerWaalsContact O-CB 3.29Å; R405-N409 WeakPolarHBondContact O-CB 3.44Å; R405-N409 PolarHBondContact O-N 2.99Å; R405-N409 PolarHBondContact O-ND2 2.96Å; H406-N409 PolarHBondContact O-N 3.4Å; V407-N409 VanDerWaalsContact C-N 3.34Å; V407-N409 PolarHBondContact O-N 3.33Å; N409-E411 PolarHBondContact O-N 3.3Å; N409-A412 PolarHBondContact O-N 2.76Å; N409-A412 VanDerWaalsContact O-N 3.11Å; N409-V413 WeakPolarHBondContact O-CG2 3.37Å; N409-V413 PolarHBondContact O-N 2.91Å
410	L	98.9	Very high	97.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-67.1	-22.8	-177.4	-73.1	166.9	0	0	0	112.9	A307 L382 A385 H406 V407 V413 N414	A307-L410 HydrophobicContact CB-CD1 4.24Å; A307-L410 HydrophobicContact CB-CD2 4.41Å; L382-L410 HydrophobicContact CB-CB 4.2Å; L382-L410 HydrophobicContact CD1-CB 3.83Å; A385-L410 HydrophobicContact CB-CD1 3.72Å; H406-L410 WeakPolarHBondContact O-CB 3.47Å; H406-L410 WeakPolarHBondContact O-CD1 3.32Å; H406-L410 VanDerWaalsContact O-CG 3.26Å; H406-L410 WeakPolarHBondContact O-CG 3.39Å; H406-L410 PolarHBondContact O-N 3.01Å; V407-L410 PolarHBondContact O-N 2.9Å; L410-V413 HydrophobicContact CD2-CB 4.37Å; L410-V413 PolarHBondContact O-N 3.07Å; L410-N414 VanDerWaalsContact O-CB 3.31Å; L410-N414 WeakPolarHBondContact O-CB 3.44Å; L410-N414 PolarHBondContact O-N 3.48Å
411	E	98.8	Very high	97.8	Very high	72 Å²	72	35.1 Å²	35.1	34%	0.336	18%	0.183	S	C	.	.	H	α-helix	trans	-57.5	-48.4	169.1	-62.3	-66.6	171.3	0	0	111.1	L382 R386 V407 M408 N409 T415	L382-E411 HydrophobicContact CD1-CG 4.27Å; R386-E411 IonicContact CZ-OE1 2.85Å; R386-E411 VanDerWaalsContact CZ-OE1 3.31Å; R386-E411 IonicContact NE-OE1 3.56Å; R386-E411 PolarHBondContact NE-OE1 2.83Å; R386-E411 VanDerWaalsContact NH2-CD 3.25Å; R386-E411 IonicContact NH2-OE1 3.72Å; R386-E411 PolarHBondContact NH2-OE1 3.11Å; R386-E411 IonicContact NH2-OE2 3.51Å; R386-E411 PolarHBondContact NH2-OE2 2.98Å; V407-E411 PolarHBondContact O-N 3.37Å; M408-E411 WeakPolarHBondContact O-CB 3.46Å; M408-E411 PolarHBondContact O-N 3.15Å; N409-E411 PolarHBondContact O-N 3.3Å; E411-T415 PolarHBondContact O-N 2.82Å; E411-T415 PolarHBondContact O-OG1 3.39Å
412	A	98.6	Very high	97.8	Very high	24 Å²	24	32.5 Å²	32.5	20%	0.198	18%	0.175	C	C	.	.	H	α-helix	trans	-68.8	-41.5	177.3	0	0	0	0	0	111.8	S258 L259 N409 N414 T415 Y416	S258-A412 WeakPolarHBondContact OG-CB 3.2Å; L259-A412 HydrophobicContact CD1-CB 3.83Å; L259-A412 HydrophobicContact CG-CB 3.97Å; N409-A412 PolarHBondContact O-N 2.76Å; N409-A412 VanDerWaalsContact O-N 3.11Å; A412-N414 PolarHBondContact O-N 3.31Å; A412-T415 WeakPolarHBondContact O-CA 3.45Å; A412-T415 WeakPolarHBondContact O-CB 3.4Å; A412-T415 PolarHBondContact O-N 3.22Å; A412-Y416 HydrophobicContact CB-CD1 4.31Å; A412-Y416 WeakPolarHBondContact O-CD1 3.3Å; A412-Y416 PolarHBondContact O-N 3.06Å
413	V	98.6	Very high	97.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-60	-35.1	179.3	-179.2	0	0	0	0	112	L259 I300 K374 N409 L410 T415 Y416	L259-V413 HydrophobicContact CD2-CG2 4.28Å; I300-V413 HydrophobicContact CG2-CG1 3.61Å; K374-V413 PolarHBondContact NZ-O 3.25Å; N409-V413 WeakPolarHBondContact O-CG2 3.37Å; N409-V413 PolarHBondContact O-N 2.91Å; L410-V413 HydrophobicContact CD2-CB 4.37Å; L410-V413 PolarHBondContact O-N 3.07Å; V413-T415 PolarHBondContact O-N 3Å; V413-Y416 VanDerWaalsContact CA-CE1 3.42Å; V413-Y416 HydrophobicContact CB-CE1 4.14Å; V413-Y416 HydrophobicContact CG2-CE1 3.85Å
414	N	98.6	Very high	97.8	Very high	31 Å²	31	32.3 Å²	32.3	17%	0.166	18%	0.18	C	C	.	.	H	α-helix	trans	-69.7	-22.8	175.1	-166.2	51.7	0	0	0	113	C378 L382 L410 A412	C378-N414 HydrophobicContact CB-CB 4.42Å; L382-N414 HydrophobicContact CD2-CB 4.18Å; L410-N414 VanDerWaalsContact O-CB 3.31Å; L410-N414 WeakPolarHBondContact O-CB 3.44Å; L410-N414 PolarHBondContact O-N 3.48Å; A412-N414 PolarHBondContact O-N 3.31Å
415	T	97.2	Very high	97.7	Very high	86 Å²	86	33.8 Å²	33.8	53%	0.528	19%	0.188	S	C	.	.	H	α-helix	trans	-94.1	-51.9	-177.5	-59.1	0	0	0	0	113.5	E411 A412 V413 G418 T419	E411-T415 PolarHBondContact O-N 2.82Å; E411-T415 PolarHBondContact O-OG1 3.39Å; A412-T415 WeakPolarHBondContact O-CA 3.45Å; A412-T415 WeakPolarHBondContact O-CB 3.4Å; A412-T415 PolarHBondContact O-N 3.22Å; V413-T415 PolarHBondContact O-N 3Å; T415-G418 CarbonylContact O-C 3.53Å; T415-T419 HydrophobicContact CG2-CG2 4.31Å; T415-T419 PolarHBondContact O-N 3.06Å
416	Y	93.1	Very high	97.7	Very high	51 Å²	51	34.9 Å²	34.9	20%	0.2	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.2	165	-172	77.7	-107.7	0	0	0	111.9	R141 L259 I300 K374 A412 V413 G418	R141-Y416 PolarHBondContact NH1-OH 3.26Å; R141-Y416 PolarHBondContact NH2-OH 3.17Å; L259-Y416 HydrophobicContact CD1-CD1 4.24Å; L259-Y416 HydrophobicContact CD1-CE1 3.79Å; I300-Y416 HydrophobicContact CD1-CD2 4.46Å; I300-Y416 HydrophobicContact CD1-CE2 3.47Å; I300-Y416 VanDerWaalsContact CD1-CE2 3.47Å; K374-Y416 WeakPolarHBondContact CE-O 3.16Å; K374-Y416 PolarHBondContact NZ-O 3.03Å; A412-Y416 HydrophobicContact CB-CD1 4.31Å; A412-Y416 WeakPolarHBondContact O-CD1 3.3Å; A412-Y416 PolarHBondContact O-N 3.06Å; V413-Y416 VanDerWaalsContact CA-CE1 3.42Å; V413-Y416 HydrophobicContact CB-CE1 4.14Å; V413-Y416 HydrophobicContact CG2-CE1 3.85Å; Y416-G418 PolarHBondContact O-N 3.4Å
417	E	91.2	Very high	97.7	Very high	28 Å²	28	36.5 Å²	36.5	13%	0.131	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.3	28.6	-175.4	-81	176.6	-136.5	0	0	113.4	L293 A296 R297 I300 H423	L293-E417 HydrophobicContact CD2-CG 3.89Å; A296-E417 WeakPolarHBondContact CB-OE2 3.5Å; R297-E417 HydrophobicContact CG-CB 4.17Å; R297-E417 VanDerWaalsContact CZ-O 3.26Å; R297-E417 PolarHBondContact N-OE2 2.8Å; R297-E417 PolarHBondContact NE-O 3.32Å; R297-E417 PolarHBondContact NH2-O 2.93Å; I300-E417 HydrophobicContact CD1-CB 4.26Å; I300-E417 HydrophobicContact CD1-CG 4.35Å; I300-E417 WeakPolarHBondContact CD1-OE2 3.48Å; E417-H423 PolarHBondContact O-NE2 3.31Å
418	G	94.2	Very high	97.7	Very high	18 Å²	18	37.1 Å²	37.1	19%	0.186	21%	0.212	C	C	.	.	S	Bend	trans	104.4	117.8	-178.3	0	0	0	0	0	110.6	K374 T415 Y416 H423	K374-G418 WeakPolarHBondContact CE-O 3.19Å; K374-G418 PolarHBondContact NZ-O 3.4Å; T415-G418 CarbonylContact O-C 3.53Å; Y416-G418 PolarHBondContact O-N 3.4Å; G418-H423 PolarHBondContact O-CD2 2.67Å; G418-H423 VanDerWaalsContact O-CD2 3.27Å; G418-H423 PolarHBondContact O-NE2 3.33Å
419	T	97.8	Very high	97.6	Very high	39 Å²	39	39.7 Å²	39.7	24%	0.239	22%	0.218	C	C	.	.			trans	-66.1	160.9	-178.7	67.3	0	0	0	0	111.1	T415 D421 I422 H423	T415-T419 HydrophobicContact CG2-CG2 4.31Å; T415-T419 PolarHBondContact O-N 3.06Å; T419-D421 PolarHBondContact O-N 3.22Å; T419-I422 PolarHBondContact O-N 3.45Å; T419-I422 VanDerWaalsContact O-N 3.17Å; T419-I422 VanDerWaalsContact OG1-CG1 3.27Å; T419-I422 WeakPolarHBondContact OG1-CG1 3.3Å; T419-I422 PolarHBondContact OG1-N 3.03Å; T419-H423 PolarHBondContact O-CD2 3.01Å; T419-H423 PolarHBondContact O-N 3.04Å
420	H	98.4	Very high	97.6	Very high	47 Å²	47	42.5 Å²	42.5	22%	0.218	24%	0.241	C	C	.	.	H	α-helix	trans	-50.5	-38.8	174.5	-174.9	-89.2	0	0	0	112.8	R375 A424	R375-H420 WeakPolarHBondContact CD-O 3.26Å; R375-H420 WeakPolarHBondContact CG-CD2 3.39Å; R375-H420 WeakPolarHBondContact CG-NE2 3.5Å; R375-H420 PolarHBondContact NE-CE1 2.98Å; R375-H420 VanDerWaalsContact NE-CE1 3.33Å; R375-H420 PolarHBondContact NE-O 3.33Å; R375-H420 PolarHBondContact NH2-CE1 2.9Å; H420-A424 PolarHBondContact O-N 3.47Å; H420-A424 VanDerWaalsContact O-N 3.15Å
421	D	98.4	Very high	97.6	Very high	111 Å²	111	49.3 Å²	49.3	59%	0.594	28%	0.276	S	S	*	.	H	α-helix	trans	-78.5	-37.3	-179.9	-60	-30.8	0	0	0	112.8	T419 H423 A424 L425	T419-D421 PolarHBondContact O-N 3.22Å; D421-H423 VanDerWaalsContact C-N 3.28Å; D421-H423 PolarHBondContact O-N 3.36Å; D421-A424 WeakPolarHBondContact O-CA 3.23Å; D421-A424 VanDerWaalsContact O-CB 3.3Å; D421-A424 WeakPolarHBondContact O-CB 3.44Å; D421-A424 PolarHBondContact O-N 3.24Å; D421-L425 WeakPolarHBondContact O-CG 3.33Å; D421-L425 PolarHBondContact O-N 3.11Å
422	I	98.3	Very high	97.5	Very high	35 Å²	35	49.9 Å²	49.9	18%	0.179	29%	0.285	C	S	.	.	H	α-helix	trans	-60.4	-41.5	173.6	-71.2	-67.6	0	0	0	110.6	T419 A424 L425 I426 F437	T419-I422 PolarHBondContact O-N 3.45Å; T419-I422 VanDerWaalsContact O-N 3.17Å; T419-I422 VanDerWaalsContact OG1-CG1 3.27Å; T419-I422 WeakPolarHBondContact OG1-CG1 3.3Å; T419-I422 PolarHBondContact OG1-N 3.03Å; I422-A424 VanDerWaalsContact C-N 3.31Å; I422-A424 PolarHBondContact O-N 3.1Å; I422-L425 PolarHBondContact O-N 3.49Å; I422-I426 HydrophobicContact CG2-CD1 4.19Å; I422-I426 WeakPolarHBondContact O-CG1 3.16Å; I422-I426 PolarHBondContact O-N 2.73Å; I422-F437 HydrophobicContact CD1-CD1 4.3Å; I422-F437 HydrophobicContact CG2-CE1 4.5Å
423	H	98.6	Very high	97.5	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-65.4	-33.4	173	-75.2	-64.3	0	0	0	112.8	S371 K374 R375 E417 G418 T419 D421 I426 L427	S371-H423 WeakPolarHBondContact CA-ND1 3.44Å; S371-H423 WeakPolarHBondContact CB-ND1 3.28Å; S371-H423 PolarHBondContact OG-ND1 2.98Å; K374-H423 WeakPolarHBondContact CD-NE2 3.44Å; R375-H423 HydrophobicContact CB-CB 3.83Å; R375-H423 HydrophobicContact CG-CB 4.27Å; E417-H423 PolarHBondContact O-NE2 3.31Å; G418-H423 PolarHBondContact O-CD2 2.67Å; G418-H423 VanDerWaalsContact O-CD2 3.27Å; G418-H423 PolarHBondContact O-NE2 3.33Å; T419-H423 PolarHBondContact O-CD2 3.01Å; T419-H423 PolarHBondContact O-N 3.04Å; D421-H423 VanDerWaalsContact C-N 3.28Å; D421-H423 PolarHBondContact O-N 3.36Å; H423-I426 PolarHBondContact O-N 3.02Å; H423-L427 VanDerWaalsContact O-CG 3.31Å; H423-L427 WeakPolarHBondContact O-CG 3.24Å; H423-L427 PolarHBondContact O-N 3.06Å; H423-L427 VanDerWaalsContact O-N 3.09Å
424	A	98.7	Very high	97.4	Very high	34 Å²	34	57.8 Å²	57.8	28%	0.281	34%	0.338	S	S	.	.	H	α-helix	trans	-63.1	-42	172.8	0	0	0	0	0	111.6	H420 D421 I422 L427 G428	H420-A424 PolarHBondContact O-N 3.47Å; H420-A424 VanDerWaalsContact O-N 3.15Å; D421-A424 WeakPolarHBondContact O-CA 3.23Å; D421-A424 VanDerWaalsContact O-CB 3.3Å; D421-A424 WeakPolarHBondContact O-CB 3.44Å; D421-A424 PolarHBondContact O-N 3.24Å; I422-A424 VanDerWaalsContact C-N 3.31Å; I422-A424 PolarHBondContact O-N 3.1Å; A424-L427 PolarHBondContact O-N 3.21Å; A424-G428 PolarHBondContact O-N 2.62Å
425	L	98.3	Very high	97.2	Very high	60 Å²	60	59.2 Å²	59.2	31%	0.314	34%	0.344	S	S	.	.	H	α-helix	trans	-67.8	-35.8	176.6	-64.1	178	0	0	0	112.7	D421 I422 L427 G428 R429 F437	D421-L425 WeakPolarHBondContact O-CG 3.33Å; D421-L425 PolarHBondContact O-N 3.11Å; I422-L425 PolarHBondContact O-N 3.49Å; L425-L427 VanDerWaalsContact C-N 3.35Å; L425-G428 PolarHBondContact O-N 3.44Å; L425-R429 WeakPolarHBondContact O-CB 3.43Å; L425-R429 PolarHBondContact O-N 3.09Å; L425-F437 HydrophobicContact CB-CD1 3.91Å; L425-F437 HydrophobicContact CB-CE1 3.49Å; L425-F437 VanDerWaalsContact CB-CE1 3.49Å; L425-F437 HydrophobicContact CB-CZ 3.87Å; L425-F437 HydrophobicContact CD1-CD1 3.96Å; L425-F437 HydrophobicContact CD1-CE1 4.34Å
426	I	98	Very high	97.2	Very high	25 Å²	25	59.2 Å²	59.2	13%	0.128	35%	0.347	C	S	.	.	H	α-helix	trans	-58.7	-48.5	171.9	-69.9	167.2	0	0	0	110.3	I422 H423 R429 A430 F437	I422-I426 HydrophobicContact CG2-CD1 4.19Å; I422-I426 WeakPolarHBondContact O-CG1 3.16Å; I422-I426 PolarHBondContact O-N 2.73Å; H423-I426 PolarHBondContact O-N 3.02Å; I426-R429 PolarHBondContact O-N 3.32Å; I426-A430 PolarHBondContact O-N 3.1Å; I426-A430 VanDerWaalsContact O-N 3.07Å; I426-F437 HydrophobicContact CB-CZ 4.43Å; I426-F437 HydrophobicContact CG1-CE1 4.08Å; I426-F437 HydrophobicContact CG1-CZ 3.72Å
427	L	98.7	Very high	97.2	Very high	35 Å²	35	60.3 Å²	60.3	18%	0.183	35%	0.353	C	S	.	.	H	α-helix	trans	-66.9	-41.3	178	-64.1	171.2	0	0	0	111.6	E368 M372 H423 A424 L425 R429 A430 I431	E368-L427 HydrophobicContact CB-CD2 4.27Å; E368-L427 WeakPolarHBondContact O-CD2 3.45Å; M372-L427 HydrophobicContact CB-CD1 4.21Å; M372-L427 HydrophobicContact CB-CD2 4.1Å; H423-L427 VanDerWaalsContact O-CG 3.31Å; H423-L427 WeakPolarHBondContact O-CG 3.24Å; H423-L427 PolarHBondContact O-N 3.06Å; H423-L427 VanDerWaalsContact O-N 3.09Å; A424-L427 PolarHBondContact O-N 3.21Å; L425-L427 VanDerWaalsContact C-N 3.35Å; L427-R429 VanDerWaalsContact C-N 3.32Å; L427-R429 PolarHBondContact O-N 3.13Å; L427-A430 WeakPolarHBondContact O-CB 3.36Å; L427-A430 PolarHBondContact O-N 3.07Å; L427-A430 VanDerWaalsContact O-N 3.09Å; L427-I431 WeakPolarHBondContact O-CD1 3.48Å; L427-I431 VanDerWaalsContact O-CG1 3.26Å; L427-I431 WeakPolarHBondContact O-CG1 3.33Å; L427-I431 PolarHBondContact O-N 2.87Å
428	G	98.6	Very high	97.2	Very high	28 Å²	28	63.1 Å²	63.1	29%	0.289	37%	0.372	S	S	.	.	H	α-helix	trans	-56.1	-46	175.5	0	0	0	0	0	111.9	A424 L425 A430 I431 T432	A424-G428 PolarHBondContact O-N 2.62Å; L425-G428 PolarHBondContact O-N 3.44Å; G428-A430 PolarHBondContact O-N 3.01Å; G428-I431 PolarHBondContact O-N 2.97Å; G428-T432 WeakPolarHBondContact O-CB 3.5Å; G428-T432 WeakPolarHBondContact O-CG2 3.28Å; G428-T432 PolarHBondContact O-N 3.47Å; G428-T432 PolarHBondContact O-OG1 3.23Å
429	R	98.3	Very high	96.8	Very high	110 Å²	110	69.1 Å²	69.1	42%	0.415	41%	0.405	S	S	.	.	H	α-helix	trans	-62.6	-40.6	174.1	-177	179.8	65.3	-169.2	0.5	112.4	L425 I426 L427 I431 G433 L434 F437	L425-R429 WeakPolarHBondContact O-CB 3.43Å; L425-R429 PolarHBondContact O-N 3.09Å; I426-R429 PolarHBondContact O-N 3.32Å; L427-R429 VanDerWaalsContact C-N 3.32Å; L427-R429 PolarHBondContact O-N 3.13Å; R429-I431 VanDerWaalsContact C-N 3.32Å; R429-I431 PolarHBondContact O-N 2.93Å; R429-G433 VanDerWaalsContact O-CA 3.23Å; R429-G433 WeakPolarHBondContact O-CA 3.39Å; R429-G433 PolarHBondContact O-N 3.2Å; R429-L434 VanDerWaalsContact CA-O 3.32Å; R429-L434 WeakPolarHBondContact CA-O 3.45Å; R429-F437 HydrophobicContact CB-CE2 4.49Å
430	A	98.3	Very high	95.5	Very high	58 Å²	58	73.3 Å²	73.3	48%	0.479	43%	0.426	S	S	.	.	H	α-helix	trans	-67.1	-32.5	178.2	0	0	0	0	0	113.1	E368 I426 L427 G428	E368-A430 HydrophobicContact CG-CB 3.59Å; I426-A430 PolarHBondContact O-N 3.1Å; I426-A430 VanDerWaalsContact O-N 3.07Å; L427-A430 WeakPolarHBondContact O-CB 3.36Å; L427-A430 PolarHBondContact O-N 3.07Å; L427-A430 VanDerWaalsContact O-N 3.09Å; G428-A430 PolarHBondContact O-N 3.01Å
431	I	98.5	Very high	93.2	Very high	144 Å²	144	81.6 Å²	81.6	74%	0.738	47%	0.472	S	S	*	.	H	α-helix	trans	-77.3	-42.7	178.6	-67.9	162.4	0	0	0	111.3	L427 G428 R429	L427-I431 WeakPolarHBondContact O-CD1 3.48Å; L427-I431 VanDerWaalsContact O-CG1 3.26Å; L427-I431 WeakPolarHBondContact O-CG1 3.33Å; L427-I431 PolarHBondContact O-N 2.87Å; G428-I431 PolarHBondContact O-N 2.97Å; R429-I431 VanDerWaalsContact C-N 3.32Å; R429-I431 PolarHBondContact O-N 2.93Å
432	T	98.2	Very high	93	Very high	84 Å²	84	80.2 Å²	80.2	52%	0.515	47%	0.466	S	S	.	.	H	α-helix	trans	-99.7	-18.5	-170.5	66.9	0	0	0	0	114	G428 L434	G428-T432 WeakPolarHBondContact O-CB 3.5Å; G428-T432 WeakPolarHBondContact O-CG2 3.28Å; G428-T432 PolarHBondContact O-N 3.47Å; G428-T432 PolarHBondContact O-OG1 3.23Å; T432-L434 PolarHBondContact O-N 2.78Å; T432-L434 PolarHBondContact OG1-N 2.87Å; T432-L434 VanDerWaalsContact OG1-N 3.11Å; T432-L434 PolarHBondContact OG1-O 2.87Å
433	G	97.1	Very high	92.7	Very high	64 Å²	64	82.5 Å²	82.5	66%	0.66	48%	0.481	S	S	*	.	S	Bend	trans	74.6	0.9	-168.2	0	0	0	0	0	114.3	R429	R429-G433 VanDerWaalsContact O-CA 3.23Å; R429-G433 WeakPolarHBondContact O-CA 3.39Å; R429-G433 PolarHBondContact O-N 3.2Å
434	L	96.4	Very high	92.4	Very high	125 Å²	125	87.1 Å²	87.1	65%	0.654	51%	0.508	S	S	*	.			trans	-111.9	131.1	-174.6	-57.9	176.8	0	0	0	111.1	R429 T432	R429-L434 VanDerWaalsContact CA-O 3.32Å; R429-L434 WeakPolarHBondContact CA-O 3.45Å; T432-L434 PolarHBondContact O-N 2.78Å; T432-L434 PolarHBondContact OG1-N 2.87Å; T432-L434 VanDerWaalsContact OG1-N 3.11Å; T432-L434 PolarHBondContact OG1-O 2.87Å
435	Q	95.7	Very high	92	Very high	62 Å²	62	90.2 Å²	90.2	29%	0.29	52%	0.521	S	S	.	.			trans	-75.1	142.2	175.3	76.6	83.8	-4.9	0	0	110.6	F437 T438 N440	Q435-F437 HydrophobicContact CB-CD2 4.39Å; Q435-T438 PolarHBondContact NE2-OG1 3.08Å; Q435-N440 PolarHBondContact NE2-O 3.05Å
436	S	96.4	Very high	91.6	Very high	85 Å²	85	92.1 Å²	92.1	59%	0.594	53%	0.534	S	S	*	.			trans	-139	33.3	173.8	-163.2	0	0	0	0	111.6
437	F	93.2	Very high	91.2	Very high	74 Å²	74	96.6 Å²	96.6	33%	0.325	56%	0.561	S	S	.	*	S	Bend	trans	-84	-30.7	173.9	-60.9	-84.3	0	0	0	111.2	I422 L425 I426 R429 Q435	I422-F437 HydrophobicContact CD1-CD1 4.3Å; I422-F437 HydrophobicContact CG2-CE1 4.5Å; L425-F437 HydrophobicContact CB-CD1 3.91Å; L425-F437 HydrophobicContact CB-CE1 3.49Å; L425-F437 VanDerWaalsContact CB-CE1 3.49Å; L425-F437 HydrophobicContact CB-CZ 3.87Å; L425-F437 HydrophobicContact CD1-CD1 3.96Å; L425-F437 HydrophobicContact CD1-CE1 4.34Å; I426-F437 HydrophobicContact CB-CZ 4.43Å; I426-F437 HydrophobicContact CG1-CE1 4.08Å; I426-F437 HydrophobicContact CG1-CZ 3.72Å; R429-F437 HydrophobicContact CB-CE2 4.49Å; Q435-F437 HydrophobicContact CB-CD2 4.39Å
438	T	91.1	Very high	90.7	Very high	88 Å²	88	101 Å²	101	54%	0.54	59%	0.588	S	S	.	*	S	Bend	trans	-131.7	162.4	178.9	61.8	0	0	0	0	109.4	Q435 N440	Q435-T438 PolarHBondContact NE2-OG1 3.08Å; T438-N440 PolarHBondContact OG1-O 2.89Å
439	V	86.4	Confident	90	Very high	143 Å²	143	106.6 Å²	106.6	87%	0.867	61%	0.611	S	S	*	*	S	Bend	trans	-89.5	-9.5	179.8	-70.9	0	0	0	0	113.8
440	N	68.9	Low	89.4	Confident	128 Å²	128	106.3 Å²	106.3	68%	0.684	63%	0.627	S	S	*	*			trans	-112.4	128	-177.8	-63.6	-21.3	0	0	0	109.6	Q435 T438	Q435-N440 PolarHBondContact NE2-O 3.05Å; T438-N440 PolarHBondContact OG1-O 2.89Å
441	N	52.2	Low	88.6	Confident	221 Å²	221	110.7 Å²	110.7	100%	1.182	64%	0.641	S	S	*	*			trans	-68.3	0	179.8	-80.5	-21	0	0	0	112.9

Retrieved 441 of 441 residues in 92.9 ms (Link to these results)

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