A0A077ZCW7_TRITR Loading...

Neur chan memb and Neur chan LBD domain containin g protein

AlphaFold DB , UniProt , Accession A0A077ZCW7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 525 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	36.6	Very low	43.6	Very low	249 Å²	249	177.5 Å²	177.5	100%	1.227	89%	0.886	S	S	*	*				0	95.8	0	-80.5	175.3	160.5	0	0	109.9
2	C	40	Very low	43.3	Very low	138 Å²	138	176.5 Å²	176.5	93%	0.932	89%	0.885	S	S	*	*			trans	-179	102.7	141.9	-126.3	0	0	0	0	106.9
3	N	37.6	Very low	42.9	Very low	171 Å²	171	170.3 Å²	170.3	91%	0.914	88%	0.878	S	S	*	*			trans	-85.9	121	179.7	-133.8	0.3	0	0	0	107.4
4	R	46.9	Very low	42.6	Very low	244 Å²	244	166.6 Å²	166.6	92%	0.921	87%	0.87	S	S	*	*			trans	-116.9	119.1	166.4	-107.4	-174.2	-172	-160.5	2.8	110.3
5	R	42.7	Very low	42.2	Very low	240 Å²	240	161.9 Å²	161.9	91%	0.906	86%	0.864	S	S	*	*	P	Polyproline II helix	trans	-56.7	134.6	178.6	-70.7	174.9	-177.2	172.2	0.1	111.4
6	V	47.7	Very low	41.5	Very low	127 Å²	127	164.1 Å²	164.1	77%	0.77	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-82.2	122.6	163.1	176.3	0	0	0	0	107.9	V8	V6-V8 HydrophobicContact CG1-CG2 4.24Å
7	I	45.7	Very low	41.2	Very low	154 Å²	154	161.8 Å²	161.8	79%	0.79	87%	0.868	S	S	*	*	P	Polyproline II helix	trans	-85.2	122.1	167.5	-63.8	172.7	0	0	0	106.4
8	V	48.3	Very low	40.9	Very low	126 Å²	126	159.6 Å²	159.6	76%	0.764	86%	0.862	S	S	*	*			trans	-100.3	109.7	172.7	177.6	0	0	0	0	107.4	V6	V6-V8 HydrophobicContact CG1-CG2 4.24Å
9	E	44.4	Very low	40.8	Very low	179 Å²	179	158.6 Å²	158.6	84%	0.836	86%	0.862	S	S	*	*	P	Polyproline II helix	trans	-77.5	129.4	167.2	-83.8	-179.2	144.2	0	0	110.4
10	K	40.5	Very low	40.5	Very low	194 Å²	194	160 Å²	160	84%	0.843	86%	0.859	S	S	*	*	P	Polyproline II helix	trans	-74.3	139.8	167.8	-85.2	176.6	171.1	177.5	0	109.9
11	P	48.8	Very low	40.2	Very low	130 Å²	130	161.6 Å²	161.6	84%	0.844	86%	0.861	S	S	*	*	P	Polyproline II helix	trans	-83.2	132.4	163.6	27.7	-21.1	0	0	0	111.2
12	L	41	Very low	40.2	Very low	166 Å²	166	154.7 Å²	154.7	87%	0.869	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-60.6	142.1	168.1	-101	73.1	0	0	0	111.7
13	A	37.5	Very low	39.9	Very low	96 Å²	96	157 Å²	157	79%	0.793	84%	0.841	S	S	*	*			trans	-108.3	139.8	153.4	0	0	0	0	0	108.4
14	P	38.4	Very low	39.8	Very low	119 Å²	119	153 Å²	153	77%	0.773	83%	0.831	S	S	*	*				-147.6	173.7	121.1	39.4	-22.5	0	0	0	110.4
15	A	37	Very low	39.5	Very low	95 Å²	95	149.8 Å²	149.8	79%	0.785	83%	0.826	S	S	*	*			cis	-158.5	148.9	17.1	0	0	0	0	0	109
16	Q	31.4	Very low	39.3	Very low	197 Å²	197	145.6 Å²	145.6	92%	0.921	82%	0.822	S	S	*	*			trans	-77.3	144.4	162.7	-73.5	172.5	-30.9	0	0	110.1
17	S	36.8	Very low	38.7	Very low	125 Å²	125	151.3 Å²	151.3	87%	0.874	83%	0.829	S	S	*	*			trans	-128.8	138.1	160.6	63	0	0	0	0	110.2
18	T	34.3	Very low	38.5	Very low	123 Å²	123	149.8 Å²	149.8	76%	0.755	83%	0.827	S	S	*	*			trans	-105.7	141.5	-167.7	44.7	0	0	0	0	111.7
19	V	39	Very low	38	Very low	141 Å²	141	152.7 Å²	152.7	86%	0.855	83%	0.829	S	S	*	*			trans	-152.6	97.8	156.3	-175.1	0	0	0	0	105.6
20	K	35.9	Very low	37.7	Very low	186 Å²	186	155.8 Å²	155.8	81%	0.809	83%	0.833	S	S	*	*				55.6	136.7	76	-84.9	-166.2	177.4	-175.2	0	116.3
21	E	34.7	Very low	37.5	Very low	194 Å²	194	151.9 Å²	151.9	91%	0.907	83%	0.831	S	S	*	*			trans	84.7	131.6	171.7	-66.2	169.2	165.7	0	0	116.2
22	A	35.4	Very low	37.2	Very low	103 Å²	103	157.4 Å²	157.4	85%	0.851	83%	0.834	S	S	*	*			cis	-155.7	150.2	13.5	0	0	0	0	0	111.7
23	E	34.8	Very low	37.1	Very low	188 Å²	188	161.9 Å²	161.9	88%	0.879	84%	0.84	S	S	*	*			trans	-79.6	158.1	173.1	-71.1	171	126.4	0	0	113.2
24	A	35.2	Very low	37.3	Very low	85 Å²	85	160.5 Å²	160.5	70%	0.702	84%	0.835	S	S	*	*			trans	58.1	111.7	142.5	0	0	0	0	0	120.2
25	H	41.2	Very low	37.5	Very low	177 Å²	177	164 Å²	164	82%	0.819	84%	0.838	S	S	*	*				170.5	103.9	122.7	-106.2	-94.9	0	0	0	110.4
26	N	37	Very low	38	Very low	153 Å²	153	166.9 Å²	166.9	82%	0.818	84%	0.839	S	S	*	*				177.5	114.4	120	-105.2	-27.7	0	0	0	112.4
27	R	35.3	Very low	38.1	Very low	247 Å²	247	161.2 Å²	161.2	93%	0.932	83%	0.833	S	S	*	*			trans	-113	98.1	173	-168.5	-171.2	-147.8	-148.9	8.3	106.7
28	V	41.2	Very low	38.4	Very low	121 Å²	121	164.1 Å²	164.1	73%	0.733	83%	0.833	S	S	*	*			trans	-137.4	107.8	165.8	-179.4	0	0	0	0	110.8
29	K	38.4	Very low	38.7	Very low	188 Å²	188	169.8 Å²	169.8	82%	0.817	84%	0.841	S	S	*	*			trans	36.8	108.3	140.1	-62.9	176.3	177.9	175.9	0	117.6
30	R	37.8	Very low	38.8	Very low	243 Å²	243	174.1 Å²	174.1	92%	0.917	84%	0.842	S	S	*	*				68.5	119.1	91.6	-108	-177	178.6	175.4	-0.1	114.8
31	S	37	Very low	39.1	Very low	113 Å²	113	173.6 Å²	173.6	79%	0.79	84%	0.842	S	S	*	*			trans	81	99.9	145.5	-159.2	0	0	0	0	117.9
32	R	41.7	Very low	39.6	Very low	245 Å²	245	171.1 Å²	171.1	93%	0.925	83%	0.834	S	S	*	*				-160.5	115.5	126.2	-104.6	168.7	-170.5	-163.9	2.8	110.1
33	R	39.5	Very low	40	Very low	260 Å²	260	172.9 Å²	172.9	98%	0.981	83%	0.829	S	S	*	*			trans	-68.3	120.6	169.7	-143.3	176.4	-169.1	178.7	1.9	106.9
34	G	40.8	Very low	40.8	Very low	68 Å²	68	169.3 Å²	169.3	70%	0.701	82%	0.82	S	S	*	*			trans	-171.7	97.1	-178.6	0	0	0	0	0	113.3
35	K	43.4	Very low	41.8	Very low	191 Å²	191	169.8 Å²	169.8	83%	0.83	81%	0.814	S	S	*	*			trans	58.8	116.3	146.2	-66.8	-177.9	177.7	-179.2	0	120.1
36	I	46.6	Very low	42.5	Very low	156 Å²	156	167.4 Å²	167.4	80%	0.8	80%	0.803	S	S	*	*				67.4	100.1	126.8	-59	166.6	0	0	0	116.2
37	G	35.2	Very low	43.9	Very low	78 Å²	78	164 Å²	164	80%	0.804	79%	0.788	S	S	*	*				59.7	79	123.3	0	0	0	0	0	117.6
38	E	42.1	Very low	45.8	Very low	186 Å²	186	153.4 Å²	153.4	87%	0.869	75%	0.749	S	S	*	*			trans	-135.6	90.9	153.4	-154.3	166.5	-161.2	0	0	108.6	R40	E38-R40 PolarHBondContact O-N 3.06Å
39	R	41.7	Very low	47.8	Very low	242 Å²	242	150 Å²	150	91%	0.913	73%	0.731	S	S	*	*			trans	-73.1	94.4	173.1	-148.7	179	-159.5	-170.9	4.4	105.8	Q41	R39-Q41 PolarHBondContact O-N 3.37Å
40	R	41.1	Very low	50.1	Low	233 Å²	233	146.2 Å²	146.2	88%	0.879	72%	0.716	S	S	*	*			trans	-54.3	102.4	166.4	-95.1	-179.2	171.9	172.9	-3.1	108.1	E38 I42	E38-R40 PolarHBondContact O-N 3.06Å; R40-I42 PolarHBondContact O-N 2.96Å
41	Q	41.2	Very low	52.4	Low	174 Å²	174	142.4 Å²	142.4	81%	0.813	71%	0.709	S	S	*	*			trans	-66.3	100.2	162.7	-79.6	179.5	-19.7	0	0	106.7	R39 N43	R39-Q41 PolarHBondContact O-N 3.37Å; Q41-N43 VanDerWaalsContact C-N 3.34Å; Q41-N43 PolarHBondContact O-N 2.73Å; Q41-N43 VanDerWaalsContact O-N 3.1Å
42	I	45.8	Very low	54.8	Low	142 Å²	142	140.6 Å²	140.6	73%	0.728	69%	0.688	S	S	*	*			trans	-67.7	104.1	158.4	-60.7	173.9	0	0	0	104.2	R40 V44	R40-I42 PolarHBondContact O-N 2.96Å; I42-V44 HydrophobicContact CB-CG2 4.48Å; I42-V44 HydrophobicContact CG2-CG2 3.78Å; I42-V44 PolarHBondContact O-N 3.07Å
43	N	43.9	Very low	57	Low	141 Å²	141	129 Å²	129	75%	0.754	64%	0.644	S	S	*	*			trans	-64.2	83.3	167	-92.3	-7.9	0	0	0	107.4	Q41 T45	Q41-N43 VanDerWaalsContact C-N 3.34Å; Q41-N43 PolarHBondContact O-N 2.73Å; Q41-N43 VanDerWaalsContact O-N 3.1Å; N43-T45 VanDerWaalsContact C-N 3.31Å; N43-T45 PolarHBondContact O-N 2.9Å
44	V	50.9	Low	59.3	Low	113 Å²	113	118.8 Å²	118.8	69%	0.685	61%	0.609	S	S	*	*			trans	-70.3	97.5	163.6	-176.9	0	0	0	0	104.9	I42 H46	I42-V44 HydrophobicContact CB-CG2 4.48Å; I42-V44 HydrophobicContact CG2-CG2 3.78Å; I42-V44 PolarHBondContact O-N 3.07Å; V44-H46 VanDerWaalsContact C-N 3.31Å; V44-H46 PolarHBondContact O-N 3.38Å
45	T	55.2	Low	61.6	Low	95 Å²	95	122.2 Å²	122.2	58%	0.583	61%	0.606	S	S	*	*			trans	-56.1	99.4	166.7	33.8	0	0	0	0	107.3	N43 T47	N43-T45 VanDerWaalsContact C-N 3.31Å; N43-T45 PolarHBondContact O-N 2.9Å; T45-T47 PolarHBondContact O-N 3.39Å
46	H	57.8	Low	63.8	Low	126 Å²	126	117.9 Å²	117.9	58%	0.583	59%	0.587	S	S	*	*			trans	-69.6	96.6	-177	-164.4	-83	0	0	0	108.3	V44 L48	V44-H46 VanDerWaalsContact C-N 3.31Å; V44-H46 PolarHBondContact O-N 3.38Å; H46-L48 PolarHBondContact O-N 3.42Å
47	T	65.6	Low	65.8	Low	83 Å²	83	111 Å²	111	51%	0.509	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-61.1	123.9	167.7	50.8	0	0	0	0	107.6	T45 S49	T45-T47 PolarHBondContact O-N 3.39Å; T47-S49 PolarHBondContact O-N 2.93Å
48	L	75.2	Confident	68.4	Low	23 Å²	23	109.4 Å²	109.4	12%	0.12	53%	0.525	C	S	.	.	P	Polyproline II helix	trans	-58.7	133.1	174.2	-72.1	173.7	0	0	0	109	H46 I53 M122 M129	H46-L48 PolarHBondContact O-N 3.42Å; L48-I53 HydrophobicContact CB-CD1 4.27Å; L48-I53 HydrophobicContact CB-CG1 3.92Å; L48-M122 HydrophobicContact CD1-CB 3.93Å; L48-M122 WeakPolarHBondContact CD1-O 3.19Å; L48-M129 HydrophobicContact CD1-CE 4.27Å
49	S	83.9	Confident	70.7	Confident	49 Å²	49	106.6 Å²	106.6	34%	0.343	52%	0.516	S	S	.	.	P	Polyproline II helix	trans	-66.3	150.9	173.7	65	0	0	0	0	110.3	T47 Q51 E52 I53	T47-S49 PolarHBondContact O-N 2.93Å; S49-Q51 PolarHBondContact O-N 2.98Å; S49-E52 WeakPolarHBondContact CB-OE2 3.39Å; S49-E52 PolarHBondContact N-OE2 3.08Å; S49-E52 PolarHBondContact O-N 3.02Å; S49-E52 VanDerWaalsContact O-N 3.07Å; S49-E52 WeakPolarHBondContact OG-CB 3.39Å; S49-E52 WeakPolarHBondContact OG-CG 3.29Å; S49-E52 PolarHBondContact OG-N 3.32Å; S49-E52 PolarHBondContact OG-OE2 3.4Å; S49-I53 WeakPolarHBondContact O-CG1 3.27Å; S49-I53 PolarHBondContact O-N 3.4Å
50	E	84.9	Confident	73	Confident	109 Å²	109	98.9 Å²	98.9	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-55.8	-36.3	176.8	-65.1	-177.5	170.9	0	0	111.8	I53 I54 V133	E50-I53 PolarHBondContact O-N 3.03Å; E50-I54 VanDerWaalsContact O-CG1 3.26Å; E50-I54 WeakPolarHBondContact O-CG1 3.33Å; E50-I54 PolarHBondContact O-N 3.26Å; E50-V133 HydrophobicContact CB-CG1 4.39Å; E50-V133 HydrophobicContact CG-CG2 4.5Å
51	Q	86.3	Confident	75.4	Confident	163 Å²	163	89.1 Å²	89.1	76%	0.762	48%	0.475	S	S	*	.	H	α-helix	trans	-62.6	-44.3	176.4	-66.9	179.9	-18.4	0	0	112.3	S49 I53 I54 H55	S49-Q51 PolarHBondContact O-N 2.98Å; Q51-I53 VanDerWaalsContact C-N 3.33Å; Q51-I54 PolarHBondContact O-N 2.81Å; Q51-H55 WeakPolarHBondContact O-CB 3.26Å; Q51-H55 PolarHBondContact O-N 3.29Å
52	E	87.7	Confident	77.8	Confident	76 Å²	76	83.4 Å²	83.4	36%	0.355	45%	0.45	S	S	.	.	H	α-helix	trans	-65.6	-37.8	176.2	-72.3	165.3	134.2	0	0	111.7	S49 K56	S49-E52 WeakPolarHBondContact CB-OE2 3.39Å; S49-E52 PolarHBondContact N-OE2 3.08Å; S49-E52 PolarHBondContact O-N 3.02Å; S49-E52 VanDerWaalsContact O-N 3.07Å; S49-E52 WeakPolarHBondContact OG-CB 3.39Å; S49-E52 WeakPolarHBondContact OG-CG 3.29Å; S49-E52 PolarHBondContact OG-N 3.32Å; S49-E52 PolarHBondContact OG-OE2 3.4Å; E52-K56 WeakPolarHBondContact O-CB 3.41Å; E52-K56 VanDerWaalsContact O-CG 3.27Å; E52-K56 WeakPolarHBondContact O-CG 3.32Å; E52-K56 PolarHBondContact O-N 3.33Å
53	I	88.4	Confident	80	Confident	2 Å²	2	81.7 Å²	81.7	1%	0.01	43%	0.434	C	S	.	.	H	α-helix	trans	-62.3	-51.9	175.7	-64.4	166.4	0	0	0	109.6	L48 S49 E50 Q51 H55 K56 V57 Y119 M129 P130 V133	L48-I53 HydrophobicContact CB-CD1 4.27Å; L48-I53 HydrophobicContact CB-CG1 3.92Å; S49-I53 WeakPolarHBondContact O-CG1 3.27Å; S49-I53 PolarHBondContact O-N 3.4Å; E50-I53 PolarHBondContact O-N 3.03Å; Q51-I53 VanDerWaalsContact C-N 3.33Å; I53-H55 VanDerWaalsContact C-N 3.34Å; I53-H55 PolarHBondContact O-N 3.29Å; I53-K56 PolarHBondContact O-N 3.25Å; I53-V57 HydrophobicContact CG2-CG2 4.03Å; I53-V57 VanDerWaalsContact O-CB 3.32Å; I53-V57 WeakPolarHBondContact O-CB 3.45Å; I53-V57 VanDerWaalsContact O-CG2 3.22Å; I53-V57 WeakPolarHBondContact O-CG2 3.34Å; I53-V57 PolarHBondContact O-N 2.93Å; I53-Y119 HydrophobicContact CD1-CD2 4.43Å; I53-Y119 HydrophobicContact CG2-CD1 3.91Å; I53-Y119 HydrophobicContact CG2-CD2 3.98Å; I53-Y119 HydrophobicContact CG2-CE1 4.46Å; I53-Y119 HydrophobicContact CG2-CG 3.63Å; I53-M129 HydrophobicContact CD1-CE 3.44Å; I53-M129 VanDerWaalsContact CD1-CE 3.44Å; I53-M129 HydrophobicContact CG1-CE 3.83Å; I53-P130 HydrophobicContact CD1-CG 3.54Å; I53-V133 HydrophobicContact CD1-CG2 4.35Å; I53-V133 HydrophobicContact CG2-CG2 4.11Å
54	I	87.8	Confident	82.2	Confident	45 Å²	45	82.9 Å²	82.9	23%	0.231	43%	0.428	C	S	.	.	H	α-helix	trans	-57.4	-48.3	179.5	-66.9	167.3	0	0	0	110.5	E50 Q51 K56 V57 L58 V133 L135	E50-I54 VanDerWaalsContact O-CG1 3.26Å; E50-I54 WeakPolarHBondContact O-CG1 3.33Å; E50-I54 PolarHBondContact O-N 3.26Å; Q51-I54 PolarHBondContact O-N 2.81Å; I54-K56 VanDerWaalsContact C-N 3.34Å; I54-K56 PolarHBondContact O-N 3.43Å; I54-V57 PolarHBondContact O-N 3.03Å; I54-L58 HydrophobicContact CG2-CD1 3.58Å; I54-L58 HydrophobicContact CG2-CG 4.25Å; I54-L58 WeakPolarHBondContact O-CB 3.46Å; I54-L58 WeakPolarHBondContact O-CG 3.49Å; I54-L58 PolarHBondContact O-N 3.49Å; I54-V133 HydrophobicContact CD1-CG1 3.57Å; I54-V133 HydrophobicContact CG1-CG1 3.44Å; I54-V133 VanDerWaalsContact CG1-CG1 3.44Å; I54-L135 HydrophobicContact CD1-CD2 4.04Å; I54-L135 HydrophobicContact CG1-CD2 3.93Å; I54-L135 HydrophobicContact CG2-CD2 3.87Å
55	H	88.8	Confident	84.2	Confident	139 Å²	139	81.3 Å²	81.3	64%	0.644	42%	0.419	S	S	*	.	H	α-helix	trans	-61.8	-42	-179.2	-174.7	-79.1	0	0	0	111.9	Q51 I53 N59	Q51-H55 WeakPolarHBondContact O-CB 3.26Å; Q51-H55 PolarHBondContact O-N 3.29Å; I53-H55 VanDerWaalsContact C-N 3.34Å; I53-H55 PolarHBondContact O-N 3.29Å; H55-N59 WeakPolarHBondContact O-CB 3.46Å; H55-N59 PolarHBondContact O-N 3.22Å
56	K	89.4	Confident	86	Confident	101 Å²	101	78.4 Å²	78.4	44%	0.439	40%	0.397	S	S	.	.	H	α-helix	trans	-68.9	-43.5	178.2	-75.1	178.7	179.3	-179.5	0	112.4	E52 I53 I54 N59 M122	E52-K56 WeakPolarHBondContact O-CB 3.41Å; E52-K56 VanDerWaalsContact O-CG 3.27Å; E52-K56 WeakPolarHBondContact O-CG 3.32Å; E52-K56 PolarHBondContact O-N 3.33Å; I53-K56 PolarHBondContact O-N 3.25Å; I54-K56 VanDerWaalsContact C-N 3.34Å; I54-K56 PolarHBondContact O-N 3.43Å; K56-N59 PolarHBondContact O-N 2.98Å; K56-M122 HydrophobicContact CB-CE 4.34Å; K56-M122 HydrophobicContact CB-SD 3.63Å; K56-M122 HydrophobicContact CD-SD 3.86Å; K56-M122 HydrophobicContact CG-SD 4.4Å
57	V	89.7	Confident	87.8	Confident	10 Å²	10	72.4 Å²	72.4	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-64.4	-41.6	-179.8	166.9	0	0	0	0	111.6	I53 I54 L117 Y119 M122	I53-V57 HydrophobicContact CG2-CG2 4.03Å; I53-V57 VanDerWaalsContact O-CB 3.32Å; I53-V57 WeakPolarHBondContact O-CB 3.45Å; I53-V57 VanDerWaalsContact O-CG2 3.22Å; I53-V57 WeakPolarHBondContact O-CG2 3.34Å; I53-V57 PolarHBondContact O-N 2.93Å; I54-V57 PolarHBondContact O-N 3.03Å; V57-L117 HydrophobicContact CG1-CB 3.89Å; V57-L117 HydrophobicContact CG1-CD2 3.22Å; V57-L117 HydrophobicContact CG1-CG 4.14Å; V57-Y119 HydrophobicContact CG2-CD1 4.38Å; V57-M122 HydrophobicContact CB-CE 4.35Å; V57-M122 HydrophobicContact CG2-CE 3.22Å
58	L	89.4	Confident	89	Confident	45 Å²	45	75.6 Å²	75.6	24%	0.236	37%	0.372	C	S	.	.	H	α-helix	trans	-83.1	-11.6	-177.7	-63.8	179.9	0	0	0	113.4	I54 G60 Y61 L117 V144	I54-L58 HydrophobicContact CG2-CD1 3.58Å; I54-L58 HydrophobicContact CG2-CG 4.25Å; I54-L58 WeakPolarHBondContact O-CB 3.46Å; I54-L58 WeakPolarHBondContact O-CG 3.49Å; I54-L58 PolarHBondContact O-N 3.49Å; L58-G60 PolarHBondContact O-N 3.48Å; L58-Y61 PolarHBondContact O-N 3.41Å; L58-L117 HydrophobicContact CD2-CD2 4.36Å; L58-V144 HydrophobicContact CD2-CG1 3.98Å
59	N	90.3	Very high	89.8	Confident	128 Å²	128	75.1 Å²	75.1	68%	0.684	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	113.9	179	-172.9	22.4	0	0	0	111	H55 K56 Y61	H55-N59 WeakPolarHBondContact O-CB 3.46Å; H55-N59 PolarHBondContact O-N 3.22Å; K56-N59 PolarHBondContact O-N 2.98Å; N59-Y61 VanDerWaalsContact C-N 3.28Å
60	G	89.6	Confident	90	Very high	79 Å²	79	78.7 Å²	78.7	81%	0.814	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	7.6	-177	0	0	0	0	0	114.6	L58	L58-G60 PolarHBondContact O-N 3.48Å
61	Y	92.3	Very high	90.1	Very high	29 Å²	29	77.1 Å²	77.1	11%	0.114	38%	0.382	C	S	.	.			trans	-77.4	123.1	175.5	-176.5	-90.6	0	0	0	111.1	L58 N59 W63 D114 R116 L117 V144 W145	L58-Y61 PolarHBondContact O-N 3.41Å; N59-Y61 VanDerWaalsContact C-N 3.28Å; Y61-W63 HydrophobicContact CD1-CB 4.29Å; Y61-W63 HydrophobicContact CE1-CB 3.87Å; Y61-D114 VanDerWaalsContact CE2-OD2 3.28Å; Y61-D114 WeakPolarHBondContact CE2-OD2 3.28Å; Y61-D114 PolarHBondContact OH-OD2 3.48Å; Y61-R116 HydrophobicContact CD2-CB 3.92Å; Y61-R116 HydrophobicContact CE2-CB 3.89Å; Y61-R116 PolarHBondContact OH-NH2 3.46Å; Y61-R116 VanDerWaalsContact OH-NH2 3.15Å; Y61-L117 HydrophobicContact CD2-CD2 3.47Å; Y61-L117 VanDerWaalsContact CD2-CD2 3.47Å; Y61-L117 HydrophobicContact CD2-CG 4.13Å; Y61-L117 HydrophobicContact CE2-CD1 4.08Å; Y61-L117 HydrophobicContact CE2-CD2 3.43Å; Y61-L117 VanDerWaalsContact CE2-CD2 3.43Å; Y61-L117 HydrophobicContact CE2-CG 3.63Å; Y61-L117 HydrophobicContact CG-CD2 4.04Å; Y61-V144 HydrophobicContact CE1-CB 4.37Å; Y61-V144 HydrophobicContact CE1-CG1 4.5Å; Y61-W145 WeakPolarHBondContact OH-CB 3.32Å; Y61-W145 PolarHBondContact OH-N 3.11Å; Y61-W145 VanDerWaalsContact OH-N 3.1Å
62	D	91.7	Very high	89.9	Confident	53 Å²	53	76 Å²	76	28%	0.283	39%	0.387	S	S	.	.			trans	-99.3	105.1	172.6	-164.6	-18.4	0	0	0	110.8	R64 V65 R116	D62-R64 PolarHBondContact O-N 2.86Å; D62-R64 WeakPolarHBondContact OD1-CB 3.4Å; D62-R64 IonicContact OD1-CZ 3.68Å; D62-R64 PolarHBondContact OD1-N 2.94Å; D62-R64 IonicContact OD1-NE 2.77Å; D62-R64 PolarHBondContact OD1-NE 3.15Å; D62-R64 IonicContact OD1-NH2 2.77Å; D62-R64 IonicContact OD2-CZ 2.72Å; D62-R64 IonicContact OD2-NE 3.11Å; D62-R64 PolarHBondContact OD2-NE 3.4Å; D62-R64 IonicContact OD2-NH2 3.3Å; D62-R64 PolarHBondContact OD2-NH2 3.02Å; D62-V65 HydrophobicContact CB-CG2 4.22Å; D62-V65 PolarHBondContact O-N 3.37Å; D62-R116 PolarHBondContact O-NH1 3.27Å
63	W	90.9	Very high	89.9	Confident	106 Å²	106	77 Å²	77	40%	0.402	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.6	-14.7	180	64	-93.9	0	0	0	114	Y61 V65 Q142 W145	Y61-W63 HydrophobicContact CD1-CB 4.29Å; Y61-W63 HydrophobicContact CE1-CB 3.87Å; W63-V65 VanDerWaalsContact C-N 3.27Å; W63-Q142 HydrophobicContact CE3-CB 4.29Å; W63-W145 WeakPolarHBondContact O-CA 3.46Å; W63-W145 VanDerWaalsContact O-CB 3.3Å; W63-W145 WeakPolarHBondContact O-CB 3.39Å; W63-W145 VanDerWaalsContact O-CD1 3.29Å
64	R	90.7	Very high	89.7	Confident	167 Å²	167	80.1 Å²	80.1	63%	0.63	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-15	178.7	-59.3	168.6	-66.3	178.4	4.2	112.4	D62	D62-R64 PolarHBondContact O-N 2.86Å; D62-R64 WeakPolarHBondContact OD1-CB 3.4Å; D62-R64 IonicContact OD1-CZ 3.68Å; D62-R64 PolarHBondContact OD1-N 2.94Å; D62-R64 IonicContact OD1-NE 2.77Å; D62-R64 PolarHBondContact OD1-NE 3.15Å; D62-R64 IonicContact OD1-NH2 2.77Å; D62-R64 IonicContact OD2-CZ 2.72Å; D62-R64 IonicContact OD2-NE 3.11Å; D62-R64 PolarHBondContact OD2-NE 3.4Å; D62-R64 IonicContact OD2-NH2 3.3Å; D62-R64 PolarHBondContact OD2-NH2 3.02Å
65	V	92.1	Very high	89.2	Confident	79 Å²	79	82.9 Å²	82.9	48%	0.479	44%	0.439	S	S	.	.	S	Bend	trans	-102.6	126.8	-175.1	-176.4	0	0	0	0	110	D62 W63 R116	D62-V65 HydrophobicContact CB-CG2 4.22Å; D62-V65 PolarHBondContact O-N 3.37Å; W63-V65 VanDerWaalsContact C-N 3.27Å; V65-R116 PolarHBondContact O-NH1 2.94Å; V65-R116 PolarHBondContact O-NH2 3.43Å
66	R	93.9	Very high	88.7	Confident	34 Å²	34	82.7 Å²	82.7	13%	0.128	44%	0.443	C	S	.	.	P	Polyproline II helix	trans	-58.4	138.1	174.9	-177	-179.8	64.8	90.6	-22.3	110.8	G79 V81 W145 Y212 D216	R66-G79 PolarHBondContact NH1-O 3.41Å; R66-V81 HydrophobicContact CG-CG2 3.87Å; R66-W145 HydrophobicContact CB-CZ2 4.17Å; R66-W145 HydrophobicContact CG-CH2 4.22Å; R66-W145 HydrophobicContact CG-CZ2 3.71Å; R66-Y212 HydrophobicContact CB-CE1 4.13Å; R66-D216 WeakPolarHBondContact CD-O 3.34Å; R66-D216 IonicContact CZ-OD1 2.8Å; R66-D216 IonicContact NE-OD1 3.66Å; R66-D216 PolarHBondContact NE-OD1 3.18Å; R66-D216 PolarHBondContact NH1-O 3.18Å; R66-D216 IonicContact NH2-OD1 3.41Å; R66-D216 PolarHBondContact NH2-OD1 2.89Å
67	P	94.5	Very high	88.5	Confident	1 Å²	1	80.7 Å²	80.7	1%	0.006	44%	0.44	C	S	.	.	P	Polyproline II helix	trans	-59.4	154.5	171	-17.7	26.5	0	0	0	112.2	V81 D114 W145	P67-V81 HydrophobicContact CB-CG2 4.21Å; P67-V81 WeakPolarHBondContact O-CG2 3.24Å; P67-D114 HydrophobicContact CB-CB 4.13Å; P67-D114 HydrophobicContact CG-CB 3.91Å; P67-W145 HydrophobicContact CG-CD2 4.12Å; P67-W145 HydrophobicContact CG-CE3 3.62Å; P67-W145 HydrophobicContact CG-CZ3 3.96Å
68	R	92	Very high	88.3	Confident	149 Å²	149	80.6 Å²	80.6	56%	0.562	44%	0.44	S	S	*	.	P	Polyproline II helix	trans	-71.1	145.1	170.8	-61	-178.2	91	-178.7	3.7	109.7	D76 T77	R68-D76 PolarHBondContact NE-O 2.99Å; R68-D76 VanDerWaalsContact NH2-C 3.28Å; R68-D76 PolarHBondContact NH2-O 2.9Å; R68-T77 CarbonylContact C-O 3.52Å; R68-T77 VanDerWaalsContact CA-O 3.27Å; R68-T77 WeakPolarHBondContact CA-O 3.43Å; R68-T77 WeakPolarHBondContact CB-O 3.42Å
69	G	90.9	Very high	88.5	Confident	13 Å²	13	78.6 Å²	78.6	13%	0.134	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-66.8	169.5	171	0	0	0	0	0	112	T77 G78 G79	G69-T77 PolarHBondContact N-O 3.2Å; G69-G78 CarbonylContact C-O 3.06Å; G69-G78 WeakPolarHBondContact CA-O 3.32Å; G69-G79 WeakPolarHBondContact CA-O 3.5Å; G69-G79 PolarHBondContact N-O 3.5Å
70	L	88.4	Confident	88.7	Confident	124 Å²	124	74.1 Å²	74.1	65%	0.649	41%	0.409	S	S	*	.	S	Bend	trans	-84.3	-8.4	-176.3	-66.7	171.5	0	0	0	113.8	T72 G78 V113	L70-T72 PolarHBondContact O-N 3.32Å; L70-G78 PolarHBondContact N-O 2.95Å; L70-V113 HydrophobicContact CD1-CB 4.48Å; L70-V113 HydrophobicContact CD1-CG2 4.3Å; L70-V113 HydrophobicContact CD2-CB 4.22Å; L70-V113 HydrophobicContact CD2-CG1 4.03Å
71	N	87.6	Confident	89	Confident	76 Å²	76	70.6 Å²	70.6	41%	0.406	37%	0.371	S	S	.	.			trans	-87.1	101.2	-174.8	-171.2	-4.9	0	0	0	111.1	S73 I74 G78	N71-S73 PolarHBondContact O-N 3.46Å; N71-S73 VanDerWaalsContact O-N 3.12Å; N71-S73 VanDerWaalsContact OD1-CB 3.3Å; N71-S73 WeakPolarHBondContact OD1-CB 3.18Å; N71-S73 PolarHBondContact OD1-N 2.82Å; N71-S73 VanDerWaalsContact OD1-N 3.08Å; N71-S73 PolarHBondContact OD1-OG 3.13Å; N71-I74 HydrophobicContact CB-CD1 4.34Å; N71-I74 PolarHBondContact O-N 2.98Å; N71-G78 WeakPolarHBondContact CA-O 3.26Å; N71-G78 VanDerWaalsContact CB-O 3.32Å; N71-G78 WeakPolarHBondContact CB-O 3.33Å; N71-G78 PolarHBondContact N-O 2.86Å; N71-G78 CarbonylContact O-C 3.4Å; N71-G78 VanDerWaalsContact O-CA 3.25Å; N71-G78 WeakPolarHBondContact O-CA 3.38Å
72	T	82.5	Confident	89.2	Confident	139 Å²	139	72.3 Å²	72.3	85%	0.853	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-14	179.7	54.3	0	0	0	0	114.1	L70 I74	L70-T72 PolarHBondContact O-N 3.32Å; T72-I74 VanDerWaalsContact C-N 3.31Å
73	S	87.3	Confident	89.4	Confident	99 Å²	99	69.8 Å²	69.8	69%	0.692	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-19.3	178.8	-57.8	0	0	0	0	113.5	N71 P75	N71-S73 PolarHBondContact O-N 3.46Å; N71-S73 VanDerWaalsContact O-N 3.12Å; N71-S73 VanDerWaalsContact OD1-CB 3.3Å; N71-S73 WeakPolarHBondContact OD1-CB 3.18Å; N71-S73 PolarHBondContact OD1-N 2.82Å; N71-S73 VanDerWaalsContact OD1-N 3.08Å; N71-S73 PolarHBondContact OD1-OG 3.13Å; S73-P75 WeakPolarHBondContact O-CD 3.46Å
74	I	83.1	Confident	89.8	Confident	67 Å²	67	67.7 Å²	67.7	34%	0.344	37%	0.365	S	S	.	.	S	Bend	trans	-96.4	110.9	-179	-60.5	169.9	0	0	0	108.4	N71 T72 G78	N71-I74 HydrophobicContact CB-CD1 4.34Å; N71-I74 PolarHBondContact O-N 2.98Å; T72-I74 VanDerWaalsContact C-N 3.31Å; I74-G78 PolarHBondContact O-N 3.35Å
75	P	78.6	Confident	90.1	Very high	102 Å²	102	59.7 Å²	59.7	66%	0.662	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	153.8	177.2	25	-31.2	0	0	0	110.9	S73 T77	S73-P75 WeakPolarHBondContact O-CD 3.46Å; P75-T77 VanDerWaalsContact C-N 3.3Å; P75-T77 PolarHBondContact O-N 3.38Å
76	D	78.5	Confident	90.3	Very high	136 Å²	136	56.1 Å²	56.1	73%	0.727	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.4	-56.8	178.3	-53.2	-30.6	0	0	0	116.8	R68	R68-D76 PolarHBondContact NE-O 2.99Å; R68-D76 VanDerWaalsContact NH2-C 3.28Å; R68-D76 PolarHBondContact NH2-O 2.9Å
77	T	83.9	Confident	90.5	Very high	59 Å²	59	54.5 Å²	54.5	36%	0.362	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.5	-23.5	-173.8	61.5	0	0	0	0	114.5	R68 G69 P75 G79	R68-T77 CarbonylContact C-O 3.52Å; R68-T77 VanDerWaalsContact CA-O 3.27Å; R68-T77 WeakPolarHBondContact CA-O 3.43Å; R68-T77 WeakPolarHBondContact CB-O 3.42Å; G69-T77 PolarHBondContact N-O 3.2Å; P75-T77 VanDerWaalsContact C-N 3.3Å; P75-T77 PolarHBondContact O-N 3.38Å; T77-G79 PolarHBondContact O-N 3.43Å; T77-G79 PolarHBondContact OG1-N 3.4Å
78	G	87.1	Confident	90.6	Very high	7 Å²	7	56.6 Å²	56.6	7%	0.072	32%	0.317	C	S	.	.			trans	69.6	11.1	-169.9	0	0	0	0	0	113.8	G69 L70 N71 I74	G69-G78 CarbonylContact C-O 3.06Å; G69-G78 WeakPolarHBondContact CA-O 3.32Å; L70-G78 PolarHBondContact N-O 2.95Å; N71-G78 WeakPolarHBondContact CA-O 3.26Å; N71-G78 VanDerWaalsContact CB-O 3.32Å; N71-G78 WeakPolarHBondContact CB-O 3.33Å; N71-G78 PolarHBondContact N-O 2.86Å; N71-G78 CarbonylContact O-C 3.4Å; N71-G78 VanDerWaalsContact O-CA 3.25Å; N71-G78 WeakPolarHBondContact O-CA 3.38Å; I74-G78 PolarHBondContact O-N 3.35Å
79	G	92.1	Very high	90.7	Very high	3 Å²	3	49.5 Å²	49.5	3%	0.031	29%	0.29	C	S	.	.	S	Bend	trans	84.9	-168.5	-174.4	0	0	0	0	0	114.7	R66 G69 T77	R66-G79 PolarHBondContact NH1-O 3.41Å; G69-G79 WeakPolarHBondContact CA-O 3.5Å; G69-G79 PolarHBondContact N-O 3.5Å; T77-G79 PolarHBondContact O-N 3.43Å; T77-G79 PolarHBondContact OG1-N 3.4Å
80	P	94.5	Very high	90.8	Very high	35 Å²	35	53.2 Å²	53.2	23%	0.227	30%	0.3	C	S	.	.			trans	-71	146.2	-179.2	27.6	-33.5	0	0	0	111.7	I82 E215 D216 E218	P80-I82 PolarHBondContact O-N 2.77Å; P80-E215 WeakPolarHBondContact CA-O 3.49Å; P80-D216 CarbonylContact C-O 3.54Å; P80-D216 VanDerWaalsContact CA-O 3.29Å; P80-D216 WeakPolarHBondContact CA-O 3.18Å; P80-E218 HydrophobicContact CB-CB 4.19Å; P80-E218 HydrophobicContact CG-CB 4.42Å
81	V	95.9	Very high	91	Very high	4 Å²	4	48.9 Å²	48.9	2%	0.024	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.6	117.4	166.1	178.7	0	0	0	0	107.7	R66 P67 V83 W112 W145 D216 I217 E218	R66-V81 HydrophobicContact CG-CG2 3.87Å; P67-V81 HydrophobicContact CB-CG2 4.21Å; P67-V81 WeakPolarHBondContact O-CG2 3.24Å; V81-V83 HydrophobicContact CG1-CG2 4.1Å; V81-V83 PolarHBondContact O-N 2.69Å; V81-W112 HydrophobicContact CG1-CB 3.87Å; V81-W112 HydrophobicContact CG1-CG 4.34Å; V81-W145 HydrophobicContact CG1-CH2 4.46Å; V81-W145 HydrophobicContact CG1-CZ3 4.44Å; V81-D216 PolarHBondContact N-O 3.39Å; V81-I217 WeakPolarHBondContact O-CA 3.27Å; V81-E218 PolarHBondContact O-N 3.28Å
82	I	96.6	Very high	91.3	Very high	65 Å²	65	45.6 Å²	45.6	33%	0.333	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	116	175.4	-58.5	175	0	0	0	108.2	P80 E218 K220	P80-I82 PolarHBondContact O-N 2.77Å; I82-E218 WeakPolarHBondContact CA-O 3.48Å; I82-K220 HydrophobicContact CG2-CD 3.89Å; I82-K220 HydrophobicContact CG2-CG 4.28Å
83	V	97.4	Very high	91.7	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.9	177.8	-176.7	0	0	0	0	108.9	V81 V85 E110 Q111 W112 P147 I217 E218 Y219 K220	V81-V83 HydrophobicContact CG1-CG2 4.1Å; V81-V83 PolarHBondContact O-N 2.69Å; V83-V85 HydrophobicContact CG1-CG2 4.34Å; V83-E110 HydrophobicContact CG1-CB 3.95Å; V83-E110 HydrophobicContact CG1-CG 4.18Å; V83-Q111 CarbonylContact C-O 3.33Å; V83-W112 HydrophobicContact CG2-CB 4.17Å; V83-P147 HydrophobicContact CG1-CG 4.3Å; V83-P147 HydrophobicContact CG2-CB 4.32Å; V83-P147 HydrophobicContact CG2-CG 4.45Å; V83-I217 HydrophobicContact CG2-CG2 3.83Å; V83-E218 PolarHBondContact N-O 2.93Å; V83-Y219 HydrophobicContact CB-CD1 3.73Å; V83-Y219 HydrophobicContact CB-CE1 3.89Å; V83-Y219 HydrophobicContact CG1-CD1 3.85Å; V83-Y219 HydrophobicContact CG1-CE1 3.79Å; V83-Y219 HydrophobicContact CG2-CE1 4.36Å; V83-Y219 WeakPolarHBondContact O-CA 3.37Å; V83-K220 PolarHBondContact O-N 3.42Å
84	N	97.6	Very high	91.8	Very high	62 Å²	62	42.5 Å²	42.5	33%	0.332	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	118.4	175.8	-67.9	-45.5	0	0	0	110.2	E110 Q111 K220	N84-E110 CarbonylContact O-C 3.55Å; N84-E110 WeakPolarHBondContact O-CA 3.16Å; N84-Q111 HydrophobicContact CB-CB 4.22Å; N84-Q111 PolarHBondContact N-O 3.34Å; N84-Q111 PolarHBondContact O-N 2.73Å; N84-K220 CarbonylContact C-O 3.43Å; N84-K220 VanDerWaalsContact CA-O 3.3Å; N84-K220 WeakPolarHBondContact CA-O 3.42Å
85	V	97.9	Very high	92.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	138.1	-175.7	-179.4	0	0	0	0	110.9	V83 I87 F108 R109 L207 Y219 K220 W221 K222 L262	V83-V85 HydrophobicContact CG1-CG2 4.34Å; V85-I87 HydrophobicContact CG1-CG1 4.39Å; V85-F108 HydrophobicContact CG1-CD2 4.35Å; V85-F108 HydrophobicContact CG1-CE2 3.47Å; V85-F108 VanDerWaalsContact CG1-CE2 3.47Å; V85-F108 HydrophobicContact CG1-CZ 4.04Å; V85-R109 WeakPolarHBondContact CA-O 3.42Å; V85-L207 HydrophobicContact CG1-CD2 4.04Å; V85-L207 HydrophobicContact CG2-CD1 4.41Å; V85-Y219 HydrophobicContact CG2-CD1 3.65Å; V85-Y219 HydrophobicContact CG2-CE1 4.4Å; V85-K220 PolarHBondContact N-O 3.06Å; V85-W221 HydrophobicContact CG1-CZ3 4.08Å; V85-K222 PolarHBondContact O-N 2.91Å; V85-L262 HydrophobicContact CB-CD1 3.62Å; V85-L262 HydrophobicContact CG1-CD1 4.28Å; V85-L262 HydrophobicContact CG2-CD1 3.68Å
86	N	97.1	Very high	93.1	Very high	4 Å²	4	36.8 Å²	36.8	2%	0.021	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	134.9	171.6	166.1	-104.5	0	0	0	110.2	R109 K222 G225 P226 Q228	N86-R109 HydrophobicContact CB-CB 4.12Å; N86-R109 PolarHBondContact N-O 3Å; N86-R109 PolarHBondContact O-N 3.03Å; N86-R109 WeakPolarHBondContact OD1-CD 3.35Å; N86-R109 PolarHBondContact OD1-NH1 3.18Å; N86-K222 HydrophobicContact CB-CB 4.27Å; N86-K222 HydrophobicContact CB-CD 4.15Å; N86-G225 PolarHBondContact ND2-O 2.94Å; N86-P226 WeakPolarHBondContact CA-O 3.34Å; N86-P226 PolarHBondContact ND2-O 3.28Å; N86-Q228 PolarHBondContact ND2-NE2 3.02Å
87	I	97.3	Very high	93.8	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.5	177.5	-62.3	-179.9	0	0	0	108.4	V85 M89 F106 F108 L207 W221 P226 V227 Q228	V85-I87 HydrophobicContact CG1-CG1 4.39Å; I87-M89 HydrophobicContact CG2-CG 4.05Å; I87-F106 HydrophobicContact CG2-CB 3.91Å; I87-F106 HydrophobicContact CG2-CD2 3.87Å; I87-F106 HydrophobicContact CG2-CG 4.04Å; I87-F108 HydrophobicContact CG1-CD2 4.08Å; I87-F108 HydrophobicContact CG1-CE2 4.44Å; I87-L207 HydrophobicContact CD1-CD2 4.4Å; I87-W221 HydrophobicContact CD1-CH2 3.84Å; I87-W221 HydrophobicContact CD1-CZ3 4.03Å; I87-W221 HydrophobicContact CG1-CH2 4.47Å; I87-W221 HydrophobicContact CG1-CZ3 4.15Å; I87-P226 PolarHBondContact N-O 3.46Å; I87-V227 HydrophobicContact CB-CG2 4.48Å; I87-V227 CarbonylContact O-C 3.43Å; I87-V227 VanDerWaalsContact O-CA 3.28Å; I87-V227 WeakPolarHBondContact O-CA 3.49Å; I87-Q228 PolarHBondContact O-N 2.67Å
88	M	95.8	Very high	94.2	Very high	45 Å²	45	31.6 Å²	31.6	22%	0.222	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	101.7	165.9	-177.7	-168.6	-171.6	0	0	108.8	R90 F106 T107 Q228	M88-R90 PolarHBondContact O-N 3.42Å; M88-F106 CarbonylContact O-C 3.51Å; M88-F106 VanDerWaalsContact O-CA 3.25Å; M88-F106 WeakPolarHBondContact O-CA 3.26Å; M88-F106 WeakPolarHBondContact O-CB 3.26Å; M88-T107 PolarHBondContact N-O 3.24Å; M88-T107 PolarHBondContact O-N 3.4Å; M88-Q228 CarbonylContact C-O 3.53Å; M88-Q228 WeakPolarHBondContact CA-O 3.5Å; M88-Q228 HydrophobicContact CB-CB 4.18Å; M88-Q228 HydrophobicContact CG-CB 4.06Å
89	M	95.1	Very high	94.6	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.8	133.8	175	-65.6	-179.8	72.2	0	0	109.4	I87 I92 V104 V227 Q228 L229 K230 M233 L266	I87-M89 HydrophobicContact CG2-CG 4.05Å; M89-I92 HydrophobicContact CE-CD1 3.85Å; M89-I92 HydrophobicContact CE-CG1 3.97Å; M89-V104 HydrophobicContact CE-CG2 4.11Å; M89-V227 HydrophobicContact CG-CG1 4.1Å; M89-V227 HydrophobicContact SD-CG1 3.98Å; M89-Q228 PolarHBondContact N-O 2.96Å; M89-L229 HydrophobicContact CB-CD2 3.91Å; M89-L229 HydrophobicContact CG-CD2 4.2Å; M89-L229 HydrophobicContact SD-CD2 3.65Å; M89-K230 PolarHBondContact O-N 2.93Å; M89-K230 VanDerWaalsContact O-N 3.16Å; M89-M233 HydrophobicContact CB-CE 3.53Å; M89-M233 HydrophobicContact CB-SD 3.68Å; M89-M233 HydrophobicContact CE-SD 4.23Å; M89-M233 WeakPolarHBondContact O-CE 3.47Å; M89-L266 HydrophobicContact CE-CD1 3.79Å; M89-L266 HydrophobicContact CE-CD2 3.74Å; M89-L266 HydrophobicContact CE-CG 4.45Å; M89-L266 HydrophobicContact SD-CD2 3.73Å
90	R	92.9	Very high	94.7	Very high	90 Å²	90	38 Å²	38	34%	0.34	20%	0.201	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	-44.2	-178.8	-67.1	-178.7	172.7	-85.4	-2.4	111.9	M88 Q105 T107	M88-R90 PolarHBondContact O-N 3.42Å; R90-Q105 HydrophobicContact CB-CB 4.46Å; R90-Q105 WeakPolarHBondContact CB-O 3.42Å; R90-Q105 PolarHBondContact N-O 2.93Å; R90-T107 PolarHBondContact NE-OG1 3.4Å; R90-T107 PolarHBondContact NH2-OG1 3.16Å
91	S	92.9	Very high	94.8	Very high	34 Å²	34	37.9 Å²	37.9	24%	0.238	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.4	145.9	-179.9	57.1	0	0	0	0	110.3	Q105	S91-Q105 PolarHBondContact N-O 2.61Å; S91-Q105 PolarHBondContact O-N 2.96Å
92	I	94	Very high	94.8	Very high	6 Å²	6	37.7 Å²	37.7	3%	0.031	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	120.1	160	-56.9	169.2	0	0	0	105.1	M89 I95 Y102 S103 V104 L237 L242 L266 L268	M89-I92 HydrophobicContact CE-CD1 3.85Å; M89-I92 HydrophobicContact CE-CG1 3.97Å; I92-I95 HydrophobicContact CG2-CD1 4.4Å; I92-I95 HydrophobicContact CG2-CG1 4.17Å; I92-Y102 HydrophobicContact CG2-CD2 4.32Å; I92-S103 CarbonylContact C-O 3.51Å; I92-S103 WeakPolarHBondContact CA-O 3.39Å; I92-V104 HydrophobicContact CG1-CG2 4.16Å; I92-L237 HydrophobicContact CB-CD1 4.15Å; I92-L237 HydrophobicContact CB-CD2 3.88Å; I92-L237 HydrophobicContact CB-CG 4.26Å; I92-L237 HydrophobicContact CD1-CD1 4.22Å; I92-L237 HydrophobicContact CG2-CD1 4.35Å; I92-L237 HydrophobicContact CG2-CD2 3.82Å; I92-L237 WeakPolarHBondContact O-CD2 3.37Å; I92-L242 HydrophobicContact CD1-CD1 4.45Å; I92-L242 HydrophobicContact CD1-CD2 4.49Å; I92-L266 HydrophobicContact CD1-CD1 4.36Å; I92-L268 HydrophobicContact CD1-CD2 4.15Å
93	S	89.5	Confident	94.8	Very high	70 Å²	70	35.8 Å²	35.8	49%	0.49	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-38.7	-167.2	55.8	0	0	0	0	114.1	S103	S93-S103 PolarHBondContact N-O 2.97Å; S93-S103 VanDerWaalsContact OG-CB 3.31Å; S93-S103 WeakPolarHBondContact OG-CB 3.47Å; S93-S103 PolarHBondContact OG-O 3.45Å
94	K	90.9	Very high	94.7	Very high	104 Å²	104	35.8 Å²	35.8	45%	0.452	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	133.9	-177.2	-174.6	-171.7	173.1	-152.9	0	108.2	D96 Y102 S103	K94-D96 WeakPolarHBondContact CE-OD2 3.47Å; K94-D96 IonicContact NZ-OD2 3.37Å; K94-D96 PolarHBondContact NZ-OD2 3.27Å; K94-Y102 CarbonylContact O-C 3.57Å; K94-Y102 VanDerWaalsContact O-CA 3.31Å; K94-Y102 WeakPolarHBondContact O-CA 3.39Å; K94-S103 PolarHBondContact O-N 2.95Å
95	I	94	Very high	94.6	Very high	29 Å²	29	34.5 Å²	34.5	15%	0.149	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	120	167.1	-63.5	164.8	0	0	0	104.9	I92 M191 L237 F240 L268	I92-I95 HydrophobicContact CG2-CD1 4.4Å; I92-I95 HydrophobicContact CG2-CG1 4.17Å; I95-M191 HydrophobicContact CG2-CE 3.48Å; I95-M191 VanDerWaalsContact CG2-CE 3.48Å; I95-M191 HydrophobicContact CG2-SD 4.27Å; I95-L237 HydrophobicContact CD1-CD1 4.23Å; I95-L237 HydrophobicContact CD1-CD2 4.07Å; I95-F240 HydrophobicContact CB-CD2 4.2Å; I95-F240 HydrophobicContact CB-CE2 3.86Å; I95-F240 HydrophobicContact CD1-CB 3.96Å; I95-F240 HydrophobicContact CD1-CD1 4.38Å; I95-F240 HydrophobicContact CD1-CD2 3.36Å; I95-F240 HydrophobicContact CD1-CE2 3.81Å; I95-F240 HydrophobicContact CD1-CG 3.67Å; I95-F240 HydrophobicContact CD1-CZ 4.46Å; I95-F240 HydrophobicContact CG1-CD2 4.35Å; I95-F240 HydrophobicContact CG1-CE2 4.45Å; I95-F240 HydrophobicContact CG2-CD2 4.34Å; I95-F240 HydrophobicContact CG2-CE2 3.63Å; I95-F240 HydrophobicContact CG2-CZ 3.87Å; I95-L268 HydrophobicContact CD1-CD1 3.88Å; I95-L268 HydrophobicContact CD1-CD2 4.45Å
96	D	94.1	Very high	94.5	Very high	20 Å²	20	34.5 Å²	34.5	11%	0.107	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	99.8	-176.8	-167.1	-34.1	0	0	0	108.7	K94 V98 N99 M100 E101	K94-D96 WeakPolarHBondContact CE-OD2 3.47Å; K94-D96 IonicContact NZ-OD2 3.37Å; K94-D96 PolarHBondContact NZ-OD2 3.27Å; D96-V98 PolarHBondContact O-N 3.19Å; D96-V98 WeakPolarHBondContact OD1-CB 3.5Å; D96-V98 PolarHBondContact OD1-N 3.34Å; D96-N99 HydrophobicContact CB-CB 4.37Å; D96-N99 PolarHBondContact OD1-N 2.92Å; D96-N99 PolarHBondContact OD2-ND2 3.38Å; D96-M100 WeakPolarHBondContact O-CA 3.4Å; D96-M100 PolarHBondContact O-N 3.01Å; D96-E101 HydrophobicContact CB-CG 3.84Å; D96-E101 PolarHBondContact N-O 3.26Å; D96-E101 PolarHBondContact O-N 2.94Å
97	D	92.9	Very high	94.5	Very high	20 Å²	20	34.7 Å²	34.7	11%	0.107	18%	0.182	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-30.9	179.2	-65.1	-43.6	0	0	0	111.1	R270 L326 P327	D97-R270 IonicContact OD1-CZ 2.87Å; D97-R270 IonicContact OD1-NH1 3.93Å; D97-R270 PolarHBondContact OD1-NH1 2.9Å; D97-R270 IonicContact OD1-NH2 2.68Å; D97-R270 PolarHBondContact OD1-NH2 3.1Å; D97-R270 IonicContact OD2-CZ 2.97Å; D97-R270 IonicContact OD2-NH1 2.98Å; D97-R270 PolarHBondContact OD2-NH1 3.38Å; D97-R270 IonicContact OD2-NH2 2.76Å; D97-L326 HydrophobicContact CB-CD2 4.38Å; D97-P327 VanDerWaalsContact O-CD 3.25Å; D97-P327 WeakPolarHBondContact O-CD 3.3Å; D97-P327 VanDerWaalsContact O-CG 3.24Å; D97-P327 WeakPolarHBondContact O-CG 3.45Å
98	V	93.2	Very high	94.5	Very high	66 Å²	66	34.9 Å²	34.9	40%	0.4	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.8	-46.7	-175.9	-179.1	0	0	0	0	111.2	D96 M100 K325	D96-V98 PolarHBondContact O-N 3.19Å; D96-V98 WeakPolarHBondContact OD1-CB 3.5Å; D96-V98 PolarHBondContact OD1-N 3.34Å; V98-M100 VanDerWaalsContact C-N 3.31Å; V98-K325 WeakPolarHBondContact CG2-O 3.4Å
99	N	94.5	Very high	94.5	Very high	85 Å²	85	35.5 Å²	35.5	46%	0.455	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-1.2	-179.9	-67.4	-52.3	0	0	0	113.6	D96 E101 K155	D96-N99 HydrophobicContact CB-CB 4.37Å; D96-N99 PolarHBondContact OD1-N 2.92Å; D96-N99 PolarHBondContact OD2-ND2 3.38Å; N99-E101 HydrophobicContact CB-CG 3.78Å; N99-E101 PolarHBondContact O-N 3.33Å; N99-K155 PolarHBondContact O-NZ 3.15Å
100	M	95	Very high	94.6	Very high	60 Å²	60	35.7 Å²	35.7	30%	0.296	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	53.8	-176.8	-63	-174.2	176.9	0	0	111.6	D96 V98 C189 P327	D96-M100 WeakPolarHBondContact O-CA 3.4Å; D96-M100 PolarHBondContact O-N 3.01Å; V98-M100 VanDerWaalsContact C-N 3.31Å; M100-C189 CarbonylContact C-O 3.57Å; M100-C189 WeakPolarHBondContact CB-O 3.45Å; M100-C189 CarbonylContact O-C 3.51Å; M100-C189 PolarHBondContact O-N 3.5Å; M100-C189 VanDerWaalsContact O-O 3.12Å; M100-P327 HydrophobicContact CE-CG 4.18Å
101	E	96.4	Very high	94.8	Very high	32 Å²	32	32.6 Å²	32.6	15%	0.15	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	162.8	-176.3	65.2	-172.9	-149.7	0	0	112.4	D96 N99 K155 V186 L187	D96-E101 HydrophobicContact CB-CG 3.84Å; D96-E101 PolarHBondContact N-O 3.26Å; D96-E101 PolarHBondContact O-N 2.94Å; N99-E101 HydrophobicContact CB-CG 3.78Å; N99-E101 PolarHBondContact O-N 3.33Å; E101-K155 HydrophobicContact CB-CD 4.48Å; E101-K155 VanDerWaalsContact OE2-CD 3.24Å; E101-K155 WeakPolarHBondContact OE2-CD 3.48Å; E101-K155 IonicContact OE2-NZ 3.59Å; E101-K155 PolarHBondContact OE2-NZ 3.46Å; E101-V186 HydrophobicContact CB-CG1 3.99Å; E101-V186 HydrophobicContact CG-CG1 3.98Å; E101-L187 CarbonylContact C-O 3.51Å; E101-L187 VanDerWaalsContact CA-O 3.24Å; E101-L187 WeakPolarHBondContact CA-O 3.47Å; E101-L187 WeakPolarHBondContact CB-O 3.48Å
102	Y	95.8	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	145.6	174.9	71.5	-74.1	0	0	0	111.2	I92 K94 V104 V186 L187 C189 C203 L204 I205 L266	I92-Y102 HydrophobicContact CG2-CD2 4.32Å; K94-Y102 CarbonylContact O-C 3.57Å; K94-Y102 VanDerWaalsContact O-CA 3.31Å; K94-Y102 WeakPolarHBondContact O-CA 3.39Å; Y102-V104 HydrophobicContact CD2-CB 4.21Å; Y102-V104 HydrophobicContact CE2-CB 4Å; Y102-V104 HydrophobicContact CE2-CG1 4.04Å; Y102-V186 WeakPolarHBondContact O-CA 3.43Å; Y102-L187 HydrophobicContact CD1-CB 4.07Å; Y102-L187 WeakPolarHBondContact CD1-O 3.22Å; Y102-L187 HydrophobicContact CE1-CB 3.47Å; Y102-L187 VanDerWaalsContact CE1-CB 3.47Å; Y102-L187 HydrophobicContact CE1-CD1 4.34Å; Y102-L187 HydrophobicContact CE2-CB 4.45Å; Y102-L187 HydrophobicContact CE2-CD1 4.21Å; Y102-L187 PolarHBondContact N-O 2.86Å; Y102-L187 PolarHBondContact O-N 3.36Å; Y102-L187 VanDerWaalsContact OH-CD1 3.26Å; Y102-L187 WeakPolarHBondContact OH-CD1 3.38Å; Y102-C189 HydrophobicContact CD1-CB 3.59Å; Y102-C189 HydrophobicContact CE1-CB 3.93Å; Y102-C203 HydrophobicContact CD1-CB 3.98Å; Y102-C203 HydrophobicContact CE1-CB 3.65Å; Y102-L204 VanDerWaalsContact OH-C 3.28Å; Y102-L204 PolarHBondContact OH-O 2.92Å; Y102-I205 WeakPolarHBondContact OH-CG1 3.46Å; Y102-L266 HydrophobicContact CE2-CD1 3.89Å
103	S	95.8	Very high	95.1	Very high	24 Å²	24	33 Å²	33	17%	0.168	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	120.3	178.1	-52.7	0	0	0	0	110.1	I92 S93 K94 M185	I92-S103 CarbonylContact C-O 3.51Å; I92-S103 WeakPolarHBondContact CA-O 3.39Å; S93-S103 PolarHBondContact N-O 2.97Å; S93-S103 VanDerWaalsContact OG-CB 3.31Å; S93-S103 WeakPolarHBondContact OG-CB 3.47Å; S93-S103 PolarHBondContact OG-O 3.45Å; K94-S103 PolarHBondContact O-N 2.95Å; S103-M185 CarbonylContact C-O 3.56Å; S103-M185 VanDerWaalsContact CA-O 3.31Å; S103-M185 WeakPolarHBondContact CA-O 3.37Å
104	V	95.4	Very high	95.4	Very high	1 Å²	1	29.6 Å²	29.6	1%	0.006	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	142.9	179.8	64.2	0	0	0	0	110.6	M89 I92 Y102 F106 S184 M185 L187	M89-V104 HydrophobicContact CE-CG2 4.11Å; I92-V104 HydrophobicContact CG1-CG2 4.16Å; Y102-V104 HydrophobicContact CD2-CB 4.21Å; Y102-V104 HydrophobicContact CE2-CB 4Å; Y102-V104 HydrophobicContact CE2-CG1 4.04Å; V104-F106 HydrophobicContact CG1-CD1 3.94Å; V104-F106 HydrophobicContact CG1-CE1 3.93Å; V104-F106 HydrophobicContact CG2-CD1 4.11Å; V104-S184 WeakPolarHBondContact O-CA 3.3Å; V104-M185 HydrophobicContact CG1-CB 4.29Å; V104-M185 PolarHBondContact N-O 2.78Å; V104-M185 PolarHBondContact O-N 3.34Å; V104-L187 HydrophobicContact CG1-CD1 3.82Å; V104-L187 HydrophobicContact CG1-CG 4.41Å
105	Q	95.5	Very high	95.5	Very high	35 Å²	35	28.3 Å²	28.3	16%	0.164	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	130.4	167.5	-55.5	-168.5	16.7	0	0	109.3	R90 S91 L183 S184	R90-Q105 HydrophobicContact CB-CB 4.46Å; R90-Q105 WeakPolarHBondContact CB-O 3.42Å; R90-Q105 PolarHBondContact N-O 2.93Å; S91-Q105 PolarHBondContact N-O 2.61Å; S91-Q105 PolarHBondContact O-N 2.96Å; Q105-L183 WeakPolarHBondContact CA-O 3.46Å; Q105-S184 WeakPolarHBondContact CG-OG 3.43Å
106	F	95.8	Very high	95.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	159	177.3	58.4	-88.8	0	0	0	111.5	I87 M88 V104 F108 F151 L183 M185	I87-F106 HydrophobicContact CG2-CB 3.91Å; I87-F106 HydrophobicContact CG2-CD2 3.87Å; I87-F106 HydrophobicContact CG2-CG 4.04Å; M88-F106 CarbonylContact O-C 3.51Å; M88-F106 VanDerWaalsContact O-CA 3.25Å; M88-F106 WeakPolarHBondContact O-CA 3.26Å; M88-F106 WeakPolarHBondContact O-CB 3.26Å; V104-F106 HydrophobicContact CG1-CD1 3.94Å; V104-F106 HydrophobicContact CG1-CE1 3.93Å; V104-F106 HydrophobicContact CG2-CD1 4.11Å; F106-F108 HydrophobicContact CD2-CB 3.96Å; F106-F108 HydrophobicContact CE2-CB 3.77Å; F106-F108 HydrophobicContact CE2-CD2 4Å; F106-F108 HydrophobicContact CE2-CG 4.18Å; F106-F151 HydrophobicContact CE2-CE1 4.15Å; F106-F151 AromaticContact CE2-CZ 3.75Å; F106-F151 HydrophobicContact CE2-CZ 3.75Å; F106-F151 AromaticContact CZ-CE1 3.7Å; F106-F151 HydrophobicContact CZ-CE1 3.7Å; F106-F151 HydrophobicContact CZ-CE2 4.26Å; F106-F151 AromaticContact CZ-CZ 3.54Å; F106-F151 HydrophobicContact CZ-CZ 3.54Å; F106-L183 HydrophobicContact CE2-CB 4.38Å; F106-L183 HydrophobicContact CE2-CD1 4.03Å; F106-L183 HydrophobicContact CZ-CB 4.33Å; F106-L183 HydrophobicContact CZ-CD1 4.2Å; F106-L183 PolarHBondContact N-O 3.1Å; F106-L183 PolarHBondContact O-N 2.98Å; F106-M185 HydrophobicContact CE1-CB 4.39Å; F106-M185 HydrophobicContact CE1-CG 4.06Å; F106-M185 HydrophobicContact CE1-SD 3.63Å; F106-M185 HydrophobicContact CZ-CG 4.33Å; F106-M185 HydrophobicContact CZ-SD 3.4Å; F106-M185 WeakPolarHBondContact CZ-SD 3.26Å
107	T	96.7	Very high	95.4	Very high	7 Å²	7	30.2 Å²	30.2	4%	0.043	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	116.6	163.2	-72.3	0	0	0	0	107.6	M88 R90 R109 S180 V181	M88-T107 PolarHBondContact N-O 3.24Å; M88-T107 PolarHBondContact O-N 3.4Å; R90-T107 PolarHBondContact NE-OG1 3.4Å; R90-T107 PolarHBondContact NH2-OG1 3.16Å; T107-R109 HydrophobicContact CG2-CG 4.12Å; T107-S180 VanDerWaalsContact CG2-OG 3.27Å; T107-S180 WeakPolarHBondContact CG2-OG 3.44Å; T107-V181 CarbonylContact C-O 3.59Å; T107-V181 WeakPolarHBondContact CA-O 3.3Å
108	F	97.2	Very high	95.4	Very high	5 Å²	5	30.9 Å²	30.9	2%	0.022	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	135.1	176.6	-172.5	-120.5	0	0	0	109.1	V85 I87 F106 E110 T149 F151 S180 V181 L183 L207	V85-F108 HydrophobicContact CG1-CD2 4.35Å; V85-F108 HydrophobicContact CG1-CE2 3.47Å; V85-F108 VanDerWaalsContact CG1-CE2 3.47Å; V85-F108 HydrophobicContact CG1-CZ 4.04Å; I87-F108 HydrophobicContact CG1-CD2 4.08Å; I87-F108 HydrophobicContact CG1-CE2 4.44Å; F106-F108 HydrophobicContact CD2-CB 3.96Å; F106-F108 HydrophobicContact CE2-CB 3.77Å; F106-F108 HydrophobicContact CE2-CD2 4Å; F106-F108 HydrophobicContact CE2-CG 4.18Å; F108-E110 HydrophobicContact CD1-CG 4.25Å; F108-E110 HydrophobicContact CE1-CG 3.48Å; F108-E110 VanDerWaalsContact CE1-CG 3.48Å; F108-E110 WeakPolarHBondContact CE1-OE1 3.26Å; F108-E110 HydrophobicContact CZ-CG 3.62Å; F108-E110 VanDerWaalsContact CZ-OE1 3.27Å; F108-E110 WeakPolarHBondContact CZ-OE1 3.4Å; F108-T149 HydrophobicContact CE1-CG2 4.18Å; F108-T149 HydrophobicContact CZ-CG2 3.83Å; F108-F151 HydrophobicContact CD2-CZ 4.08Å; F108-F151 HydrophobicContact CE2-CZ 4.14Å; F108-F151 HydrophobicContact CG-CZ 4.41Å; F108-F151 HydrophobicContact CZ-CZ 4.49Å; F108-S180 CarbonylContact O-C 3.4Å; F108-S180 VanDerWaalsContact O-CA 3.28Å; F108-S180 WeakPolarHBondContact O-CA 3.18Å; F108-V181 HydrophobicContact CB-CG1 3.92Å; F108-V181 HydrophobicContact CD1-CG1 4.1Å; F108-V181 PolarHBondContact N-O 3.28Å; F108-V181 PolarHBondContact O-N 3.47Å; F108-L183 HydrophobicContact CB-CD1 3.97Å; F108-L183 HydrophobicContact CD1-CD1 4.48Å; F108-L183 HydrophobicContact CG-CD1 4.36Å; F108-L207 HydrophobicContact CE2-CD2 3.88Å; F108-L207 HydrophobicContact CZ-CD2 4.39Å
109	R	97.2	Very high	95.3	Very high	57 Å²	57	27.8 Å²	27.8	22%	0.215	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	138.3	178.9	-57.5	-171.2	-175.7	109.8	-4.8	110.6	V85 N86 T107 L178 Y179 S180	V85-R109 WeakPolarHBondContact CA-O 3.42Å; N86-R109 HydrophobicContact CB-CB 4.12Å; N86-R109 PolarHBondContact N-O 3Å; N86-R109 PolarHBondContact O-N 3.03Å; N86-R109 WeakPolarHBondContact OD1-CD 3.35Å; N86-R109 PolarHBondContact OD1-NH1 3.18Å; T107-R109 HydrophobicContact CG2-CG 4.12Å; R109-L178 HydrophobicContact CB-CD1 4.38Å; R109-Y179 CarbonylContact C-O 3.5Å; R109-Y179 VanDerWaalsContact CA-O 3.22Å; R109-Y179 WeakPolarHBondContact CA-O 3.32Å; R109-S180 WeakPolarHBondContact CG-OG 3.45Å
110	E	97.1	Very high	95	Very high	4 Å²	4	31.2 Å²	31.2	2%	0.019	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	137.2	177	-65.1	177.4	136.7	0	0	108.8	V83 N84 F108 W112 P147 T149 Y179	V83-E110 HydrophobicContact CG1-CB 3.95Å; V83-E110 HydrophobicContact CG1-CG 4.18Å; N84-E110 CarbonylContact O-C 3.55Å; N84-E110 WeakPolarHBondContact O-CA 3.16Å; F108-E110 HydrophobicContact CD1-CG 4.25Å; F108-E110 HydrophobicContact CE1-CG 3.48Å; F108-E110 VanDerWaalsContact CE1-CG 3.48Å; F108-E110 WeakPolarHBondContact CE1-OE1 3.26Å; F108-E110 HydrophobicContact CZ-CG 3.62Å; F108-E110 VanDerWaalsContact CZ-OE1 3.27Å; F108-E110 WeakPolarHBondContact CZ-OE1 3.4Å; E110-W112 HydrophobicContact CB-CE3 4.15Å; E110-W112 HydrophobicContact CB-CZ3 3.99Å; E110-P147 WeakPolarHBondContact OE2-CG 3.36Å; E110-T149 VanDerWaalsContact OE1-CB 3.32Å; E110-T149 WeakPolarHBondContact OE1-CB 3.23Å; E110-T149 PolarHBondContact OE1-OG1 3.07Å; E110-Y179 HydrophobicContact CB-CD1 4.43Å; E110-Y179 PolarHBondContact N-O 3.44Å; E110-Y179 PolarHBondContact O-N 3.14Å; E110-Y179 WeakPolarHBondContact OE2-CD1 3.34Å
111	Q	97	Very high	94.5	Very high	26 Å²	26	33.8 Å²	33.8	12%	0.121	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	122.9	176.5	-62.5	-176.6	-94.2	0	0	109.4	V83 N84 E176 M177 L178	V83-Q111 CarbonylContact C-O 3.33Å; N84-Q111 HydrophobicContact CB-CB 4.22Å; N84-Q111 PolarHBondContact N-O 3.34Å; N84-Q111 PolarHBondContact O-N 2.73Å; Q111-E176 PolarHBondContact NE2-OE1 3.48Å; Q111-M177 VanDerWaalsContact CA-O 3.23Å; Q111-M177 WeakPolarHBondContact CA-O 3.46Å; Q111-L178 HydrophobicContact CG-CB 4.37Å; Q111-L178 HydrophobicContact CG-CD1 3.49Å; Q111-L178 VanDerWaalsContact CG-CD1 3.49Å
112	W	96.8	Very high	93.9	Very high	4 Å²	4	35 Å²	35	2%	0.015	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	167.5	175	70.5	94.7	0	0	0	109.5	V81 V83 E110 W145 M146 P147 M177	V81-W112 HydrophobicContact CG1-CB 3.87Å; V81-W112 HydrophobicContact CG1-CG 4.34Å; V83-W112 HydrophobicContact CG2-CB 4.17Å; E110-W112 HydrophobicContact CB-CE3 4.15Å; E110-W112 HydrophobicContact CB-CZ3 3.99Å; W112-W145 AromaticContact CD1-CZ3 3.92Å; W112-W145 HydrophobicContact CD2-CZ3 4.45Å; W112-W145 HydrophobicContact CG-CZ3 4.36Å; W112-W145 VanDerWaalsContact CZ2-O 3.29Å; W112-W145 WeakPolarHBondContact CZ2-O 3.46Å; W112-W145 AromaticContact NE1-CE3 3.74Å; W112-W145 AromaticContact NE1-CZ3 3.76Å; W112-M146 HydrophobicContact CH2-CG 4.18Å; W112-M146 HydrophobicContact CZ2-CG 4.48Å; W112-P147 HydrophobicContact CE3-CG 4.4Å; W112-P147 HydrophobicContact CZ3-CG 4.33Å; W112-M177 HydrophobicContact CD2-CB 3.82Å; W112-M177 HydrophobicContact CE3-CB 4.27Å; W112-M177 HydrophobicContact CG-CB 4.3Å; W112-M177 HydrophobicContact CH2-CB 4.18Å; W112-M177 HydrophobicContact CZ2-CB 3.69Å; W112-M177 HydrophobicContact CZ2-CE 4.2Å; W112-M177 HydrophobicContact CZ2-CG 4.06Å; W112-M177 HydrophobicContact CZ3-CB 4.44Å; W112-M177 PolarHBondContact N-O 3.48Å; W112-M177 WeakPolarHBondContact O-CB 3.46Å; W112-M177 PolarHBondContact O-N 3Å
113	V	96.3	Very high	92.9	Very high	43 Å²	43	35.9 Å²	35.9	26%	0.261	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	128.9	176.8	-178.1	0	0	0	0	109.4	L70	L70-V113 HydrophobicContact CD1-CB 4.48Å; L70-V113 HydrophobicContact CD1-CG2 4.3Å; L70-V113 HydrophobicContact CD2-CB 4.22Å; L70-V113 HydrophobicContact CD2-CG1 4.03Å
114	D	95.4	Very high	91.7	Very high	0 Å²	0	38 Å²	38	0%	0	22%	0.216	C	C	.	.			trans	-122.4	99.4	168.3	-170.8	-12.2	0	0	0	109.3	Y61 P67 R116 L117 G175 M177	Y61-D114 VanDerWaalsContact CE2-OD2 3.28Å; Y61-D114 WeakPolarHBondContact CE2-OD2 3.28Å; Y61-D114 PolarHBondContact OH-OD2 3.48Å; P67-D114 HydrophobicContact CB-CB 4.13Å; P67-D114 HydrophobicContact CG-CB 3.91Å; D114-R116 PolarHBondContact O-N 3.37Å; D114-R116 VanDerWaalsContact O-N 3.08Å; D114-R116 VanDerWaalsContact OD1-CB 3.3Å; D114-R116 WeakPolarHBondContact OD1-CB 3.34Å; D114-R116 WeakPolarHBondContact OD1-CG 3.39Å; D114-R116 IonicContact OD1-CZ 3.48Å; D114-R116 PolarHBondContact OD1-N 2.92Å; D114-R116 VanDerWaalsContact OD1-N 3.13Å; D114-R116 IonicContact OD1-NE 3.53Å; D114-R116 PolarHBondContact OD1-NE 2.94Å; D114-R116 IonicContact OD1-NH2 2.9Å; D114-R116 IonicContact OD2-CZ 3.54Å; D114-R116 IonicContact OD2-NE 2.77Å; D114-R116 PolarHBondContact OD2-NE 3.2Å; D114-R116 IonicContact OD2-NH2 3.66Å; D114-R116 PolarHBondContact OD2-NH2 2.67Å; D114-L117 HydrophobicContact CB-CD1 4.11Å; D114-L117 HydrophobicContact CB-CG 4.29Å; D114-L117 PolarHBondContact O-N 3.45Å; D114-G175 PolarHBondContact N-O 2.98Å; D114-M177 HydrophobicContact CB-CG 4.25Å
115	S	92.5	Very high	90.4	Very high	77 Å²	77	43.4 Å²	43.4	54%	0.538	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-60.4	-21.4	-177.3	62	0	0	0	0	113.5	L117 A118	S115-L117 PolarHBondContact O-N 3.49Å; S115-A118 WeakPolarHBondContact O-CB 3.35Å; S115-A118 PolarHBondContact O-N 3.47Å
116	R	93.1	Very high	89.1	Confident	88 Å²	88	45.2 Å²	45.2	33%	0.332	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-69.3	-22.6	176.7	-57	172.4	-67.8	179	0.5	111.9	Y61 D62 V65 D114	Y61-R116 HydrophobicContact CD2-CB 3.92Å; Y61-R116 HydrophobicContact CE2-CB 3.89Å; Y61-R116 PolarHBondContact OH-NH2 3.46Å; Y61-R116 VanDerWaalsContact OH-NH2 3.15Å; D62-R116 PolarHBondContact O-NH1 3.27Å; V65-R116 PolarHBondContact O-NH1 2.94Å; V65-R116 PolarHBondContact O-NH2 3.43Å; D114-R116 PolarHBondContact O-N 3.37Å; D114-R116 VanDerWaalsContact O-N 3.08Å; D114-R116 VanDerWaalsContact OD1-CB 3.3Å; D114-R116 WeakPolarHBondContact OD1-CB 3.34Å; D114-R116 WeakPolarHBondContact OD1-CG 3.39Å; D114-R116 IonicContact OD1-CZ 3.48Å; D114-R116 PolarHBondContact OD1-N 2.92Å; D114-R116 VanDerWaalsContact OD1-N 3.13Å; D114-R116 IonicContact OD1-NE 3.53Å; D114-R116 PolarHBondContact OD1-NE 2.94Å; D114-R116 IonicContact OD1-NH2 2.9Å; D114-R116 IonicContact OD2-CZ 3.54Å; D114-R116 IonicContact OD2-NE 2.77Å; D114-R116 PolarHBondContact OD2-NE 3.2Å; D114-R116 IonicContact OD2-NH2 3.66Å; D114-R116 PolarHBondContact OD2-NH2 2.67Å
117	L	93.5	Very high	87.9	Confident	1 Å²	1	46 Å²	46	1%	0.005	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-97.8	2.1	-179.6	-57.5	175.6	0	0	0	113.1	V57 L58 Y61 D114 S115 V144 I171 M177	V57-L117 HydrophobicContact CG1-CB 3.89Å; V57-L117 HydrophobicContact CG1-CD2 3.22Å; V57-L117 HydrophobicContact CG1-CG 4.14Å; L58-L117 HydrophobicContact CD2-CD2 4.36Å; Y61-L117 HydrophobicContact CD2-CD2 3.47Å; Y61-L117 VanDerWaalsContact CD2-CD2 3.47Å; Y61-L117 HydrophobicContact CD2-CG 4.13Å; Y61-L117 HydrophobicContact CE2-CD1 4.08Å; Y61-L117 HydrophobicContact CE2-CD2 3.43Å; Y61-L117 VanDerWaalsContact CE2-CD2 3.43Å; Y61-L117 HydrophobicContact CE2-CG 3.63Å; Y61-L117 HydrophobicContact CG-CD2 4.04Å; D114-L117 HydrophobicContact CB-CD1 4.11Å; D114-L117 HydrophobicContact CB-CG 4.29Å; D114-L117 PolarHBondContact O-N 3.45Å; S115-L117 PolarHBondContact O-N 3.49Å; L117-V144 HydrophobicContact CD1-CB 4.38Å; L117-V144 HydrophobicContact CD1-CG1 3.97Å; L117-V144 HydrophobicContact CD2-CG1 4.44Å; L117-I171 HydrophobicContact CB-CG2 3.98Å; L117-I171 HydrophobicContact CD1-CD1 4.43Å; L117-M177 HydrophobicContact CB-SD 4.49Å; L117-M177 HydrophobicContact CD1-CE 3.93Å; L117-M177 HydrophobicContact CD1-CG 4.17Å; L117-M177 HydrophobicContact CD1-SD 3.46Å; L117-M177 WeakPolarHBondContact CD1-SD 3.36Å
118	A	93.2	Very high	87	Confident	33 Å²	33	53.8 Å²	53.8	27%	0.273	33%	0.332	S	S	.	.			trans	-67.9	133.4	178.6	0	0	0	0	0	111.5	S115	S115-A118 WeakPolarHBondContact O-CB 3.35Å; S115-A118 PolarHBondContact O-N 3.47Å
119	Y	91.5	Very high	86.4	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.008	34%	0.339	C	S	.	.			trans	-127.9	4.4	-177	59.6	-97.6	0	0	0	114.2	I53 V57 S121 M122 M129 P130 F132 V133 I171 Y172 P173	I53-Y119 HydrophobicContact CD1-CD2 4.43Å; I53-Y119 HydrophobicContact CG2-CD1 3.91Å; I53-Y119 HydrophobicContact CG2-CD2 3.98Å; I53-Y119 HydrophobicContact CG2-CE1 4.46Å; I53-Y119 HydrophobicContact CG2-CG 3.63Å; V57-Y119 HydrophobicContact CG2-CD1 4.38Å; Y119-S121 PolarHBondContact O-N 2.99Å; Y119-S121 VanDerWaalsContact O-N 3.13Å; Y119-M122 PolarHBondContact O-N 2.89Å; Y119-M129 HydrophobicContact CD2-CB 4.5Å; Y119-M129 HydrophobicContact CD2-CE 3.59Å; Y119-M129 HydrophobicContact CE2-CB 4.42Å; Y119-M129 HydrophobicContact CE2-CE 4.33Å; Y119-P130 HydrophobicContact CE2-CG 4.31Å; Y119-F132 VanDerWaalsContact OH-CA 3.24Å; Y119-F132 WeakPolarHBondContact OH-CA 3.28Å; Y119-V133 HydrophobicContact CE1-CG2 4.29Å; Y119-V133 HydrophobicContact CE2-CG2 4.39Å; Y119-V133 PolarHBondContact OH-N 3.4Å; Y119-I171 HydrophobicContact CD1-CG2 4.16Å; Y119-I171 HydrophobicContact CE1-CB 4.1Å; Y119-I171 HydrophobicContact CE1-CG2 3.78Å; Y119-I171 WeakPolarHBondContact CE1-O 3.31Å; Y119-I171 PolarHBondContact OH-O 3.39Å; Y119-Y172 WeakPolarHBondContact CE1-O 3.47Å; Y119-P173 HydrophobicContact CD2-CB 4.23Å; Y119-P173 HydrophobicContact CE2-CB 3.87Å; Y119-P173 HydrophobicContact CE2-CG 3.72Å; Y119-P173 PolarHBondContact N-O 2.91Å; Y119-P173 WeakPolarHBondContact OH-CD 3.5Å
120	K	88.2	Confident	85.9	Confident	157 Å²	157	54.1 Å²	54.1	68%	0.683	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.3	-35.7	178.6	-173.2	174.7	-177.7	178.6	0	113.3	P173	K120-P173 HydrophobicContact CB-CB 3.94Å; K120-P173 VanDerWaalsContact CB-O 3.26Å; K120-P173 WeakPolarHBondContact CB-O 3.33Å; K120-P173 HydrophobicContact CG-CB 4.43Å; K120-P173 PolarHBondContact N-O 3.42Å
121	S	84.5	Confident	85.6	Confident	113 Å²	113	62.3 Å²	62.3	79%	0.79	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.2	6.6	-177.8	59.8	0	0	0	0	114.7	Y119	Y119-S121 PolarHBondContact O-N 2.99Å; Y119-S121 VanDerWaalsContact O-N 3.13Å
122	M	82.7	Confident	85.4	Confident	57 Å²	57	64.3 Å²	64.3	28%	0.281	38%	0.383	S	S	.	.	S	Bend	trans	-83.9	-23.7	-179.5	-76.4	-158.2	-114	0	0	114.2	L48 K56 V57 Y119	L48-M122 HydrophobicContact CD1-CB 3.93Å; L48-M122 WeakPolarHBondContact CD1-O 3.19Å; K56-M122 HydrophobicContact CB-CE 4.34Å; K56-M122 HydrophobicContact CB-SD 3.63Å; K56-M122 HydrophobicContact CD-SD 3.86Å; K56-M122 HydrophobicContact CG-SD 4.4Å; V57-M122 HydrophobicContact CB-CE 4.35Å; V57-M122 HydrophobicContact CG2-CE 3.22Å; Y119-M122 PolarHBondContact O-N 2.89Å
123	G	75.6	Confident	85.1	Confident	19 Å²	19	64.2 Å²	64.2	20%	0.196	38%	0.383	C	S	.	.	S	Bend	trans	-69.2	156.6	175.8	0	0	0	0	0	112
124	A	71.1	Confident	84.8	Confident	69 Å²	69	65.2 Å²	65.2	57%	0.57	39%	0.389	S	S	*	.			trans	-56.9	146.7	166.1	0	0	0	0	0	109.6	G126 A127	A124-G126 PolarHBondContact O-N 3.29Å; A124-A127 WeakPolarHBondContact O-CB 3.44Å; A124-A127 PolarHBondContact O-N 3.19Å
125	A	68.1	Low	84.4	Confident	114 Å²	114	65.5 Å²	65.5	94%	0.942	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	113.2	179.6	0	0	0	0	0	110.6
126	G	68.1	Low	83.7	Confident	74 Å²	74	66.3 Å²	66.3	76%	0.763	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.3	-1.3	-176.7	0	0	0	0	0	116.3	A124	A124-G126 PolarHBondContact O-N 3.29Å
127	A	71.4	Confident	82.6	Confident	17 Å²	17	64.1 Å²	64.1	14%	0.14	39%	0.389	C	S	.	.	P	Polyproline II helix	trans	-75.9	128.5	171.9	0	0	0	0	0	110.7	A124 M129	A124-A127 WeakPolarHBondContact O-CB 3.44Å; A124-A127 PolarHBondContact O-N 3.19Å; A127-M129 PolarHBondContact O-N 2.98Å
128	E	77.7	Confident	81.3	Confident	169 Å²	169	68.8 Å²	68.8	79%	0.79	41%	0.414	S	S	*	.	P	Polyproline II helix	trans	-69.3	122.6	172	-66.6	-170.8	164	0	0	109.9
129	M	83.1	Confident	79.6	Confident	36 Å²	36	73.8 Å²	73.8	18%	0.177	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-87.1	147.9	174	-64.8	-57.1	-70.9	0	0	110.1	L48 I53 Y119 A127	L48-M129 HydrophobicContact CD1-CE 4.27Å; I53-M129 HydrophobicContact CD1-CE 3.44Å; I53-M129 VanDerWaalsContact CD1-CE 3.44Å; I53-M129 HydrophobicContact CG1-CE 3.83Å; Y119-M129 HydrophobicContact CD2-CB 4.5Å; Y119-M129 HydrophobicContact CD2-CE 3.59Å; Y119-M129 HydrophobicContact CE2-CB 4.42Å; Y119-M129 HydrophobicContact CE2-CE 4.33Å; A127-M129 PolarHBondContact O-N 2.98Å
130	P	87.5	Confident	77.8	Confident	33 Å²	33	82.7 Å²	82.7	21%	0.214	48%	0.478	C	S	.	.	P	Polyproline II helix	trans	-57.7	146	173.9	24.8	-33.5	0	0	0	110.7	I53 Y119 F132 V133 P173	I53-P130 HydrophobicContact CD1-CG 3.54Å; Y119-P130 HydrophobicContact CE2-CG 4.31Å; P130-F132 PolarHBondContact O-N 3.16Å; P130-V133 HydrophobicContact CG-CG2 3.99Å; P130-P173 WeakPolarHBondContact O-CG 3.5Å
131	K	90.4	Very high	76.3	Confident	176 Å²	176	78.6 Å²	78.6	77%	0.765	47%	0.469	S	S	*	.	S	Bend	trans	-61.7	-32.5	-177.8	-71.4	-173.9	179	-178.8	0	113.1	Y172 P173	K131-Y172 VanDerWaalsContact O-CD1 3.25Å; K131-Y172 WeakPolarHBondContact O-CD1 3.46Å; K131-P173 WeakPolarHBondContact O-CD 3.48Å
132	F	92.2	Very high	75.7	Confident	69 Å²	69	78.3 Å²	78.3	30%	0.303	46%	0.455	S	S	.	.			trans	-158	158.2	173.1	55	-96.3	0	0	0	108.3	Y119 P130 V134 R170 I171 Y172	Y119-F132 VanDerWaalsContact OH-CA 3.24Å; Y119-F132 WeakPolarHBondContact OH-CA 3.28Å; P130-F132 PolarHBondContact O-N 3.16Å; F132-V134 HydrophobicContact CD2-CG2 3.81Å; F132-V134 HydrophobicContact CE2-CG2 3.73Å; F132-R170 HydrophobicContact CB-CB 4.38Å; F132-R170 HydrophobicContact CD2-CG 4.06Å; F132-R170 HydrophobicContact CG-CG 4.47Å; F132-I171 CarbonylContact C-O 3.56Å; F132-I171 VanDerWaalsContact CA-O 3.23Å; F132-I171 WeakPolarHBondContact CA-O 3.09Å; F132-Y172 HydrophobicContact CB-CD1 4.06Å; F132-Y172 HydrophobicContact CB-CE1 4.08Å; F132-Y172 HydrophobicContact CD1-CE1 4.3Å
133	V	91.4	Very high	75.6	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.012	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	137	169.5	179.6	0	0	0	0	108.5	E50 I53 I54 Y119 P130 R170 I171	E50-V133 HydrophobicContact CB-CG1 4.39Å; E50-V133 HydrophobicContact CG-CG2 4.5Å; I53-V133 HydrophobicContact CD1-CG2 4.35Å; I53-V133 HydrophobicContact CG2-CG2 4.11Å; I54-V133 HydrophobicContact CD1-CG1 3.57Å; I54-V133 HydrophobicContact CG1-CG1 3.44Å; I54-V133 VanDerWaalsContact CG1-CG1 3.44Å; Y119-V133 HydrophobicContact CE1-CG2 4.29Å; Y119-V133 HydrophobicContact CE2-CG2 4.39Å; Y119-V133 PolarHBondContact OH-N 3.4Å; P130-V133 HydrophobicContact CG-CG2 3.99Å; V133-R170 WeakPolarHBondContact O-CA 3.5Å; V133-I171 PolarHBondContact N-O 3.3Å; V133-I171 PolarHBondContact O-N 3.36Å
134	V	90.6	Very high	76.4	Confident	63 Å²	63	77.6 Å²	77.6	38%	0.382	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	121.2	-178.5	-175.8	0	0	0	0	109.6	F132 I169 R170	F132-V134 HydrophobicContact CD2-CG2 3.81Å; F132-V134 HydrophobicContact CE2-CG2 3.73Å; V134-I169 WeakPolarHBondContact CA-O 3.35Å; V134-R170 HydrophobicContact CG2-CG 4.26Å
135	L	86.6	Confident	77.5	Confident	7 Å²	7	74.7 Å²	74.7	4%	0.037	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	124.5	167.5	-63	-176.4	0	0	0	109.1	I54 P137 V144 I169 I171	I54-L135 HydrophobicContact CD1-CD2 4.04Å; I54-L135 HydrophobicContact CG1-CD2 3.93Å; I54-L135 HydrophobicContact CG2-CD2 3.87Å; L135-P137 WeakPolarHBondContact O-CD 3.35Å; L135-V144 HydrophobicContact CD1-CG1 3.57Å; L135-V144 HydrophobicContact CD1-CG2 4.4Å; L135-I169 HydrophobicContact CB-CB 4.07Å; L135-I169 HydrophobicContact CB-CG2 4.11Å; L135-I169 HydrophobicContact CD1-CG2 4.12Å; L135-I169 HydrophobicContact CG-CG2 4.37Å; L135-I169 PolarHBondContact N-O 3.44Å; L135-I171 HydrophobicContact CD1-CD1 3.76Å; L135-I171 HydrophobicContact CD1-CG1 4.37Å; L135-I171 HydrophobicContact CD2-CD1 4.46Å; L135-I171 HydrophobicContact CG-CD1 3.99Å; L135-I171 HydrophobicContact CG-CG1 4.35Å
136	T	77.9	Confident	78.6	Confident	94 Å²	94	71.2 Å²	71.2	58%	0.577	39%	0.385	S	S	*	.	P	Polyproline II helix	trans	-87.7	117.3	168.2	-56.5	0	0	0	0	107.2	N138	T136-N138 PolarHBondContact O-N 2.98Å; T136-N138 VanDerWaalsContact O-N 3.15Å
137	P	69.4	Low	79.9	Confident	41 Å²	41	68.2 Å²	68.2	27%	0.266	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-61.7	121.9	176.2	14.5	-16.7	0	0	0	108.8	L135 V167	L135-P137 WeakPolarHBondContact O-CD 3.35Å; P137-V167 HydrophobicContact CG-CB 3.85Å; P137-V167 HydrophobicContact CG-CG1 3.88Å
138	N	66.5	Low	81	Confident	99 Å²	99	69.5 Å²	69.5	53%	0.529	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-76.1	138.5	166.8	-75.5	-10.6	0	0	0	107.8	T136 Q140 S141	T136-N138 PolarHBondContact O-N 2.98Å; T136-N138 VanDerWaalsContact O-N 3.15Å; N138-Q140 PolarHBondContact O-N 3.16Å; N138-S141 PolarHBondContact O-N 3.2Å
139	D	57.6	Low	81.9	Confident	138 Å²	138	62.9 Å²	62.9	74%	0.738	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.1	-12.5	-179.1	-72.5	-34.3	0	0	0	114.1	P165	D139-P165 WeakPolarHBondContact OD1-CG 3.4Å
140	Q	53.2	Low	82.5	Confident	189 Å²	189	64.3 Å²	64.3	88%	0.883	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.8	-11.5	-170.1	-63.1	-170.5	-8.8	0	0	115.7	N138	N138-Q140 PolarHBondContact O-N 3.16Å
141	S	57.3	Low	82.9	Confident	71 Å²	71	63.5 Å²	63.5	50%	0.497	33%	0.327	S	S	.	.			trans	-163.3	139.3	179	53.6	0	0	0	0	115.3	N138 Q143	N138-S141 PolarHBondContact O-N 3.2Å; S141-Q143 PolarHBondContact O-N 3.13Å
142	Q	70.8	Confident	83.2	Confident	107 Å²	107	58.9 Å²	58.9	50%	0.5	31%	0.308	S	S	.	.			trans	-67.8	121.5	161.3	-67.5	-175.8	-11.3	0	0	108.4	W63 M146	W63-Q142 HydrophobicContact CE3-CB 4.29Å; Q142-M146 HydrophobicContact CB-CE 4.13Å; Q142-M146 HydrophobicContact CG-CE 3.65Å
143	Q	82	Confident	83.4	Confident	58 Å²	58	56.9 Å²	56.9	27%	0.271	30%	0.3	S	S	.	.			trans	-98	-22.5	-177.7	-65.9	177.7	-7.2	0	0	112.9	S141	S141-Q143 PolarHBondContact O-N 3.13Å
144	V	91.5	Very high	83.6	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.018	32%	0.319	C	S	.	.	S	Bend	trans	-127.9	149.4	-178	-66.1	0	0	0	0	109.8	L58 Y61 L117 L135 M146 I169 M177	L58-V144 HydrophobicContact CD2-CG1 3.98Å; Y61-V144 HydrophobicContact CE1-CB 4.37Å; Y61-V144 HydrophobicContact CE1-CG1 4.5Å; L117-V144 HydrophobicContact CD1-CB 4.38Å; L117-V144 HydrophobicContact CD1-CG1 3.97Å; L117-V144 HydrophobicContact CD2-CG1 4.44Å; L135-V144 HydrophobicContact CD1-CG1 3.57Å; L135-V144 HydrophobicContact CD1-CG2 4.4Å; V144-M146 HydrophobicContact CG2-CG 4.46Å; V144-I169 HydrophobicContact CG2-CD1 4.19Å; V144-I169 HydrophobicContact CG2-CG2 4.35Å; V144-M177 HydrophobicContact CB-CE 4.35Å; V144-M177 HydrophobicContact CG1-CE 4.46Å; V144-M177 HydrophobicContact CG2-CE 4.06Å
145	W	93.8	Very high	83.9	Confident	8 Å²	8	62.7 Å²	62.7	3%	0.03	32%	0.322	C	S	.	.			trans	-62.6	139.5	171.8	178.9	89.6	0	0	0	109.2	Y61 W63 R66 P67 V81 W112 P147 Y212 I217	Y61-W145 WeakPolarHBondContact OH-CB 3.32Å; Y61-W145 PolarHBondContact OH-N 3.11Å; Y61-W145 VanDerWaalsContact OH-N 3.1Å; W63-W145 WeakPolarHBondContact O-CA 3.46Å; W63-W145 VanDerWaalsContact O-CB 3.3Å; W63-W145 WeakPolarHBondContact O-CB 3.39Å; W63-W145 VanDerWaalsContact O-CD1 3.29Å; R66-W145 HydrophobicContact CB-CZ2 4.17Å; R66-W145 HydrophobicContact CG-CH2 4.22Å; R66-W145 HydrophobicContact CG-CZ2 3.71Å; P67-W145 HydrophobicContact CG-CD2 4.12Å; P67-W145 HydrophobicContact CG-CE3 3.62Å; P67-W145 HydrophobicContact CG-CZ3 3.96Å; V81-W145 HydrophobicContact CG1-CH2 4.46Å; V81-W145 HydrophobicContact CG1-CZ3 4.44Å; W112-W145 AromaticContact CD1-CZ3 3.92Å; W112-W145 HydrophobicContact CD2-CZ3 4.45Å; W112-W145 HydrophobicContact CG-CZ3 4.36Å; W112-W145 VanDerWaalsContact CZ2-O 3.29Å; W112-W145 WeakPolarHBondContact CZ2-O 3.46Å; W112-W145 AromaticContact NE1-CE3 3.74Å; W112-W145 AromaticContact NE1-CZ3 3.76Å; W145-P147 HydrophobicContact CH2-CB 4.07Å; W145-Y212 HydrophobicContact CZ2-CE2 4.19Å; W145-Y212 PolarHBondContact NE1-OH 3.19Å; W145-I217 HydrophobicContact CH2-CD1 3.83Å; W145-I217 HydrophobicContact CZ2-CD1 3.79Å
146	M	92.6	Very high	84.4	Confident	41 Å²	41	68.2 Å²	68.2	20%	0.202	35%	0.347	C	S	.	.			trans	-134.1	145.2	175.3	-68.1	175.2	-76.2	0	0	108.3	W112 Q142 V144 I169 Y179	W112-M146 HydrophobicContact CH2-CG 4.18Å; W112-M146 HydrophobicContact CZ2-CG 4.48Å; Q142-M146 HydrophobicContact CB-CE 4.13Å; Q142-M146 HydrophobicContact CG-CE 3.65Å; V144-M146 HydrophobicContact CG2-CG 4.46Å; M146-I169 HydrophobicContact SD-CD1 4.47Å; M146-Y179 HydrophobicContact SD-CD2 4.19Å; M146-Y179 HydrophobicContact SD-CE2 3.98Å
147	P	95.2	Very high	85.2	Confident	12 Å²	12	66.1 Å²	66.1	8%	0.078	34%	0.34	C	S	.	.			trans	-60.6	145.9	172.8	28	-34.7	0	0	0	110.3	V83 E110 W112 W145 T149 I217	V83-P147 HydrophobicContact CG1-CG 4.3Å; V83-P147 HydrophobicContact CG2-CB 4.32Å; V83-P147 HydrophobicContact CG2-CG 4.45Å; E110-P147 WeakPolarHBondContact OE2-CG 3.36Å; W112-P147 HydrophobicContact CE3-CG 4.4Å; W112-P147 HydrophobicContact CZ3-CG 4.33Å; W145-P147 HydrophobicContact CH2-CB 4.07Å; P147-T149 PolarHBondContact O-N 3.19Å; P147-T149 VanDerWaalsContact O-N 3.1Å; P147-I217 HydrophobicContact CB-CD1 4.31Å
148	D	93.9	Very high	86.4	Confident	44 Å²	44	71 Å²	71	24%	0.235	35%	0.353	C	S	.	.			trans	-87.7	48.1	-177.7	65.1	-16.1	0	0	0	111.7	F150 S209 Y210 A211 Y212	D148-F150 PolarHBondContact O-N 3.34Å; D148-S209 WeakPolarHBondContact OD1-CB 3.45Å; D148-S209 PolarHBondContact OD1-OG 2.83Å; D148-S209 PolarHBondContact OD2-OG 3.1Å; D148-Y210 PolarHBondContact O-N 2.98Å; D148-Y210 PolarHBondContact OD2-N 3.01Å; D148-A211 VanDerWaalsContact OD2-CB 3.28Å; D148-A211 WeakPolarHBondContact OD2-CB 3.41Å; D148-A211 PolarHBondContact OD2-N 3.03Å; D148-Y212 WeakPolarHBondContact OD1-CD2 3.33Å
149	T	96.3	Very high	87.6	Confident	29 Å²	29	74.1 Å²	74.1	18%	0.178	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	122.2	-176.6	-50.1	0	0	0	0	111	F108 E110 P147 L207 A208 Y219	F108-T149 HydrophobicContact CE1-CG2 4.18Å; F108-T149 HydrophobicContact CZ-CG2 3.83Å; E110-T149 VanDerWaalsContact OE1-CB 3.32Å; E110-T149 WeakPolarHBondContact OE1-CB 3.23Å; E110-T149 PolarHBondContact OE1-OG1 3.07Å; P147-T149 PolarHBondContact O-N 3.19Å; P147-T149 VanDerWaalsContact O-N 3.1Å; T149-L207 HydrophobicContact CG2-CB 4.03Å; T149-L207 HydrophobicContact CG2-CD1 3.86Å; T149-L207 HydrophobicContact CG2-CG 4.46Å; T149-A208 WeakPolarHBondContact CA-O 3.26Å; T149-Y219 HydrophobicContact CG2-CE1 4.4Å; T149-Y219 WeakPolarHBondContact OG1-CE1 3.44Å; T149-Y219 PolarHBondContact OG1-OH 3.03Å
150	F	95.6	Very high	89.3	Confident	67 Å²	67	69 Å²	69	29%	0.294	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	156.9	172.2	83.5	-73.4	0	0	0	110.1	D148 Q152 L207 A208 S209 Y210	D148-F150 PolarHBondContact O-N 3.34Å; F150-Q152 HydrophobicContact CE2-CB 4.38Å; F150-Q152 HydrophobicContact CE2-CG 3.83Å; F150-Q152 HydrophobicContact CZ-CG 3.78Å; F150-L207 VanDerWaalsContact O-CA 3.3Å; F150-L207 WeakPolarHBondContact O-CA 3.34Å; F150-A208 WeakPolarHBondContact CD1-O 3.46Å; F150-A208 HydrophobicContact CE1-CB 3.85Å; F150-A208 HydrophobicContact CZ-CB 4.38Å; F150-A208 PolarHBondContact N-O 2.63Å; F150-A208 PolarHBondContact O-N 3.3Å; F150-S209 WeakPolarHBondContact CE1-O 3.48Å; F150-Y210 HydrophobicContact CD1-CD2 4.04Å; F150-Y210 HydrophobicContact CD1-CG 4.43Å; F150-Y210 HydrophobicContact CD2-CD2 4.42Å; F150-Y210 HydrophobicContact CE1-CD2 4.14Å; F150-Y210 HydrophobicContact CE2-CD2 4.49Å; F150-Y210 HydrophobicContact CG-CD2 4.18Å; F150-Y210 HydrophobicContact CZ-CD2 4.35Å
151	F	97	Very high	91.1	Very high	16 Å²	16	64.7 Å²	64.7	7%	0.07	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	119.9	178.5	-67.4	-90.9	0	0	0	109	F106 F108 N153 E154 L183 M185 L187 I205 D206 L207	F106-F151 HydrophobicContact CE2-CE1 4.15Å; F106-F151 AromaticContact CE2-CZ 3.75Å; F106-F151 HydrophobicContact CE2-CZ 3.75Å; F106-F151 AromaticContact CZ-CE1 3.7Å; F106-F151 HydrophobicContact CZ-CE1 3.7Å; F106-F151 HydrophobicContact CZ-CE2 4.26Å; F106-F151 AromaticContact CZ-CZ 3.54Å; F106-F151 HydrophobicContact CZ-CZ 3.54Å; F108-F151 HydrophobicContact CD2-CZ 4.08Å; F108-F151 HydrophobicContact CE2-CZ 4.14Å; F108-F151 HydrophobicContact CG-CZ 4.41Å; F108-F151 HydrophobicContact CZ-CZ 4.49Å; F151-N153 VanDerWaalsContact C-N 3.31Å; F151-N153 PolarHBondContact O-N 2.87Å; F151-E154 HydrophobicContact CB-CB 3.89Å; F151-E154 WeakPolarHBondContact O-CB 3.36Å; F151-E154 PolarHBondContact O-N 3.21Å; F151-L183 HydrophobicContact CE2-CD1 3.84Å; F151-L183 HydrophobicContact CZ-CD1 4.21Å; F151-M185 HydrophobicContact CB-CE 3.38Å; F151-M185 HydrophobicContact CB-SD 4.5Å; F151-M185 HydrophobicContact CD1-CE 4.09Å; F151-M185 HydrophobicContact CD1-SD 4.14Å; F151-M185 HydrophobicContact CD2-CE 3.28Å; F151-M185 HydrophobicContact CD2-SD 3.55Å; F151-M185 VanDerWaalsContact CD2-SD 3.55Å; F151-M185 HydrophobicContact CE1-SD 4.26Å; F151-M185 HydrophobicContact CE2-CE 4.07Å; F151-M185 HydrophobicContact CE2-SD 3.69Å; F151-M185 HydrophobicContact CG-CE 3.29Å; F151-M185 HydrophobicContact CG-SD 3.79Å; F151-M185 HydrophobicContact CZ-SD 4.06Å; F151-L187 HydrophobicContact CB-CD2 4.43Å; F151-I205 HydrophobicContact CD1-CG2 3.77Å; F151-I205 HydrophobicContact CE1-CG2 3.81Å; F151-D206 CarbonylContact C-O 3.59Å; F151-D206 WeakPolarHBondContact CA-O 3.36Å; F151-L207 HydrophobicContact CD1-CB 3.94Å; F151-L207 HydrophobicContact CE1-CB 3.97Å; F151-L207 HydrophobicContact CE1-CD2 4.26Å
152	Q	95.3	Very high	92.6	Very high	79 Å²	79	68.6 Å²	68.6	37%	0.369	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.2	-30.9	-168.6	-66.5	-173.7	-42.4	0	0	113.3	F150 D206 A208 C261	F150-Q152 HydrophobicContact CE2-CB 4.38Å; F150-Q152 HydrophobicContact CE2-CG 3.83Å; F150-Q152 HydrophobicContact CZ-CG 3.78Å; Q152-D206 HydrophobicContact CB-CB 4.13Å; Q152-D206 PolarHBondContact N-O 3.26Å; Q152-A208 HydrophobicContact CG-CB 4.19Å; Q152-C261 PolarHBondContact OE1-SG 3.36Å; Q152-C261 VanDerWaalsContact OE1-SG 3.41Å
153	N	96.2	Very high	93.4	Very high	26 Å²	26	70.4 Å²	70.4	14%	0.139	34%	0.336	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.1	19.8	-177.4	68.1	-38	0	0	0	113.2	F151 L187 S188 L204 D206	F151-N153 VanDerWaalsContact C-N 3.31Å; F151-N153 PolarHBondContact O-N 2.87Å; N153-L187 CarbonylContact O-C 3.52Å; N153-L187 WeakPolarHBondContact O-CA 3.36Å; N153-S188 PolarHBondContact ND2-O 3.06Å; N153-S188 VanDerWaalsContact ND2-O 3.08Å; N153-S188 PolarHBondContact O-N 3.33Å; N153-L204 PolarHBondContact ND2-O 3.43Å; N153-D206 PolarHBondContact OD1-N 3Å
154	E	96.8	Very high	93.6	Very high	87 Å²	87	74.2 Å²	74.2	41%	0.407	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	133.8	175.9	161.3	-94.3	146.7	0	0	112.1	F151 A157 M185 L187	F151-E154 HydrophobicContact CB-CB 3.89Å; F151-E154 WeakPolarHBondContact O-CB 3.36Å; F151-E154 PolarHBondContact O-N 3.21Å; E154-A157 HydrophobicContact CG-CB 3.92Å; E154-M185 HydrophobicContact CB-CE 3.65Å; E154-M185 HydrophobicContact CG-CE 3.75Å; E154-L187 HydrophobicContact CB-CD2 3.97Å
155	K	96.2	Very high	93.5	Very high	101 Å²	101	75.8 Å²	75.8	44%	0.439	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-36.9	169	-68.2	-173.5	-177.7	179.1	0	111.9	N99 E101 V186	N99-K155 PolarHBondContact O-NZ 3.15Å; E101-K155 HydrophobicContact CB-CD 4.48Å; E101-K155 VanDerWaalsContact OE2-CD 3.24Å; E101-K155 WeakPolarHBondContact OE2-CD 3.48Å; E101-K155 IonicContact OE2-NZ 3.59Å; E101-K155 PolarHBondContact OE2-NZ 3.46Å; K155-V186 PolarHBondContact N-O 3.06Å
156	E	96.4	Very high	93.4	Very high	122 Å²	122	78 Å²	78	57%	0.57	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148	135.5	176.3	-171.4	-173.9	162	0	0	108.7	M185 V186	E156-M185 CarbonylContact O-C 3.6Å; E156-M185 WeakPolarHBondContact O-CA 3.5Å; E156-V186 HydrophobicContact CB-CB 4.12Å; E156-V186 HydrophobicContact CB-CG2 4.21Å; E156-V186 PolarHBondContact N-O 3.49Å; E156-V186 PolarHBondContact O-N 3.32Å
157	A	95.5	Very high	93.3	Very high	51 Å²	51	77.6 Å²	77.6	42%	0.421	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	146.1	173.3	0	0	0	0	0	110.9	E154 M185	E154-A157 HydrophobicContact CG-CB 3.92Å; A157-M185 HydrophobicContact CB-CE 3.96Å; A157-M185 HydrophobicContact CB-CG 3.94Å
158	R	94.5	Very high	93.1	Very high	144 Å²	144	79.6 Å²	79.6	54%	0.543	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	140.6	175.8	63.3	-175.9	-176.6	142	1.4	111.9	S184	R158-S184 PolarHBondContact N-O 3.33Å; R158-S184 PolarHBondContact O-N 3.27Å; R158-S184 VanDerWaalsContact O-N 3.07Å
159	R	92.8	Very high	93.1	Very high	163 Å²	163	78 Å²	78	62%	0.615	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-85.5	146.2	168.2	-65.2	-176.1	-177.3	124.1	1.6	109.5	M161 V181 L183	R159-M161 HydrophobicContact CB-SD 4.3Å; R159-V181 HydrophobicContact CG-CG2 4.45Å; R159-L183 HydrophobicContact CG-CD2 3.81Å
160	H	92.9	Very high	93	Very high	32 Å²	32	80 Å²	80	15%	0.148	38%	0.38	C	S	.	.			trans	-89.2	124.7	175.8	-66.2	-95.2	0	0	0	110.3	N166 R182 S184	H160-N166 HydrophobicContact CB-CB 4.16Å; H160-N166 WeakPolarHBondContact CB-ND2 3.46Å; H160-N166 WeakPolarHBondContact O-CB 3.38Å; H160-N166 PolarHBondContact O-N 3.35Å; H160-R182 VanDerWaalsContact CD2-CG 3.48Å; H160-R182 WeakPolarHBondContact CD2-CG 3.29Å; H160-R182 PolarHBondContact CD2-O 3.05Å; H160-R182 PolarHBondContact NE2-NE 3.34Å; H160-S184 PolarHBondContact CE1-OG 3.42Å; H160-S184 PolarHBondContact NE2-OG 3.06Å
161	M	89.6	Confident	92.9	Very high	98 Å²	98	77.1 Å²	77.1	48%	0.483	37%	0.367	S	S	.	.			trans	-117.9	9.5	-171.4	-56.3	-61.7	-76.6	0	0	114.4	R159 K164 P165	R159-M161 HydrophobicContact CB-SD 4.3Å; M161-K164 CarbonylContact C-O 3.57Å; M161-K164 CarbonylContact O-C 3.53Å; M161-P165 HydrophobicContact CE-CB 3.78Å; M161-P165 HydrophobicContact CE-CG 3.55Å; M161-P165 HydrophobicContact SD-CB 3.86Å; M161-P165 HydrophobicContact SD-CG 4.27Å
162	I	89.4	Confident	92.8	Very high	152 Å²	152	79 Å²	79	78%	0.779	37%	0.374	S	S	*	.	S	Bend	trans	-114.6	133	-175.5	-58.8	175.5	0	0	0	109.2	K164	I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact N-O 2.84Å
163	D	87.8	Confident	92.7	Very high	145 Å²	145	76.6 Å²	76.6	78%	0.775	37%	0.365	S	S	*	.	S	Bend	cis	-76	-18.3	-8.8	64.8	-30.4	0	0	0	113.3
164	K	86.6	Confident	92.6	Very high	138 Å²	138	79.6 Å²	79.6	60%	0.6	38%	0.381	S	S	*	.	S	Bend	trans	-128.8	167.3	171.1	-71	-171.8	179.6	-175.4	0	110.2	M161 I162 N166	M161-K164 CarbonylContact C-O 3.57Å; M161-K164 CarbonylContact O-C 3.53Å; I162-K164 VanDerWaalsContact C-N 3.33Å; I162-K164 PolarHBondContact N-O 2.84Å; K164-N166 PolarHBondContact O-N 3.3Å; K164-N166 VanDerWaalsContact O-N 3.17Å; K164-N166 PolarHBondContact O-OD1 3.37Å
165	P	88.6	Confident	92.4	Very high	36 Å²	36	75.4 Å²	75.4	23%	0.234	36%	0.362	C	S	.	.			trans	-53.3	121.5	169.9	-21.5	30.5	0	0	0	111	D139 M161 V167	D139-P165 WeakPolarHBondContact OD1-CG 3.4Å; M161-P165 HydrophobicContact CE-CB 3.78Å; M161-P165 HydrophobicContact CE-CG 3.55Å; M161-P165 HydrophobicContact SD-CB 3.86Å; M161-P165 HydrophobicContact SD-CG 4.27Å; P165-V167 PolarHBondContact O-N 2.79Å
166	N	91.2	Very high	92.4	Very high	55 Å²	55	73.1 Å²	73.1	29%	0.294	35%	0.353	S	S	.	.			trans	-79.7	61.9	-179.9	-71.9	-26.5	0	0	0	111	H160 K164 V181 R182	H160-N166 HydrophobicContact CB-CB 4.16Å; H160-N166 WeakPolarHBondContact CB-ND2 3.46Å; H160-N166 WeakPolarHBondContact O-CB 3.38Å; H160-N166 PolarHBondContact O-N 3.35Å; K164-N166 PolarHBondContact O-N 3.3Å; K164-N166 VanDerWaalsContact O-N 3.17Å; K164-N166 PolarHBondContact O-OD1 3.37Å; N166-V181 WeakPolarHBondContact O-CA 3.31Å; N166-R182 HydrophobicContact CB-CB 3.94Å; N166-R182 PolarHBondContact O-N 3.12Å; N166-R182 VanDerWaalsContact O-N 3.1Å
167	V	91.3	Very high	92.3	Very high	33 Å²	33	67.3 Å²	67.3	20%	0.2	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	136.7	-178.9	178.5	0	0	0	0	108.4	P137 P165 I169 Y179 S180 V181	P137-V167 HydrophobicContact CG-CB 3.85Å; P137-V167 HydrophobicContact CG-CG1 3.88Å; P165-V167 PolarHBondContact O-N 2.79Å; V167-I169 HydrophobicContact CG1-CG1 4.4Å; V167-Y179 HydrophobicContact CG1-CD2 4.14Å; V167-Y179 HydrophobicContact CG1-CE2 3.49Å; V167-Y179 VanDerWaalsContact CG1-CE2 3.49Å; V167-S180 CarbonylContact C-O 3.58Å; V167-S180 WeakPolarHBondContact CA-O 3.25Å; V167-V181 HydrophobicContact CG2-CB 4.3Å; V167-V181 HydrophobicContact CG2-CG2 3.84Å
168	M	90.8	Very high	92.3	Very high	54 Å²	54	65.7 Å²	65.7	27%	0.266	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	126.7	176.1	178.5	-173.7	70.3	0	0	108.7	R170 L178 Y179 S180	M168-R170 HydrophobicContact CG-CG 4.27Å; M168-R170 HydrophobicContact SD-CG 4.36Å; M168-R170 PolarHBondContact SD-NE 3.41Å; M168-R170 VanDerWaalsContact SD-NE 3.42Å; M168-L178 HydrophobicContact CE-CD2 4.18Å; M168-Y179 CarbonylContact O-C 3.57Å; M168-Y179 WeakPolarHBondContact O-CA 3.42Å; M168-S180 PolarHBondContact N-O 3.39Å; M168-S180 PolarHBondContact O-N 2.93Å
169	I	93.5	Very high	92.4	Very high	10 Å²	10	60 Å²	60	5%	0.051	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	122.8	172.9	-63.8	163.1	0	0	0	107.5	V134 L135 V144 M146 V167 M177 L178 Y179	V134-I169 WeakPolarHBondContact CA-O 3.35Å; L135-I169 HydrophobicContact CB-CB 4.07Å; L135-I169 HydrophobicContact CB-CG2 4.11Å; L135-I169 HydrophobicContact CD1-CG2 4.12Å; L135-I169 HydrophobicContact CG-CG2 4.37Å; L135-I169 PolarHBondContact N-O 3.44Å; V144-I169 HydrophobicContact CG2-CD1 4.19Å; V144-I169 HydrophobicContact CG2-CG2 4.35Å; M146-I169 HydrophobicContact SD-CD1 4.47Å; V167-I169 HydrophobicContact CG1-CG1 4.4Å; I169-M177 HydrophobicContact CG2-CE 3.56Å; I169-L178 WeakPolarHBondContact CA-O 3.46Å; I169-Y179 HydrophobicContact CG1-CD2 3.87Å
170	R	94.3	Very high	92.5	Very high	72 Å²	72	52.8 Å²	52.8	27%	0.272	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	133.1	173.9	-70.5	-177.2	-179.7	167.2	-0.2	110	F132 V133 V134 M168 Y172 M177 L178	F132-R170 HydrophobicContact CB-CB 4.38Å; F132-R170 HydrophobicContact CD2-CG 4.06Å; F132-R170 HydrophobicContact CG-CG 4.47Å; V133-R170 WeakPolarHBondContact O-CA 3.5Å; V134-R170 HydrophobicContact CG2-CG 4.26Å; M168-R170 HydrophobicContact CG-CG 4.27Å; M168-R170 HydrophobicContact SD-CG 4.36Å; M168-R170 PolarHBondContact SD-NE 3.41Å; M168-R170 VanDerWaalsContact SD-NE 3.42Å; R170-Y172 HydrophobicContact CB-CE2 4.43Å; R170-M177 WeakPolarHBondContact O-CA 3.4Å; R170-L178 HydrophobicContact CB-CB 4.29Å; R170-L178 PolarHBondContact N-O 2.86Å; R170-L178 PolarHBondContact O-N 2.91Å
171	I	94.2	Very high	92.6	Very high	5 Å²	5	51.4 Å²	51.4	3%	0.026	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	119.7	172.9	-43	-171.5	0	0	0	107.8	L117 Y119 F132 V133 L135 M177	L117-I171 HydrophobicContact CB-CG2 3.98Å; L117-I171 HydrophobicContact CD1-CD1 4.43Å; Y119-I171 HydrophobicContact CD1-CG2 4.16Å; Y119-I171 HydrophobicContact CE1-CB 4.1Å; Y119-I171 HydrophobicContact CE1-CG2 3.78Å; Y119-I171 WeakPolarHBondContact CE1-O 3.31Å; Y119-I171 PolarHBondContact OH-O 3.39Å; F132-I171 CarbonylContact C-O 3.56Å; F132-I171 VanDerWaalsContact CA-O 3.23Å; F132-I171 WeakPolarHBondContact CA-O 3.09Å; V133-I171 PolarHBondContact N-O 3.3Å; V133-I171 PolarHBondContact O-N 3.36Å; L135-I171 HydrophobicContact CD1-CD1 3.76Å; L135-I171 HydrophobicContact CD1-CG1 4.37Å; L135-I171 HydrophobicContact CD2-CD1 4.46Å; L135-I171 HydrophobicContact CG-CD1 3.99Å; L135-I171 HydrophobicContact CG-CG1 4.35Å; I171-M177 HydrophobicContact CB-SD 4.04Å; I171-M177 HydrophobicContact CD1-SD 4.17Å; I171-M177 HydrophobicContact CG1-CE 4.07Å; I171-M177 HydrophobicContact CG1-SD 3.62Å; I171-M177 HydrophobicContact CG2-SD 3.86Å
172	Y	95.3	Very high	92.9	Very high	56 Å²	56	50.7 Å²	50.7	22%	0.22	25%	0.249	C	C	.	.			trans	-87.2	158.3	173.8	-68.5	-87.7	0	0	0	111	Y119 K131 F132 R170 D174 G175 E176 L178	Y119-Y172 WeakPolarHBondContact CE1-O 3.47Å; K131-Y172 VanDerWaalsContact O-CD1 3.25Å; K131-Y172 WeakPolarHBondContact O-CD1 3.46Å; F132-Y172 HydrophobicContact CB-CD1 4.06Å; F132-Y172 HydrophobicContact CB-CE1 4.08Å; F132-Y172 HydrophobicContact CD1-CE1 4.3Å; R170-Y172 HydrophobicContact CB-CE2 4.43Å; Y172-D174 VanDerWaalsContact CB-OD1 3.22Å; Y172-D174 WeakPolarHBondContact CB-OD1 3.34Å; Y172-D174 PolarHBondContact O-N 3.45Å; Y172-D174 VanDerWaalsContact O-N 3.15Å; Y172-G175 PolarHBondContact O-N 2.92Å; Y172-E176 HydrophobicContact CD2-CB 4.07Å; Y172-E176 HydrophobicContact CD2-CG 4.33Å; Y172-E176 WeakPolarHBondContact CD2-O 3.42Å; Y172-E176 HydrophobicContact CG-CB 4.42Å; Y172-E176 PolarHBondContact N-O 2.96Å; Y172-L178 HydrophobicContact CE2-CB 3.97Å
173	P	93.4	Very high	93.2	Very high	29 Å²	29	44.3 Å²	44.3	19%	0.188	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32	-173.6	-27.8	33.8	0	0	0	114.8	Y119 K120 P130 K131 G175	Y119-P173 HydrophobicContact CD2-CB 4.23Å; Y119-P173 HydrophobicContact CE2-CB 3.87Å; Y119-P173 HydrophobicContact CE2-CG 3.72Å; Y119-P173 PolarHBondContact N-O 2.91Å; Y119-P173 WeakPolarHBondContact OH-CD 3.5Å; K120-P173 HydrophobicContact CB-CB 3.94Å; K120-P173 VanDerWaalsContact CB-O 3.26Å; K120-P173 WeakPolarHBondContact CB-O 3.33Å; K120-P173 HydrophobicContact CG-CB 4.43Å; K120-P173 PolarHBondContact N-O 3.42Å; P130-P173 WeakPolarHBondContact O-CG 3.5Å; K131-P173 WeakPolarHBondContact O-CD 3.48Å; P173-G175 VanDerWaalsContact C-N 3.27Å; P173-G175 PolarHBondContact O-N 2.86Å
174	D	93.2	Very high	93.6	Very high	88 Å²	88	37.8 Å²	37.8	47%	0.471	18%	0.182	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.3	178.7	60.3	-15.3	0	0	0	114.1	Y172 E176	Y172-D174 VanDerWaalsContact CB-OD1 3.22Å; Y172-D174 WeakPolarHBondContact CB-OD1 3.34Å; Y172-D174 PolarHBondContact O-N 3.45Å; Y172-D174 VanDerWaalsContact O-N 3.15Å; D174-E176 WeakPolarHBondContact OD1-CB 3.23Å; D174-E176 PolarHBondContact OD1-N 3.25Å; D174-E176 VanDerWaalsContact OD1-N 3.12Å
175	G	93.2	Very high	94.1	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	S	Bend	trans	91.1	6.5	-175.5	0	0	0	0	0	113.5	D114 Y172 P173 M177	D114-G175 PolarHBondContact N-O 2.98Å; Y172-G175 PolarHBondContact O-N 2.92Å; P173-G175 VanDerWaalsContact C-N 3.27Å; P173-G175 PolarHBondContact O-N 2.86Å; G175-M177 PolarHBondContact O-N 3.37Å
176	E	95.7	Very high	94.6	Very high	53 Å²	53	30.7 Å²	30.7	25%	0.248	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	130.6	167.8	-168.5	-170	165.6	0	0	109.4	Q111 Y172 D174	Q111-E176 PolarHBondContact NE2-OE1 3.48Å; Y172-E176 HydrophobicContact CD2-CB 4.07Å; Y172-E176 HydrophobicContact CD2-CG 4.33Å; Y172-E176 WeakPolarHBondContact CD2-O 3.42Å; Y172-E176 HydrophobicContact CG-CB 4.42Å; Y172-E176 PolarHBondContact N-O 2.96Å; D174-E176 WeakPolarHBondContact OD1-CB 3.23Å; D174-E176 PolarHBondContact OD1-N 3.25Å; D174-E176 VanDerWaalsContact OD1-N 3.12Å
177	M	95.2	Very high	94.9	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	130.9	176.8	-68.5	-65	-66.7	0	0	108.6	Q111 W112 D114 L117 V144 I169 R170 I171 G175	Q111-M177 VanDerWaalsContact CA-O 3.23Å; Q111-M177 WeakPolarHBondContact CA-O 3.46Å; W112-M177 HydrophobicContact CD2-CB 3.82Å; W112-M177 HydrophobicContact CE3-CB 4.27Å; W112-M177 HydrophobicContact CG-CB 4.3Å; W112-M177 HydrophobicContact CH2-CB 4.18Å; W112-M177 HydrophobicContact CZ2-CB 3.69Å; W112-M177 HydrophobicContact CZ2-CE 4.2Å; W112-M177 HydrophobicContact CZ2-CG 4.06Å; W112-M177 HydrophobicContact CZ3-CB 4.44Å; W112-M177 PolarHBondContact N-O 3.48Å; W112-M177 WeakPolarHBondContact O-CB 3.46Å; W112-M177 PolarHBondContact O-N 3Å; D114-M177 HydrophobicContact CB-CG 4.25Å; L117-M177 HydrophobicContact CB-SD 4.49Å; L117-M177 HydrophobicContact CD1-CE 3.93Å; L117-M177 HydrophobicContact CD1-CG 4.17Å; L117-M177 HydrophobicContact CD1-SD 3.46Å; L117-M177 WeakPolarHBondContact CD1-SD 3.36Å; V144-M177 HydrophobicContact CB-CE 4.35Å; V144-M177 HydrophobicContact CG1-CE 4.46Å; V144-M177 HydrophobicContact CG2-CE 4.06Å; I169-M177 HydrophobicContact CG2-CE 3.56Å; R170-M177 WeakPolarHBondContact O-CA 3.4Å; I171-M177 HydrophobicContact CB-SD 4.04Å; I171-M177 HydrophobicContact CD1-SD 4.17Å; I171-M177 HydrophobicContact CG1-CE 4.07Å; I171-M177 HydrophobicContact CG1-SD 3.62Å; I171-M177 HydrophobicContact CG2-SD 3.86Å; G175-M177 PolarHBondContact O-N 3.37Å
178	L	95.6	Very high	95.2	Very high	17 Å²	17	28.4 Å²	28.4	9%	0.089	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.1	167.7	169.1	66.8	0	0	0	109	R109 Q111 M168 I169 R170 Y172	R109-L178 HydrophobicContact CB-CD1 4.38Å; Q111-L178 HydrophobicContact CG-CB 4.37Å; Q111-L178 HydrophobicContact CG-CD1 3.49Å; Q111-L178 VanDerWaalsContact CG-CD1 3.49Å; M168-L178 HydrophobicContact CE-CD2 4.18Å; I169-L178 WeakPolarHBondContact CA-O 3.46Å; R170-L178 HydrophobicContact CB-CB 4.29Å; R170-L178 PolarHBondContact N-O 2.86Å; R170-L178 PolarHBondContact O-N 2.91Å; Y172-L178 HydrophobicContact CE2-CB 3.97Å
179	Y	95.1	Very high	95.5	Very high	23 Å²	23	25.8 Å²	25.8	9%	0.09	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	136.2	170	174.6	-114	0	0	0	109.7	R109 E110 M146 V167 M168 I169 V181	R109-Y179 CarbonylContact C-O 3.5Å; R109-Y179 VanDerWaalsContact CA-O 3.22Å; R109-Y179 WeakPolarHBondContact CA-O 3.32Å; E110-Y179 HydrophobicContact CB-CD1 4.43Å; E110-Y179 PolarHBondContact N-O 3.44Å; E110-Y179 PolarHBondContact O-N 3.14Å; E110-Y179 WeakPolarHBondContact OE2-CD1 3.34Å; M146-Y179 HydrophobicContact SD-CD2 4.19Å; M146-Y179 HydrophobicContact SD-CE2 3.98Å; V167-Y179 HydrophobicContact CG1-CD2 4.14Å; V167-Y179 HydrophobicContact CG1-CE2 3.49Å; V167-Y179 VanDerWaalsContact CG1-CE2 3.49Å; M168-Y179 CarbonylContact O-C 3.57Å; M168-Y179 WeakPolarHBondContact O-CA 3.42Å; I169-Y179 HydrophobicContact CG1-CD2 3.87Å; Y179-V181 HydrophobicContact CE1-CB 4.15Å; Y179-V181 HydrophobicContact CE1-CG1 3.64Å; Y179-V181 HydrophobicContact CE2-CB 4.49Å
180	S	95.2	Very high	95.6	Very high	13 Å²	13	30.3 Å²	30.3	9%	0.091	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	130.5	173.6	-172.8	0	0	0	0	110.8	T107 F108 R109 V167 M168	T107-S180 VanDerWaalsContact CG2-OG 3.27Å; T107-S180 WeakPolarHBondContact CG2-OG 3.44Å; F108-S180 CarbonylContact O-C 3.4Å; F108-S180 VanDerWaalsContact O-CA 3.28Å; F108-S180 WeakPolarHBondContact O-CA 3.18Å; R109-S180 WeakPolarHBondContact CG-OG 3.45Å; V167-S180 CarbonylContact C-O 3.58Å; V167-S180 WeakPolarHBondContact CA-O 3.25Å; M168-S180 PolarHBondContact N-O 3.39Å; M168-S180 PolarHBondContact O-N 2.93Å
181	V	95.1	Very high	95.6	Very high	3 Å²	3	27.3 Å²	27.3	2%	0.018	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	145.9	178.9	60.2	0	0	0	0	110.9	T107 F108 R159 N166 V167 Y179 L183	T107-V181 CarbonylContact C-O 3.59Å; T107-V181 WeakPolarHBondContact CA-O 3.3Å; F108-V181 HydrophobicContact CB-CG1 3.92Å; F108-V181 HydrophobicContact CD1-CG1 4.1Å; F108-V181 PolarHBondContact N-O 3.28Å; F108-V181 PolarHBondContact O-N 3.47Å; R159-V181 HydrophobicContact CG-CG2 4.45Å; N166-V181 WeakPolarHBondContact O-CA 3.31Å; V167-V181 HydrophobicContact CG2-CB 4.3Å; V167-V181 HydrophobicContact CG2-CG2 3.84Å; Y179-V181 HydrophobicContact CE1-CB 4.15Å; Y179-V181 HydrophobicContact CE1-CG1 3.64Å; Y179-V181 HydrophobicContact CE2-CB 4.49Å; V181-L183 HydrophobicContact CG1-CD1 4.2Å; V181-L183 HydrophobicContact CG1-CD2 4.2Å; V181-L183 HydrophobicContact CG1-CG 4.03Å; V181-L183 HydrophobicContact CG2-CD2 3.87Å; V181-L183 HydrophobicContact CG2-CG 4.35Å
182	R	95.8	Very high	95.6	Very high	83 Å²	83	30.2 Å²	30.2	31%	0.313	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	124.5	168.9	-170.8	-172.4	170.6	171	-0.2	109.8	H160 N166	H160-R182 VanDerWaalsContact CD2-CG 3.48Å; H160-R182 WeakPolarHBondContact CD2-CG 3.29Å; H160-R182 PolarHBondContact CD2-O 3.05Å; H160-R182 PolarHBondContact NE2-NE 3.34Å; N166-R182 HydrophobicContact CB-CB 3.94Å; N166-R182 PolarHBondContact O-N 3.12Å; N166-R182 VanDerWaalsContact O-N 3.1Å
183	L	96.1	Very high	95.6	Very high	17 Å²	17	27.6 Å²	27.6	9%	0.089	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.2	179.4	-59.8	176.5	0	0	0	110.8	Q105 F106 F108 F151 R159 V181 M185	Q105-L183 WeakPolarHBondContact CA-O 3.46Å; F106-L183 HydrophobicContact CE2-CB 4.38Å; F106-L183 HydrophobicContact CE2-CD1 4.03Å; F106-L183 HydrophobicContact CZ-CB 4.33Å; F106-L183 HydrophobicContact CZ-CD1 4.2Å; F106-L183 PolarHBondContact N-O 3.1Å; F106-L183 PolarHBondContact O-N 2.98Å; F108-L183 HydrophobicContact CB-CD1 3.97Å; F108-L183 HydrophobicContact CD1-CD1 4.48Å; F108-L183 HydrophobicContact CG-CD1 4.36Å; F151-L183 HydrophobicContact CE2-CD1 3.84Å; F151-L183 HydrophobicContact CZ-CD1 4.21Å; R159-L183 HydrophobicContact CG-CD2 3.81Å; V181-L183 HydrophobicContact CG1-CD1 4.2Å; V181-L183 HydrophobicContact CG1-CD2 4.2Å; V181-L183 HydrophobicContact CG1-CG 4.03Å; V181-L183 HydrophobicContact CG2-CD2 3.87Å; V181-L183 HydrophobicContact CG2-CG 4.35Å; L183-M185 HydrophobicContact CB-CG 4.25Å; L183-M185 HydrophobicContact CD1-SD 4.4Å
184	S	97.1	Very high	95.6	Very high	8 Å²	8	30.7 Å²	30.7	6%	0.056	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	128	160.2	-71.9	0	0	0	0	107.7	V104 Q105 R158 H160	V104-S184 WeakPolarHBondContact O-CA 3.3Å; Q105-S184 WeakPolarHBondContact CG-OG 3.43Å; R158-S184 PolarHBondContact N-O 3.33Å; R158-S184 PolarHBondContact O-N 3.27Å; R158-S184 VanDerWaalsContact O-N 3.07Å; H160-S184 PolarHBondContact CE1-OG 3.42Å; H160-S184 PolarHBondContact NE2-OG 3.06Å
185	M	96.8	Very high	95.7	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.02	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	143.9	-175.1	-62.2	-172	70.4	0	0	111	S103 V104 F106 F151 E154 E156 A157 L183 L187	S103-M185 CarbonylContact C-O 3.56Å; S103-M185 VanDerWaalsContact CA-O 3.31Å; S103-M185 WeakPolarHBondContact CA-O 3.37Å; V104-M185 HydrophobicContact CG1-CB 4.29Å; V104-M185 PolarHBondContact N-O 2.78Å; V104-M185 PolarHBondContact O-N 3.34Å; F106-M185 HydrophobicContact CE1-CB 4.39Å; F106-M185 HydrophobicContact CE1-CG 4.06Å; F106-M185 HydrophobicContact CE1-SD 3.63Å; F106-M185 HydrophobicContact CZ-CG 4.33Å; F106-M185 HydrophobicContact CZ-SD 3.4Å; F106-M185 WeakPolarHBondContact CZ-SD 3.26Å; F151-M185 HydrophobicContact CB-CE 3.38Å; F151-M185 HydrophobicContact CB-SD 4.5Å; F151-M185 HydrophobicContact CD1-CE 4.09Å; F151-M185 HydrophobicContact CD1-SD 4.14Å; F151-M185 HydrophobicContact CD2-CE 3.28Å; F151-M185 HydrophobicContact CD2-SD 3.55Å; F151-M185 VanDerWaalsContact CD2-SD 3.55Å; F151-M185 HydrophobicContact CE1-SD 4.26Å; F151-M185 HydrophobicContact CE2-CE 4.07Å; F151-M185 HydrophobicContact CE2-SD 3.69Å; F151-M185 HydrophobicContact CG-CE 3.29Å; F151-M185 HydrophobicContact CG-SD 3.79Å; F151-M185 HydrophobicContact CZ-SD 4.06Å; E154-M185 HydrophobicContact CB-CE 3.65Å; E154-M185 HydrophobicContact CG-CE 3.75Å; E156-M185 CarbonylContact O-C 3.6Å; E156-M185 WeakPolarHBondContact O-CA 3.5Å; A157-M185 HydrophobicContact CB-CE 3.96Å; A157-M185 HydrophobicContact CB-CG 3.94Å; L183-M185 HydrophobicContact CB-CG 4.25Å; L183-M185 HydrophobicContact CD1-SD 4.4Å; M185-L187 HydrophobicContact CB-CD2 4.28Å; M185-L187 HydrophobicContact CB-CG 4.16Å; M185-L187 HydrophobicContact CE-CD2 3.7Å
186	V	97.8	Very high	95.7	Very high	21 Å²	21	31.3 Å²	31.3	13%	0.127	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	113.3	164.4	-176	0	0	0	0	106.6	E101 Y102 K155 E156	E101-V186 HydrophobicContact CB-CG1 3.99Å; E101-V186 HydrophobicContact CG-CG1 3.98Å; Y102-V186 WeakPolarHBondContact O-CA 3.43Å; K155-V186 PolarHBondContact N-O 3.06Å; E156-V186 HydrophobicContact CB-CB 4.12Å; E156-V186 HydrophobicContact CB-CG2 4.21Å; E156-V186 PolarHBondContact N-O 3.49Å; E156-V186 PolarHBondContact O-N 3.32Å
187	L	98	Very high	95.6	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.1	-176	-64.7	175.2	0	0	0	109.5	E101 Y102 V104 F151 N153 E154 M185 I205	E101-L187 CarbonylContact C-O 3.51Å; E101-L187 VanDerWaalsContact CA-O 3.24Å; E101-L187 WeakPolarHBondContact CA-O 3.47Å; E101-L187 WeakPolarHBondContact CB-O 3.48Å; Y102-L187 HydrophobicContact CD1-CB 4.07Å; Y102-L187 WeakPolarHBondContact CD1-O 3.22Å; Y102-L187 HydrophobicContact CE1-CB 3.47Å; Y102-L187 VanDerWaalsContact CE1-CB 3.47Å; Y102-L187 HydrophobicContact CE1-CD1 4.34Å; Y102-L187 HydrophobicContact CE2-CB 4.45Å; Y102-L187 HydrophobicContact CE2-CD1 4.21Å; Y102-L187 PolarHBondContact N-O 2.86Å; Y102-L187 PolarHBondContact O-N 3.36Å; Y102-L187 VanDerWaalsContact OH-CD1 3.26Å; Y102-L187 WeakPolarHBondContact OH-CD1 3.38Å; V104-L187 HydrophobicContact CG1-CD1 3.82Å; V104-L187 HydrophobicContact CG1-CG 4.41Å; F151-L187 HydrophobicContact CB-CD2 4.43Å; N153-L187 CarbonylContact O-C 3.52Å; N153-L187 WeakPolarHBondContact O-CA 3.36Å; E154-L187 HydrophobicContact CB-CD2 3.97Å; M185-L187 HydrophobicContact CB-CD2 4.28Å; M185-L187 HydrophobicContact CB-CG 4.16Å; M185-L187 HydrophobicContact CE-CD2 3.7Å; L187-I205 HydrophobicContact CD1-CB 4.18Å; L187-I205 HydrophobicContact CD1-CD1 4.45Å; L187-I205 HydrophobicContact CD1-CG1 3.68Å; L187-I205 HydrophobicContact CD1-CG2 4Å
188	S	97.5	Very high	95.5	Very high	40 Å²	40	30.4 Å²	30.4	28%	0.28	16%	0.161	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	130.6	172.4	-172.3	0	0	0	0	110.1	N153	N153-S188 PolarHBondContact ND2-O 3.06Å; N153-S188 VanDerWaalsContact ND2-O 3.08Å; N153-S188 PolarHBondContact O-N 3.33Å
189	C	97.3	Very high	95.4	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.157	C	C	.	.			trans	-134.7	98.3	174.1	178.3	0	0	0	0	108.8	M100 Y102 M191 C203	M100-C189 CarbonylContact C-O 3.57Å; M100-C189 WeakPolarHBondContact CB-O 3.45Å; M100-C189 CarbonylContact O-C 3.51Å; M100-C189 PolarHBondContact O-N 3.5Å; M100-C189 VanDerWaalsContact O-O 3.12Å; Y102-C189 HydrophobicContact CD1-CB 3.59Å; Y102-C189 HydrophobicContact CE1-CB 3.93Å; C189-M191 HydrophobicContact CB-CE 4.28Å; C189-M191 WeakPolarHBondContact O-CG 3.39Å; C189-M191 PolarHBondContact O-N 3.37Å; C189-C203 HydrophobicContact CB-CB 3.77Å; C189-C203 WeakPolarHBondContact CB-SG 3.21Å; C189-C203 WeakPolarHBondContact SG-CA 3.3Å; C189-C203 WeakPolarHBondContact SG-CB 3.34Å; C189-C203 CovalentContact SG-SG 2.04Å; C189-C203 PolarHBondContact SG-SG 3.2Å
190	P	95.4	Very high	95.4	Very high	105 Å²	105	36 Å²	36	68%	0.682	18%	0.181	S	C	*	.			trans	-69.4	96.5	177.1	28.5	-33.2	0	0	0	109.9
191	M	94.9	Very high	95.5	Very high	9 Å²	9	35.6 Å²	35.6	4%	0.044	18%	0.177	C	C	.	.			trans	-80.1	142.2	-176.2	-66.7	174.7	-151.2	0	0	111.9	I95 C189 L193 Q201	I95-M191 HydrophobicContact CG2-CE 3.48Å; I95-M191 VanDerWaalsContact CG2-CE 3.48Å; I95-M191 HydrophobicContact CG2-SD 4.27Å; C189-M191 HydrophobicContact CB-CE 4.28Å; C189-M191 WeakPolarHBondContact O-CG 3.39Å; C189-M191 PolarHBondContact O-N 3.37Å; M191-L193 HydrophobicContact CB-CD2 4.2Å; M191-L193 HydrophobicContact CB-CG 4.44Å; M191-Q201 HydrophobicContact CB-CG 4.33Å; M191-Q201 VanDerWaalsContact CB-OE1 3.26Å; M191-Q201 HydrophobicContact CG-CB 4.37Å; M191-Q201 HydrophobicContact CG-CG 4.03Å; M191-Q201 HydrophobicContact SD-CG 4.33Å
192	S	94.2	Very high	95.5	Very high	66 Å²	66	39.1 Å²	39.1	46%	0.462	20%	0.199	S	C	.	.			trans	-99.3	105.2	170.8	-174.9	0	0	0	0	109.8	E194 Q201	S192-E194 VanDerWaalsContact C-N 3.34Å; S192-Q201 PolarHBondContact O-NE2 3.22Å
193	L	94.6	Very high	95.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	18%	0.184	C	C	.	.			trans	-94.6	13.9	-173.2	-59.2	175.5	0	0	0	113.1	M191 Y195 Y196 L326 P327 Y331 K333	M191-L193 HydrophobicContact CB-CD2 4.2Å; M191-L193 HydrophobicContact CB-CG 4.44Å; L193-Y195 VanDerWaalsContact C-N 3.26Å; L193-Y195 PolarHBondContact O-N 3.07Å; L193-Y196 HydrophobicContact CD2-CD2 4.21Å; L193-Y196 WeakPolarHBondContact O-CB 3.27Å; L193-Y196 PolarHBondContact O-N 3.35Å; L193-L326 HydrophobicContact CD1-CD2 4.43Å; L193-P327 HydrophobicContact CD1-CG 3.64Å; L193-Y331 HydrophobicContact CB-CE2 4.36Å; L193-Y331 PolarHBondContact N-OH 3.05Å; L193-Y331 VanDerWaalsContact N-OH 3.08Å; L193-K333 HydrophobicContact CB-CD 4.28Å; L193-K333 WeakPolarHBondContact O-CG 3.03Å
194	E	94.1	Very high	95.7	Very high	95 Å²	95	36.5 Å²	36.5	44%	0.444	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-42.8	-178.2	-175.3	178.1	-178.4	0	0	111.9	S192 Y331 K333 A334	S192-E194 VanDerWaalsContact C-N 3.34Å; E194-Y331 HydrophobicContact CB-CE2 4.46Å; E194-K333 CarbonylContact O-C 3.47Å; E194-K333 WeakPolarHBondContact O-CA 3.25Å; E194-A334 PolarHBondContact O-N 2.77Å
195	Y	94.6	Very high	95.7	Very high	97 Å²	97	36.1 Å²	36.1	38%	0.38	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	10.3	-179.2	-67.7	-87.9	0	0	0	113.8	L193 L198 D199 Y523	L193-Y195 VanDerWaalsContact C-N 3.26Å; L193-Y195 PolarHBondContact O-N 3.07Å; Y195-L198 CarbonylContact O-C 3.57Å; Y195-L198 WeakPolarHBondContact O-CA 3.44Å; Y195-L198 WeakPolarHBondContact O-CB 3.26Å; Y195-L198 PolarHBondContact O-N 3.47Å; Y195-D199 PolarHBondContact O-N 3.19Å; Y195-Y523 AromaticContact CD1-CD1 3.76Å; Y195-Y523 HydrophobicContact CD1-CD1 3.76Å; Y195-Y523 HydrophobicContact CD1-CE1 4.35Å; Y195-Y523 AromaticContact CE1-CD1 3.99Å; Y195-Y523 HydrophobicContact CE1-CD1 3.99Å; Y195-Y523 HydrophobicContact CE1-CE1 4.35Å
196	Y	94.1	Very high	95.7	Very high	4 Å²	4	36.4 Å²	36.4	2%	0.016	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.9	133	-175.5	-177.9	-85.9	0	0	0	112.5	L193 R270 Y275 L326 I335	L193-Y196 HydrophobicContact CD2-CD2 4.21Å; L193-Y196 WeakPolarHBondContact O-CB 3.27Å; L193-Y196 PolarHBondContact O-N 3.35Å; Y196-R270 VanDerWaalsContact CE2-CZ 3.46Å; Y196-Y275 HydrophobicContact CE1-CE1 4.09Å; Y196-Y275 AromaticContact CZ-CE1 3.71Å; Y196-Y275 AromaticContact CZ-CZ 3.96Å; Y196-Y275 WeakPolarHBondContact OH-CE1 3.31Å; Y196-Y275 PolarHBondContact OH-OH 2.7Å; Y196-Y275 VanDerWaalsContact OH-OH 3.05Å; Y196-L326 HydrophobicContact CD1-CD1 3.83Å; Y196-L326 HydrophobicContact CD2-CD2 4.02Å; Y196-L326 HydrophobicContact CE1-CD1 3.67Å; Y196-L326 HydrophobicContact CE1-CD2 4.15Å; Y196-L326 HydrophobicContact CE1-CG 4.38Å; Y196-L326 HydrophobicContact CE2-CD2 3.55Å; Y196-L326 HydrophobicContact CG-CD1 4.33Å; Y196-L326 HydrophobicContact CG-CD2 4.46Å; Y196-I335 HydrophobicContact CD1-CB 4.25Å; Y196-I335 HydrophobicContact CD1-CG2 3.87Å; Y196-I335 WeakPolarHBondContact O-CB 3.44Å; Y196-I335 PolarHBondContact O-N 2.6Å
197	P	93.6	Very high	95.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	cis	-96.3	16.5	3.4	38.7	-36.3	0	0	0	114.8	D199 R270 Y275 Y280	P197-D199 WeakPolarHBondContact CA-OD1 3.43Å; P197-R270 WeakPolarHBondContact O-CD 3.4Å; P197-Y275 HydrophobicContact CB-CD1 3.91Å; P197-Y275 HydrophobicContact CB-CD2 3.73Å; P197-Y275 HydrophobicContact CB-CE1 4.15Å; P197-Y275 HydrophobicContact CB-CE2 3.97Å; P197-Y275 HydrophobicContact CB-CG 3.68Å; P197-Y275 HydrophobicContact CG-CD1 4.09Å; P197-Y275 HydrophobicContact CG-CD2 4.18Å; P197-Y275 HydrophobicContact CG-CG 3.74Å; P197-Y280 HydrophobicContact CG-CE2 4.11Å
198	L	92.9	Very high	95.6	Very high	34 Å²	34	35.5 Å²	35.5	18%	0.178	19%	0.185	C	C	.	.	S	Bend	trans	-92.5	21	179.7	-58.3	170.4	0	0	0	112	Y195 Y272 W520 Y523	Y195-L198 CarbonylContact O-C 3.57Å; Y195-L198 WeakPolarHBondContact O-CA 3.44Å; Y195-L198 WeakPolarHBondContact O-CB 3.26Å; Y195-L198 PolarHBondContact O-N 3.47Å; L198-Y272 HydrophobicContact CD2-CD1 4.26Å; L198-Y272 HydrophobicContact CD2-CD2 4.09Å; L198-Y272 HydrophobicContact CD2-CG 3.75Å; L198-W520 HydrophobicContact CD1-CZ3 4.42Å; L198-Y523 WeakPolarHBondContact CD1-O 3.4Å
199	D	94.2	Very high	95.4	Very high	3 Å²	3	33.7 Å²	33.7	2%	0.016	17%	0.172	C	C	.	.			trans	-82.6	154.2	-171.9	54.9	-42.2	0	0	0	113.7	Y195 P197 Q201 R270	Y195-D199 PolarHBondContact O-N 3.19Å; P197-D199 WeakPolarHBondContact CA-OD1 3.43Å; D199-Q201 PolarHBondContact OD2-NE2 3.48Å; D199-R270 PolarHBondContact O-N 3.49Å; D199-R270 WeakPolarHBondContact OD1-CD 3.19Å; D199-R270 IonicContact OD1-CZ 2.79Å; D199-R270 IonicContact OD1-NE 3.55Å; D199-R270 PolarHBondContact OD1-NE 3.03Å; D199-R270 IonicContact OD1-NH2 3.64Å; D199-R270 IonicContact OD2-CZ 3.28Å; D199-R270 IonicContact OD2-NE 3.67Å; D199-R270 PolarHBondContact OD2-NE 2.71Å; D199-R270 IonicContact OD2-NH2 3.7Å; D199-R270 PolarHBondContact OD2-NH2 3.07Å
200	R	95.1	Very high	95.2	Very high	154 Å²	154	41.9 Å²	41.9	58%	0.581	20%	0.204	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-115	133.4	162.9	-62.2	-175.4	-166.9	168.8	7.5	108.5	L268 K269	R200-L268 CarbonylContact C-O 3.44Å; R200-L268 WeakPolarHBondContact CA-O 3.4Å; R200-K269 HydrophobicContact CG-CB 4.33Å; R200-K269 HydrophobicContact CG-CG 4.35Å
201	Q	95.8	Very high	95.1	Very high	4 Å²	4	39.9 Å²	39.9	2%	0.019	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	137.3	-179.7	-58.6	-53.8	-26.8	0	0	110.6	M191 S192 D199 F240 L268	M191-Q201 HydrophobicContact CB-CG 4.33Å; M191-Q201 VanDerWaalsContact CB-OE1 3.26Å; M191-Q201 HydrophobicContact CG-CB 4.37Å; M191-Q201 HydrophobicContact CG-CG 4.03Å; M191-Q201 HydrophobicContact SD-CG 4.33Å; S192-Q201 PolarHBondContact O-NE2 3.22Å; D199-Q201 PolarHBondContact OD2-NE2 3.48Å; Q201-F240 HydrophobicContact CG-CE1 4.21Å; Q201-L268 HydrophobicContact CB-CB 4.47Å; Q201-L268 PolarHBondContact N-O 3.01Å; Q201-L268 PolarHBondContact O-N 3.31Å
202	T	96.6	Very high	95.1	Very high	77 Å²	77	41.9 Å²	41.9	47%	0.472	20%	0.204	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	104.2	176.5	-59.2	0	0	0	0	108.3	L204 I265 L266	T202-L204 HydrophobicContact CG2-CD2 4.27Å; T202-I265 HydrophobicContact CG2-CG2 3.43Å; T202-I265 VanDerWaalsContact CG2-CG2 3.43Å; T202-L266 WeakPolarHBondContact CA-O 3.39Å
203	C	97.1	Very high	95.2	Very high	1 Å²	1	40 Å²	40	1%	0.007	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	140.7	179	-64	0	0	0	0	110.8	Y102 C189 L266 L268	Y102-C203 HydrophobicContact CD1-CB 3.98Å; Y102-C203 HydrophobicContact CE1-CB 3.65Å; C189-C203 HydrophobicContact CB-CB 3.77Å; C189-C203 WeakPolarHBondContact CB-SG 3.21Å; C189-C203 WeakPolarHBondContact SG-CA 3.3Å; C189-C203 WeakPolarHBondContact SG-CB 3.34Å; C189-C203 CovalentContact SG-SG 2.04Å; C189-C203 PolarHBondContact SG-SG 3.2Å; C203-L266 PolarHBondContact N-O 3.43Å; C203-L266 WeakPolarHBondContact O-CB 3.44Å; C203-L266 PolarHBondContact O-N 2.83Å; C203-L268 HydrophobicContact CB-CD1 4.27Å
204	L	97.3	Very high	95.2	Very high	44 Å²	44	41.8 Å²	41.8	23%	0.23	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.5	-172.8	-54.4	179.8	0	0	0	111.4	Y102 N153 T202 R263 T264 I265	Y102-L204 VanDerWaalsContact OH-C 3.28Å; Y102-L204 PolarHBondContact OH-O 2.92Å; N153-L204 PolarHBondContact ND2-O 3.43Å; T202-L204 HydrophobicContact CG2-CD2 4.27Å; L204-R263 HydrophobicContact CD2-CG 4.28Å; L204-T264 CarbonylContact C-O 3.58Å; L204-T264 VanDerWaalsContact CA-O 3.31Å; L204-T264 WeakPolarHBondContact CA-O 2.98Å; L204-I265 HydrophobicContact CD2-CB 4.2Å; L204-I265 HydrophobicContact CD2-CG1 3.87Å; L204-I265 HydrophobicContact CD2-CG2 4.07Å
205	I	97.3	Very high	95.1	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	105.7	161.5	-51.5	174.2	0	0	0	106.1	Y102 F151 L187 R263 T264 L266	Y102-I205 WeakPolarHBondContact OH-CG1 3.46Å; F151-I205 HydrophobicContact CD1-CG2 3.77Å; F151-I205 HydrophobicContact CE1-CG2 3.81Å; L187-I205 HydrophobicContact CD1-CB 4.18Å; L187-I205 HydrophobicContact CD1-CD1 4.45Å; L187-I205 HydrophobicContact CD1-CG1 3.68Å; L187-I205 HydrophobicContact CD1-CG2 4Å; I205-R263 CarbonylContact O-C 3.52Å; I205-R263 WeakPolarHBondContact O-CA 3.42Å; I205-T264 PolarHBondContact N-O 3.22Å; I205-T264 PolarHBondContact O-N 2.8Å; I205-L266 HydrophobicContact CD1-CD1 4.17Å; I205-L266 HydrophobicContact CG1-CD1 4.34Å
206	D	97	Very high	95	Very high	11 Å²	11	42.1 Å²	42.1	6%	0.059	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	128.3	-179.8	-70.3	-16.7	0	0	0	109.3	F151 Q152 N153 L262 R263	F151-D206 CarbonylContact C-O 3.59Å; F151-D206 WeakPolarHBondContact CA-O 3.36Å; Q152-D206 HydrophobicContact CB-CB 4.13Å; Q152-D206 PolarHBondContact N-O 3.26Å; N153-D206 PolarHBondContact OD1-N 3Å; D206-L262 WeakPolarHBondContact CA-O 3.41Å; D206-R263 VanDerWaalsContact OD1-CB 3.31Å; D206-R263 WeakPolarHBondContact OD1-CB 3.39Å; D206-R263 WeakPolarHBondContact OD1-CG 3.5Å; D206-R263 IonicContact OD1-CZ 3.79Å; D206-R263 IonicContact OD1-NE 3.52Å; D206-R263 PolarHBondContact OD1-NE 3.11Å; D206-R263 IonicContact OD1-NH2 3.4Å; D206-R263 IonicContact OD2-CZ 3.57Å; D206-R263 IonicContact OD2-NE 2.82Å; D206-R263 PolarHBondContact OD2-NE 2.98Å; D206-R263 IonicContact OD2-NH2 3.59Å; D206-R263 PolarHBondContact OD2-NH2 3.47Å
207	L	96.7	Very high	95.1	Very high	0 Å²	0	42 Å²	42	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	143.8	175.1	69.7	93.7	0	0	0	110.6	V85 I87 F108 T149 F150 F151 Y219 C261 L262	V85-L207 HydrophobicContact CG1-CD2 4.04Å; V85-L207 HydrophobicContact CG2-CD1 4.41Å; I87-L207 HydrophobicContact CD1-CD2 4.4Å; F108-L207 HydrophobicContact CE2-CD2 3.88Å; F108-L207 HydrophobicContact CZ-CD2 4.39Å; T149-L207 HydrophobicContact CG2-CB 4.03Å; T149-L207 HydrophobicContact CG2-CD1 3.86Å; T149-L207 HydrophobicContact CG2-CG 4.46Å; F150-L207 VanDerWaalsContact O-CA 3.3Å; F150-L207 WeakPolarHBondContact O-CA 3.34Å; F151-L207 HydrophobicContact CD1-CB 3.94Å; F151-L207 HydrophobicContact CE1-CB 3.97Å; F151-L207 HydrophobicContact CE1-CD2 4.26Å; L207-Y219 HydrophobicContact CD1-CD1 4.14Å; L207-Y219 HydrophobicContact CD1-CD2 4.4Å; L207-Y219 HydrophobicContact CD1-CE1 4.43Å; L207-Y219 HydrophobicContact CD1-CG 4.13Å; L207-C261 CarbonylContact O-C 3.17Å; L207-C261 VanDerWaalsContact O-CA 3.22Å; L207-C261 WeakPolarHBondContact O-CA 3.33Å; L207-C261 PolarHBondContact O-SG 3.44Å; L207-L262 HydrophobicContact CD1-CB 4.04Å; L207-L262 HydrophobicContact CD1-CD1 4.28Å; L207-L262 HydrophobicContact CD1-CG 4.23Å; L207-L262 HydrophobicContact CD2-CB 4.29Å; L207-L262 HydrophobicContact CG-CB 3.96Å; L207-L262 PolarHBondContact N-O 3.27Å; L207-L262 PolarHBondContact O-N 2.81Å
208	A	96.7	Very high	95.2	Very high	1 Å²	1	45.1 Å²	45.1	1%	0.008	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	172.3	178.1	0	0	0	0	0	110.4	T149 F150 Q152 S260 C261	T149-A208 WeakPolarHBondContact CA-O 3.26Å; F150-A208 WeakPolarHBondContact CD1-O 3.46Å; F150-A208 HydrophobicContact CE1-CB 3.85Å; F150-A208 HydrophobicContact CZ-CB 4.38Å; F150-A208 PolarHBondContact N-O 2.63Å; F150-A208 PolarHBondContact O-N 3.3Å; Q152-A208 HydrophobicContact CG-CB 4.19Å; A208-S260 WeakPolarHBondContact CA-O 3.39Å; A208-C261 HydrophobicContact CB-CB 4.07Å
209	S	95	Very high	95.4	Very high	2 Å²	2	43.6 Å²	43.6	1%	0.014	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	142	168.2	170	0	0	0	0	109	D148 F150 Y212 Y219 Y259	D148-S209 WeakPolarHBondContact OD1-CB 3.45Å; D148-S209 PolarHBondContact OD1-OG 2.83Å; D148-S209 PolarHBondContact OD2-OG 3.1Å; F150-S209 WeakPolarHBondContact CE1-O 3.48Å; S209-Y212 WeakPolarHBondContact CB-O 3.45Å; S209-Y212 WeakPolarHBondContact OG-CA 3.34Å; S209-Y212 VanDerWaalsContact OG-CB 3.3Å; S209-Y212 WeakPolarHBondContact OG-CB 3.43Å; S209-Y212 PolarHBondContact OG-N 3.21Å; S209-Y212 PolarHBondContact OG-O 3.42Å; S209-Y219 VanDerWaalsContact N-CE2 3.31Å; S209-Y259 VanDerWaalsContact O-CD1 3.32Å; S209-Y259 WeakPolarHBondContact O-CD1 3.15Å
210	Y	92.6	Very high	95.5	Very high	173 Å²	173	47 Å²	47	68%	0.678	23%	0.228	S	C	*	.	S	Bend	trans	-80.4	-46.9	-179.1	-170.5	-96	0	0	0	112.6	D148 F150	D148-Y210 PolarHBondContact O-N 2.98Å; D148-Y210 PolarHBondContact OD2-N 3.01Å; F150-Y210 HydrophobicContact CD1-CD2 4.04Å; F150-Y210 HydrophobicContact CD1-CG 4.43Å; F150-Y210 HydrophobicContact CD2-CD2 4.42Å; F150-Y210 HydrophobicContact CE1-CD2 4.14Å; F150-Y210 HydrophobicContact CE2-CD2 4.49Å; F150-Y210 HydrophobicContact CG-CD2 4.18Å; F150-Y210 HydrophobicContact CZ-CD2 4.35Å
211	A	93.6	Very high	95.7	Very high	62 Å²	62	41.5 Å²	41.5	51%	0.512	21%	0.207	S	C	.	.	S	Bend	trans	-109	-23.8	-173.4	0	0	0	0	0	113.9	D148	D148-A211 VanDerWaalsContact OD2-CB 3.28Å; D148-A211 WeakPolarHBondContact OD2-CB 3.41Å; D148-A211 PolarHBondContact OD2-N 3.03Å
212	Y	94.2	Very high	95.6	Very high	51 Å²	51	44.8 Å²	44.8	20%	0.2	22%	0.221	C	C	.	.			trans	-97.7	128.8	-173.8	-62.1	-75.5	0	0	0	111.9	R66 W145 D148 S209 D216 I217 Y259	R66-Y212 HydrophobicContact CB-CE1 4.13Å; W145-Y212 HydrophobicContact CZ2-CE2 4.19Å; W145-Y212 PolarHBondContact NE1-OH 3.19Å; D148-Y212 WeakPolarHBondContact OD1-CD2 3.33Å; S209-Y212 WeakPolarHBondContact CB-O 3.45Å; S209-Y212 WeakPolarHBondContact OG-CA 3.34Å; S209-Y212 VanDerWaalsContact OG-CB 3.3Å; S209-Y212 WeakPolarHBondContact OG-CB 3.43Å; S209-Y212 PolarHBondContact OG-N 3.21Å; S209-Y212 PolarHBondContact OG-O 3.42Å; Y212-D216 HydrophobicContact CD1-CB 3.76Å; Y212-D216 HydrophobicContact CG-CB 4.16Å; Y212-I217 HydrophobicContact CD2-CD1 3.32Å; Y212-I217 HydrophobicContact CD2-CG1 4.2Å; Y212-I217 HydrophobicContact CE2-CD1 4.03Å; Y212-I217 HydrophobicContact CG-CD1 3.59Å; Y212-I217 HydrophobicContact CG-CG1 3.94Å; Y212-Y259 WeakPolarHBondContact O-CD1 3.39Å; Y212-Y259 WeakPolarHBondContact O-CE1 3.34Å
213	T	95.7	Very high	95.4	Very high	26 Å²	26	46 Å²	46	16%	0.16	24%	0.239	C	C	.	.			trans	-75.1	173.2	176.2	67.1	0	0	0	0	111.5	E215 D216 I217 E258	T213-E215 PolarHBondContact O-N 3.43Å; T213-E215 VanDerWaalsContact O-N 3.13Å; T213-E215 PolarHBondContact OG1-N 3.31Å; T213-D216 WeakPolarHBondContact O-CB 3.31Å; T213-D216 PolarHBondContact O-N 3.33Å; T213-D216 PolarHBondContact OG1-OD2 3.4Å; T213-I217 PolarHBondContact O-N 3.43Å; T213-E258 CarbonylContact C-O 3.59Å; T213-E258 VanDerWaalsContact CA-O 3.23Å; T213-E258 WeakPolarHBondContact CA-O 3.45Å; T213-E258 WeakPolarHBondContact CB-O 3.19Å
214	T	94.4	Very high	95.2	Very high	38 Å²	38	53.7 Å²	53.7	23%	0.233	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-23	173.2	47.1	0	0	0	0	113.7	D216 T251 E258	T214-D216 VanDerWaalsContact C-N 3.3Å; T214-T251 HydrophobicContact CG2-CG2 3.94Å; T214-E258 HydrophobicContact CG2-CB 4.33Å; T214-E258 HydrophobicContact CG2-CG 3.93Å; T214-E258 PolarHBondContact N-O 3Å; T214-E258 PolarHBondContact OG1-O 3.43Å
215	E	92.1	Very high	95	Very high	152 Å²	152	53.4 Å²	53.4	71%	0.71	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.2	-22.5	175.6	-60.3	-176.7	-179.8	0	0	112.2	P80 T213	P80-E215 WeakPolarHBondContact CA-O 3.49Å; T213-E215 PolarHBondContact O-N 3.43Å; T213-E215 VanDerWaalsContact O-N 3.13Å; T213-E215 PolarHBondContact OG1-N 3.31Å
216	D	93.6	Very high	94.9	Very high	48 Å²	48	54.8 Å²	54.8	26%	0.257	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-46.4	-177.9	-73.1	-57	0	0	0	113.1	R66 P80 V81 Y212 T213 T214	R66-D216 WeakPolarHBondContact CD-O 3.34Å; R66-D216 IonicContact CZ-OD1 2.8Å; R66-D216 IonicContact NE-OD1 3.66Å; R66-D216 PolarHBondContact NE-OD1 3.18Å; R66-D216 PolarHBondContact NH1-O 3.18Å; R66-D216 IonicContact NH2-OD1 3.41Å; R66-D216 PolarHBondContact NH2-OD1 2.89Å; P80-D216 CarbonylContact C-O 3.54Å; P80-D216 VanDerWaalsContact CA-O 3.29Å; P80-D216 WeakPolarHBondContact CA-O 3.18Å; V81-D216 PolarHBondContact N-O 3.39Å; Y212-D216 HydrophobicContact CD1-CB 3.76Å; Y212-D216 HydrophobicContact CG-CB 4.16Å; T213-D216 WeakPolarHBondContact O-CB 3.31Å; T213-D216 PolarHBondContact O-N 3.33Å; T213-D216 PolarHBondContact OG1-OD2 3.4Å; T214-D216 VanDerWaalsContact C-N 3.3Å
217	I	95.1	Very high	94.8	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	129.6	-179.5	-62.1	-177.5	0	0	0	109.4	V81 V83 W145 P147 Y212 T213 Y219	V81-I217 WeakPolarHBondContact O-CA 3.27Å; V83-I217 HydrophobicContact CG2-CG2 3.83Å; W145-I217 HydrophobicContact CH2-CD1 3.83Å; W145-I217 HydrophobicContact CZ2-CD1 3.79Å; P147-I217 HydrophobicContact CB-CD1 4.31Å; Y212-I217 HydrophobicContact CD2-CD1 3.32Å; Y212-I217 HydrophobicContact CD2-CG1 4.2Å; Y212-I217 HydrophobicContact CE2-CD1 4.03Å; Y212-I217 HydrophobicContact CG-CD1 3.59Å; Y212-I217 HydrophobicContact CG-CG1 3.94Å; T213-I217 PolarHBondContact O-N 3.43Å; I217-Y219 HydrophobicContact CG2-CD2 4.38Å; I217-Y219 HydrophobicContact CG2-CE1 4.38Å; I217-Y219 HydrophobicContact CG2-CE2 3.98Å
218	E	95.8	Very high	94.7	Very high	66 Å²	66	59 Å²	59	31%	0.308	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	113.8	173.6	-167.6	-171.4	179.6	0	0	109.2	P80 V81 I82 V83 K220	P80-E218 HydrophobicContact CB-CB 4.19Å; P80-E218 HydrophobicContact CG-CB 4.42Å; V81-E218 PolarHBondContact O-N 3.28Å; I82-E218 WeakPolarHBondContact CA-O 3.48Å; V83-E218 PolarHBondContact N-O 2.93Å; E218-K220 WeakPolarHBondContact OE1-CE 3.42Å; E218-K220 IonicContact OE1-NZ 2.86Å; E218-K220 PolarHBondContact OE1-NZ 2.99Å; E218-K220 VanDerWaalsContact OE1-NZ 3.11Å; E218-K220 VanDerWaalsContact OE2-CE 3.22Å; E218-K220 WeakPolarHBondContact OE2-CE 3.42Å; E218-K220 IonicContact OE2-NZ 2.72Å; E218-K220 PolarHBondContact OE2-NZ 3.43Å
219	Y	97.3	Very high	94.6	Very high	3 Å²	3	61.7 Å²	61.7	1%	0.012	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	135.4	173	-68	-74.6	0	0	0	110.6	V83 V85 T149 L207 S209 I217 S260	V83-Y219 HydrophobicContact CB-CD1 3.73Å; V83-Y219 HydrophobicContact CB-CE1 3.89Å; V83-Y219 HydrophobicContact CG1-CD1 3.85Å; V83-Y219 HydrophobicContact CG1-CE1 3.79Å; V83-Y219 HydrophobicContact CG2-CE1 4.36Å; V83-Y219 WeakPolarHBondContact O-CA 3.37Å; V85-Y219 HydrophobicContact CG2-CD1 3.65Å; V85-Y219 HydrophobicContact CG2-CE1 4.4Å; T149-Y219 HydrophobicContact CG2-CE1 4.4Å; T149-Y219 WeakPolarHBondContact OG1-CE1 3.44Å; T149-Y219 PolarHBondContact OG1-OH 3.03Å; L207-Y219 HydrophobicContact CD1-CD1 4.14Å; L207-Y219 HydrophobicContact CD1-CD2 4.4Å; L207-Y219 HydrophobicContact CD1-CE1 4.43Å; L207-Y219 HydrophobicContact CD1-CG 4.13Å; S209-Y219 VanDerWaalsContact N-CE2 3.31Å; I217-Y219 HydrophobicContact CG2-CD2 4.38Å; I217-Y219 HydrophobicContact CG2-CE1 4.38Å; I217-Y219 HydrophobicContact CG2-CE2 3.98Å; Y219-S260 PolarHBondContact N-OG 3.46Å
220	K	97.2	Very high	94.4	Very high	75 Å²	75	67.3 Å²	67.3	33%	0.326	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	144	173.5	-68.9	-174.3	178.1	155.4	0	110.2	I82 V83 N84 V85 E218	I82-K220 HydrophobicContact CG2-CD 3.89Å; I82-K220 HydrophobicContact CG2-CG 4.28Å; V83-K220 PolarHBondContact O-N 3.42Å; N84-K220 CarbonylContact C-O 3.43Å; N84-K220 VanDerWaalsContact CA-O 3.3Å; N84-K220 WeakPolarHBondContact CA-O 3.42Å; V85-K220 PolarHBondContact N-O 3.06Å; E218-K220 WeakPolarHBondContact OE1-CE 3.42Å; E218-K220 IonicContact OE1-NZ 2.86Å; E218-K220 PolarHBondContact OE1-NZ 2.99Å; E218-K220 VanDerWaalsContact OE1-NZ 3.11Å; E218-K220 VanDerWaalsContact OE2-CE 3.22Å; E218-K220 WeakPolarHBondContact OE2-CE 3.42Å; E218-K220 IonicContact OE2-NZ 2.72Å; E218-K220 PolarHBondContact OE2-NZ 3.43Å
221	W	97.6	Very high	94.2	Very high	37 Å²	37	66.5 Å²	66.5	14%	0.14	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	138.7	167.7	-74.4	116.1	0	0	0	109.9	V85 I87 A223 P226 V227 T247 G248 L262 R263 T264	V85-W221 HydrophobicContact CG1-CZ3 4.08Å; I87-W221 HydrophobicContact CD1-CH2 3.84Å; I87-W221 HydrophobicContact CD1-CZ3 4.03Å; I87-W221 HydrophobicContact CG1-CH2 4.47Å; I87-W221 HydrophobicContact CG1-CZ3 4.15Å; W221-A223 PolarHBondContact O-N 2.94Å; W221-P226 HydrophobicContact CB-CB 3.87Å; W221-P226 HydrophobicContact CD2-CB 4.13Å; W221-P226 HydrophobicContact CE3-CB 3.77Å; W221-P226 HydrophobicContact CG-CB 4.22Å; W221-V227 HydrophobicContact CH2-CG2 4.33Å; W221-V227 HydrophobicContact CZ3-CG2 4.14Å; W221-T247 HydrophobicContact CD2-CG2 3.92Å; W221-T247 HydrophobicContact CE3-CG2 4.32Å; W221-T247 HydrophobicContact CG-CG2 4.3Å; W221-T247 HydrophobicContact CZ2-CG2 4.21Å; W221-G248 PolarHBondContact NE1-O 2.96Å; W221-L262 HydrophobicContact CD2-CD1 3.92Å; W221-L262 HydrophobicContact CE3-CD1 4.17Å; W221-L262 HydrophobicContact CG-CD1 4.3Å; W221-L262 HydrophobicContact CG-CD2 4.36Å; W221-L262 HydrophobicContact CH2-CB 4.25Å; W221-L262 HydrophobicContact CZ2-CB 3.6Å; W221-L262 HydrophobicContact CZ2-CD1 4.32Å; W221-L262 HydrophobicContact CZ2-CG 4.49Å; W221-L262 HydrophobicContact CZ3-CD1 4.46Å; W221-R263 WeakPolarHBondContact CZ2-O 3.47Å; W221-T264 WeakPolarHBondContact CH2-OG1 3.44Å
222	K	95.7	Very high	93.8	Very high	73 Å²	73	66.4 Å²	66.4	32%	0.317	36%	0.363	S	S	.	.			trans	-57.4	132	169.9	-173.6	170.7	-176.3	152.2	0	110	V85 N86 E224 P226	V85-K222 PolarHBondContact O-N 2.91Å; N86-K222 HydrophobicContact CB-CB 4.27Å; N86-K222 HydrophobicContact CB-CD 4.15Å; K222-E224 VanDerWaalsContact C-N 3.28Å; K222-E224 PolarHBondContact O-N 3.01Å; K222-P226 WeakPolarHBondContact O-CB 3.15Å
223	A	92.4	Very high	93.4	Very high	103 Å²	103	64.2 Å²	64.2	85%	0.851	36%	0.355	S	S	*	.	S	Bend	trans	-56.5	-40.3	-174.2	0	0	0	0	0	113.3	W221	W221-A223 PolarHBondContact O-N 2.94Å
224	E	92.5	Very high	92.9	Very high	163 Å²	163	68.1 Å²	68.1	76%	0.762	37%	0.37	S	S	*	.	S	Bend	trans	-109.5	124.6	178.1	-65.6	-176.5	177.2	0	0	111.2	K222	K222-E224 VanDerWaalsContact C-N 3.28Å; K222-E224 PolarHBondContact O-N 3.01Å
225	G	91.8	Very high	92.2	Very high	38 Å²	38	72.4 Å²	72.4	39%	0.392	39%	0.391	S	S	.	.			trans	55.8	56.5	177.6	0	0	0	0	0	113.5	N86 V227	N86-G225 PolarHBondContact ND2-O 2.94Å; G225-V227 VanDerWaalsContact C-N 3.27Å; G225-V227 PolarHBondContact O-N 3.09Å
226	P	94.9	Very high	91.7	Very high	29 Å²	29	68.1 Å²	68.1	19%	0.188	38%	0.378	C	S	.	.	S	Bend	trans	-59.1	-39.9	-178.4	24.5	-34.4	0	0	0	112.2	N86 I87 W221 K222 T247	N86-P226 WeakPolarHBondContact CA-O 3.34Å; N86-P226 PolarHBondContact ND2-O 3.28Å; I87-P226 PolarHBondContact N-O 3.46Å; W221-P226 HydrophobicContact CB-CB 3.87Å; W221-P226 HydrophobicContact CD2-CB 4.13Å; W221-P226 HydrophobicContact CE3-CB 3.77Å; W221-P226 HydrophobicContact CG-CB 4.22Å; K222-P226 WeakPolarHBondContact O-CB 3.15Å; P226-T247 HydrophobicContact CB-CG2 4.01Å; P226-T247 HydrophobicContact CG-CG2 3.82Å
227	V	95.4	Very high	91.3	Very high	26 Å²	26	66.6 Å²	66.6	16%	0.158	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	115.1	172.1	-172.8	0	0	0	0	109.4	I87 M89 W221 G225 L229 V245 T247 T264	I87-V227 HydrophobicContact CB-CG2 4.48Å; I87-V227 CarbonylContact O-C 3.43Å; I87-V227 VanDerWaalsContact O-CA 3.28Å; I87-V227 WeakPolarHBondContact O-CA 3.49Å; M89-V227 HydrophobicContact CG-CG1 4.1Å; M89-V227 HydrophobicContact SD-CG1 3.98Å; W221-V227 HydrophobicContact CH2-CG2 4.33Å; W221-V227 HydrophobicContact CZ3-CG2 4.14Å; G225-V227 VanDerWaalsContact C-N 3.27Å; G225-V227 PolarHBondContact O-N 3.09Å; V227-L229 HydrophobicContact CG1-CD2 4.42Å; V227-V245 HydrophobicContact CB-CG1 4.06Å; V227-V245 HydrophobicContact CG1-CG1 3.66Å; V227-T247 HydrophobicContact CG2-CG2 3.62Å; V227-T264 HydrophobicContact CG1-CG2 4.49Å; V227-T264 HydrophobicContact CG2-CG2 4.02Å
228	Q	94.8	Very high	90.7	Very high	73 Å²	73	72.1 Å²	72.1	34%	0.341	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	137.2	178	-65	166	9.5	0	0	109.3	N86 I87 M88 M89	N86-Q228 PolarHBondContact ND2-NE2 3.02Å; I87-Q228 PolarHBondContact O-N 2.67Å; M88-Q228 CarbonylContact C-O 3.53Å; M88-Q228 WeakPolarHBondContact CA-O 3.5Å; M88-Q228 HydrophobicContact CB-CB 4.18Å; M88-Q228 HydrophobicContact CG-CB 4.06Å; M89-Q228 PolarHBondContact N-O 2.96Å
229	L	94.1	Very high	90.3	Very high	58 Å²	58	71.6 Å²	71.6	30%	0.304	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	130.3	176.3	-57.2	-178.3	0	0	0	109.5	M89 V227 M233 L242 V245	M89-L229 HydrophobicContact CB-CD2 3.91Å; M89-L229 HydrophobicContact CG-CD2 4.2Å; M89-L229 HydrophobicContact SD-CD2 3.65Å; V227-L229 HydrophobicContact CG1-CD2 4.42Å; L229-M233 VanDerWaalsContact CA-CE 3.47Å; L229-M233 HydrophobicContact CB-CE 3.73Å; L229-M233 HydrophobicContact CD2-CE 3.83Å; L229-M233 HydrophobicContact CD2-SD 3.99Å; L229-M233 HydrophobicContact CG-CE 4.38Å; L229-L242 HydrophobicContact CD1-CD2 4.33Å; L229-L242 HydrophobicContact CD2-CD2 4.38Å; L229-V245 HydrophobicContact CD1-CG2 4.08Å; L229-V245 HydrophobicContact CD2-CG2 4.11Å
230	K	91.7	Very high	90.1	Very high	120 Å²	120	71.8 Å²	71.8	52%	0.522	41%	0.41	S	S	.	.			trans	-57	138.6	164.5	-172.9	-174.2	176.2	-170	0	110.4	M89 G232 M233	M89-K230 PolarHBondContact O-N 2.93Å; M89-K230 VanDerWaalsContact O-N 3.16Å; K230-G232 PolarHBondContact O-N 3.28Å; K230-M233 HydrophobicContact CB-CE 3.85Å; K230-M233 WeakPolarHBondContact O-CB 3.31Å; K230-M233 PolarHBondContact O-N 3.35Å; K230-M233 VanDerWaalsContact O-N 3.09Å
231	D	87.8	Confident	89.9	Confident	156 Å²	156	71 Å²	71	83%	0.834	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	134.8	174.9	-58.9	-42.5	0	0	0	111.7	M233	D231-M233 VanDerWaalsContact C-N 3.28Å; D231-M233 PolarHBondContact O-N 2.95Å
232	G	85.1	Confident	89.7	Confident	60 Å²	60	69.2 Å²	69.2	62%	0.619	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.2	-0.5	-178.5	0	0	0	0	0	115.5	K230 K234 N235 S236	K230-G232 PolarHBondContact O-N 3.28Å; G232-K234 VanDerWaalsContact C-N 3.27Å; G232-K234 PolarHBondContact O-N 3.23Å; G232-N235 PolarHBondContact O-N 3.1Å; G232-S236 PolarHBondContact O-N 3.5Å
233	M	85.7	Confident	89.5	Confident	5 Å²	5	67.7 Å²	67.7	3%	0.025	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.9	-179.3	-170.7	-171	-32.6	0	0	113.3	M89 L229 K230 D231 N235 S236 L242	M89-M233 HydrophobicContact CB-CE 3.53Å; M89-M233 HydrophobicContact CB-SD 3.68Å; M89-M233 HydrophobicContact CE-SD 4.23Å; M89-M233 WeakPolarHBondContact O-CE 3.47Å; L229-M233 VanDerWaalsContact CA-CE 3.47Å; L229-M233 HydrophobicContact CB-CE 3.73Å; L229-M233 HydrophobicContact CD2-CE 3.83Å; L229-M233 HydrophobicContact CD2-SD 3.99Å; L229-M233 HydrophobicContact CG-CE 4.38Å; K230-M233 HydrophobicContact CB-CE 3.85Å; K230-M233 WeakPolarHBondContact O-CB 3.31Å; K230-M233 PolarHBondContact O-N 3.35Å; K230-M233 VanDerWaalsContact O-N 3.09Å; D231-M233 VanDerWaalsContact C-N 3.28Å; D231-M233 PolarHBondContact O-N 2.95Å; M233-N235 PolarHBondContact O-N 3.41Å; M233-N235 VanDerWaalsContact O-N 3.14Å; M233-S236 WeakPolarHBondContact O-CB 3.4Å; M233-S236 PolarHBondContact O-N 3.45Å; M233-S236 VanDerWaalsContact O-N 3.08Å; M233-S236 PolarHBondContact O-OG 3.48Å; M233-L242 HydrophobicContact SD-CD2 4.14Å
234	K	85	Confident	89.5	Confident	108 Å²	108	67.1 Å²	67.1	47%	0.47	38%	0.378	S	S	.	.	G	3₁₀ helix	trans	-51.8	-38.3	-179.7	-67.5	-164.3	175.2	-158.6	0	113.2	G232 L242	G232-K234 VanDerWaalsContact C-N 3.27Å; G232-K234 PolarHBondContact O-N 3.23Å; K234-L242 PolarHBondContact O-N 2.8Å; K234-L242 VanDerWaalsContact O-N 3.12Å
235	N	81.7	Confident	89.6	Confident	127 Å²	127	61.2 Å²	61.2	68%	0.679	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-110.2	11.5	-176.2	-57.2	-14.4	0	0	0	112.9	G232 M233 L237	G232-N235 PolarHBondContact O-N 3.1Å; M233-N235 PolarHBondContact O-N 3.41Å; M233-N235 VanDerWaalsContact O-N 3.14Å; N235-L237 VanDerWaalsContact C-N 3.29Å
236	S	79.8	Confident	89.9	Confident	63 Å²	63	63.9 Å²	63.9	44%	0.441	36%	0.357	S	S	.	.			trans	-79.3	-15.3	-175.9	66	0	0	0	0	113.6	G232 M233	G232-S236 PolarHBondContact O-N 3.5Å; M233-S236 WeakPolarHBondContact O-CB 3.4Å; M233-S236 PolarHBondContact O-N 3.45Å; M233-S236 VanDerWaalsContact O-N 3.08Å; M233-S236 PolarHBondContact O-OG 3.48Å
237	L	85.5	Confident	89.9	Confident	15 Å²	15	65.1 Å²	65.1	8%	0.079	36%	0.364	C	S	.	.			trans	-86.8	132.2	-178	-79.3	166.1	0	0	0	109.9	I92 I95 N235 F240 L268	I92-L237 HydrophobicContact CB-CD1 4.15Å; I92-L237 HydrophobicContact CB-CD2 3.88Å; I92-L237 HydrophobicContact CB-CG 4.26Å; I92-L237 HydrophobicContact CD1-CD1 4.22Å; I92-L237 HydrophobicContact CG2-CD1 4.35Å; I92-L237 HydrophobicContact CG2-CD2 3.82Å; I92-L237 WeakPolarHBondContact O-CD2 3.37Å; I95-L237 HydrophobicContact CD1-CD1 4.23Å; I95-L237 HydrophobicContact CD1-CD2 4.07Å; N235-L237 VanDerWaalsContact C-N 3.29Å; L237-F240 HydrophobicContact CB-CB 4.34Å; L237-F240 WeakPolarHBondContact CB-O 3.34Å; L237-F240 HydrophobicContact CD1-CB 4.18Å; L237-L268 HydrophobicContact CD1-CD2 3.86Å
238	P	83.2	Confident	89.9	Confident	116 Å²	116	65 Å²	65	75%	0.753	37%	0.368	S	S	*	.	S	Bend	trans	-75.1	-29	-176.2	27.5	-34.5	0	0	0	114.1
239	S	86.9	Confident	90	Very high	56 Å²	56	67.2 Å²	67.2	39%	0.392	38%	0.381	S	S	.	.	S	Bend	trans	-115.5	-6.1	-173.9	-50.9	0	0	0	0	113.7	R270 E271	S239-R270 WeakPolarHBondContact O-CG 3.45Å; S239-E271 PolarHBondContact O-N 3.45Å
240	F	92.8	Very high	90.1	Very high	6 Å²	6	65.3 Å²	65.3	3%	0.026	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	154.5	-175.4	-71.4	-94.2	0	0	0	110.1	I95 Q201 L237 L268 K269 R270	I95-F240 HydrophobicContact CB-CD2 4.2Å; I95-F240 HydrophobicContact CB-CE2 3.86Å; I95-F240 HydrophobicContact CD1-CB 3.96Å; I95-F240 HydrophobicContact CD1-CD1 4.38Å; I95-F240 HydrophobicContact CD1-CD2 3.36Å; I95-F240 HydrophobicContact CD1-CE2 3.81Å; I95-F240 HydrophobicContact CD1-CG 3.67Å; I95-F240 HydrophobicContact CD1-CZ 4.46Å; I95-F240 HydrophobicContact CG1-CD2 4.35Å; I95-F240 HydrophobicContact CG1-CE2 4.45Å; I95-F240 HydrophobicContact CG2-CD2 4.34Å; I95-F240 HydrophobicContact CG2-CE2 3.63Å; I95-F240 HydrophobicContact CG2-CZ 3.87Å; Q201-F240 HydrophobicContact CG-CE1 4.21Å; L237-F240 HydrophobicContact CB-CB 4.34Å; L237-F240 WeakPolarHBondContact CB-O 3.34Å; L237-F240 HydrophobicContact CD1-CB 4.18Å; F240-L268 HydrophobicContact CD1-CB 4Å; F240-K269 CarbonylContact C-O 3.48Å; F240-K269 WeakPolarHBondContact CA-O 3.25Å; F240-R270 HydrophobicContact CD1-CB 4.09Å; F240-R270 HydrophobicContact CE1-CB 3.96Å; F240-R270 HydrophobicContact CE1-CG 4.27Å; F240-R270 HydrophobicContact CZ-CG 4.5Å; F240-R270 VanDerWaalsContact CZ-NH1 3.26Å; F240-R270 VanDerWaalsContact CZ-NH2 3.35Å
241	E	92.7	Very high	90.2	Very high	58 Å²	58	62.2 Å²	62.2	27%	0.271	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132	167.8	-174.4	-171.5	-176.4	0	0	108.1	Q243 L268 K269	E241-Q243 PolarHBondContact O-N 2.92Å; E241-L268 WeakPolarHBondContact O-CA 3.49Å; E241-K269 PolarHBondContact N-O 3.29Å; E241-K269 PolarHBondContact O-N 2.94Å
242	L	94	Very high	90.4	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.1	106.3	170.6	177.1	69.4	0	0	0	108.8	I92 L229 M233 K234 V245 L266 L268	I92-L242 HydrophobicContact CD1-CD1 4.45Å; I92-L242 HydrophobicContact CD1-CD2 4.49Å; L229-L242 HydrophobicContact CD1-CD2 4.33Å; L229-L242 HydrophobicContact CD2-CD2 4.38Å; M233-L242 HydrophobicContact SD-CD2 4.14Å; K234-L242 PolarHBondContact O-N 2.8Å; K234-L242 VanDerWaalsContact O-N 3.12Å; L242-V245 HydrophobicContact CD1-CG2 3.95Å; L242-V245 HydrophobicContact CD2-CG2 3.88Å; L242-V245 HydrophobicContact CG-CG2 4.1Å; L242-L266 HydrophobicContact CD1-CB 4.26Å; L242-L266 HydrophobicContact CD1-CD2 4.43Å; L242-L268 HydrophobicContact CB-CD2 4.2Å; L242-L268 HydrophobicContact CD1-CD2 3.76Å
243	Q	91.8	Very high	90.8	Very high	40 Å²	40	62.3 Å²	62.3	19%	0.187	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	-66.1	-177.3	-58	-160.7	-61.1	0	0	110.8	E241 T267 K269	E241-Q243 PolarHBondContact O-N 2.92Å; Q243-T267 HydrophobicContact CB-CG2 4.45Å; Q243-T267 PolarHBondContact N-O 2.93Å; Q243-K269 VanDerWaalsContact CD-CB 3.48Å; Q243-K269 HydrophobicContact CG-CB 3.71Å
244	D	92.5	Very high	91.1	Very high	91 Å²	91	64.9 Å²	64.9	49%	0.487	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	148.7	-170.5	-64.4	-46.5	0	0	0	111.8	T267	D244-T267 PolarHBondContact O-N 3.19Å
245	V	95.3	Very high	91.4	Very high	40 Å²	40	67.4 Å²	67.4	24%	0.242	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	110.6	175.1	179.1	0	0	0	0	107.9	V227 L229 L242 T264 I265 L266	V227-V245 HydrophobicContact CB-CG1 4.06Å; V227-V245 HydrophobicContact CG1-CG1 3.66Å; L229-V245 HydrophobicContact CD1-CG2 4.08Å; L229-V245 HydrophobicContact CD2-CG2 4.11Å; L242-V245 HydrophobicContact CD1-CG2 3.95Å; L242-V245 HydrophobicContact CD2-CG2 3.88Å; L242-V245 HydrophobicContact CG-CG2 4.1Å; V245-T264 HydrophobicContact CG1-CG2 3.83Å; V245-I265 WeakPolarHBondContact CA-O 3.39Å; V245-L266 HydrophobicContact CB-CD2 4.32Å; V245-L266 HydrophobicContact CG1-CD2 3.87Å; V245-L266 HydrophobicContact CG2-CD2 3.73Å
246	I	96.3	Very high	92	Very high	93 Å²	93	65.9 Å²	65.9	48%	0.477	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	139	-174.2	-56.8	172.6	0	0	0	108.9	I265	I246-I265 HydrophobicContact CB-CB 4.34Å; I246-I265 PolarHBondContact N-O 3.35Å; I246-I265 PolarHBondContact O-N 2.92Å
247	T	96.8	Very high	92.6	Very high	56 Å²	56	63.8 Å²	63.8	34%	0.344	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	137.5	172.9	51.7	0	0	0	0	110.7	W221 P226 V227	W221-T247 HydrophobicContact CD2-CG2 3.92Å; W221-T247 HydrophobicContact CE3-CG2 4.32Å; W221-T247 HydrophobicContact CG-CG2 4.3Å; W221-T247 HydrophobicContact CZ2-CG2 4.21Å; P226-T247 HydrophobicContact CB-CG2 4.01Å; P226-T247 HydrophobicContact CG-CG2 3.82Å; V227-T247 HydrophobicContact CG2-CG2 3.62Å
248	G	95.5	Very high	93.1	Very high	22 Å²	22	67.7 Å²	67.7	23%	0.227	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	-179.1	175	0	0	0	0	0	112	W221 R263	W221-G248 PolarHBondContact NE1-O 2.96Å; G248-R263 PolarHBondContact N-O 3.05Å; G248-R263 PolarHBondContact O-N 3.4Å
249	L	95.9	Very high	93.7	Very high	120 Å²	120	63.3 Å²	63.3	63%	0.628	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	149.4	174	-60.1	175.9	0	0	0	109.1	L262	L249-L262 HydrophobicContact CD2-CD2 3.35Å
250	C	95.6	Very high	94.2	Very high	18 Å²	18	60.9 Å²	60.9	12%	0.122	33%	0.334	C	S	.	.			trans	-137.5	21.4	-178.2	44.1	0	0	0	0	112.7	S252 C261 L262 R263	C250-S252 PolarHBondContact O-N 3.07Å; C250-C261 VanDerWaalsContact C-CB 3.45Å; C250-C261 HydrophobicContact CB-CB 3.94Å; C250-C261 WeakPolarHBondContact CB-SG 3.5Å; C250-C261 PolarHBondContact N-O 3.01Å; C250-C261 WeakPolarHBondContact O-CB 3.48Å; C250-C261 WeakPolarHBondContact SG-CB 3.38Å; C250-C261 PolarHBondContact SG-O 3.32Å; C250-C261 CovalentContact SG-SG 2.03Å; C250-C261 PolarHBondContact SG-SG 3.28Å; C250-L262 PolarHBondContact SG-N 3.48Å; C250-L262 PolarHBondContact SG-O 3.32Å; C250-R263 HydrophobicContact CB-CB 4.12Å
251	T	94.2	Very high	94.3	Very high	56 Å²	56	60.6 Å²	60.6	34%	0.344	33%	0.332	S	S	.	.			trans	-46.4	124.4	-178.7	-58.3	0	0	0	0	110.3	T214 E258 Y259	T214-T251 HydrophobicContact CG2-CG2 3.94Å; T251-E258 HydrophobicContact CG2-CG 3.7Å; T251-E258 VanDerWaalsContact CG2-OE1 3.29Å; T251-E258 WeakPolarHBondContact CG2-OE1 3.48Å; T251-Y259 WeakPolarHBondContact CA-O 3.36Å; T251-Y259 WeakPolarHBondContact CG2-O 3.45Å
252	S	91.2	Very high	94.6	Very high	41 Å²	41	57.9 Å²	57.9	29%	0.287	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	138	-171.8	65.9	0	0	0	0	110.7	C250 Y259	C250-S252 PolarHBondContact O-N 3.07Å; S252-Y259 PolarHBondContact N-O 3.16Å; S252-Y259 PolarHBondContact O-N 3.14Å
253	K	94.1	Very high	94.8	Very high	177 Å²	177	61.5 Å²	61.5	77%	0.77	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.9	174	-172.2	172.1	-177	170.3	0	110.2
254	T	91.3	Very high	95	Very high	59 Å²	59	59.6 Å²	59.6	36%	0.362	32%	0.324	S	S	.	.			trans	-108.2	-176.9	175.1	71.7	0	0	0	0	110.2	T256 G257 Y259	T254-T256 PolarHBondContact O-N 3.48Å; T254-T256 PolarHBondContact OG1-N 3.16Å; T254-T256 PolarHBondContact OG1-OG1 2.83Å; T254-T256 VanDerWaalsContact OG1-OG1 3.12Å; T254-G257 PolarHBondContact N-O 2.94Å; T254-G257 PolarHBondContact OG1-O 3.35Å; T254-Y259 HydrophobicContact CG2-CD2 4.14Å; T254-Y259 HydrophobicContact CG2-CE2 4.46Å; T254-Y259 VanDerWaalsContact OG1-CE2 3.25Å; T254-Y259 WeakPolarHBondContact OG1-CE2 3.39Å
255	N	93.2	Very high	95.3	Very high	161 Å²	161	57.4 Å²	57.4	86%	0.861	31%	0.312	S	S	*	.	S	Bend	trans	-66	-24.5	173.7	61	-28.9	0	0	0	113.4
256	T	92.7	Very high	95.3	Very high	94 Å²	94	55.5 Å²	55.5	58%	0.577	30%	0.3	S	S	*	.	S	Bend	trans	-96.5	-14.5	-177.4	53.7	0	0	0	0	113.7	T254 Y259	T254-T256 PolarHBondContact O-N 3.48Å; T254-T256 PolarHBondContact OG1-N 3.16Å; T254-T256 PolarHBondContact OG1-OG1 2.83Å; T254-T256 VanDerWaalsContact OG1-OG1 3.12Å; T256-Y259 WeakPolarHBondContact OG1-CE2 3.22Å; T256-Y259 PolarHBondContact OG1-OH 3.01Å
257	G	93.5	Very high	95.3	Very high	20 Å²	20	52.2 Å²	52.2	21%	0.206	29%	0.285	C	S	.	.			trans	157.5	-175.3	179.8	0	0	0	0	0	112.8	T254 Y259	T254-G257 PolarHBondContact N-O 2.94Å; T254-G257 PolarHBondContact OG1-O 3.35Å; G257-Y259 WeakPolarHBondContact O-CD2 3.41Å
258	E	96.1	Very high	95.2	Very high	97 Å²	97	49.6 Å²	49.6	45%	0.453	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	132.2	169.5	-170.6	172.2	173.2	0	0	109.3	T213 T214 T251	T213-E258 CarbonylContact C-O 3.59Å; T213-E258 VanDerWaalsContact CA-O 3.23Å; T213-E258 WeakPolarHBondContact CA-O 3.45Å; T213-E258 WeakPolarHBondContact CB-O 3.19Å; T214-E258 HydrophobicContact CG2-CB 4.33Å; T214-E258 HydrophobicContact CG2-CG 3.93Å; T214-E258 PolarHBondContact N-O 3Å; T214-E258 PolarHBondContact OG1-O 3.43Å; T251-E258 HydrophobicContact CG2-CG 3.7Å; T251-E258 VanDerWaalsContact CG2-OE1 3.29Å; T251-E258 WeakPolarHBondContact CG2-OE1 3.48Å
259	Y	95.9	Very high	95.1	Very high	24 Å²	24	51.9 Å²	51.9	9%	0.094	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	125.8	-175.4	-69.2	-96.2	0	0	0	110.6	S209 Y212 T251 S252 T254 T256 G257 C261	S209-Y259 VanDerWaalsContact O-CD1 3.32Å; S209-Y259 WeakPolarHBondContact O-CD1 3.15Å; Y212-Y259 WeakPolarHBondContact O-CD1 3.39Å; Y212-Y259 WeakPolarHBondContact O-CE1 3.34Å; T251-Y259 WeakPolarHBondContact CA-O 3.36Å; T251-Y259 WeakPolarHBondContact CG2-O 3.45Å; S252-Y259 PolarHBondContact N-O 3.16Å; S252-Y259 PolarHBondContact O-N 3.14Å; T254-Y259 HydrophobicContact CG2-CD2 4.14Å; T254-Y259 HydrophobicContact CG2-CE2 4.46Å; T254-Y259 VanDerWaalsContact OG1-CE2 3.25Å; T254-Y259 WeakPolarHBondContact OG1-CE2 3.39Å; T256-Y259 WeakPolarHBondContact OG1-CE2 3.22Å; T256-Y259 PolarHBondContact OG1-OH 3.01Å; G257-Y259 WeakPolarHBondContact O-CD2 3.41Å; Y259-C261 PolarHBondContact O-N 3.49Å
260	S	96.1	Very high	95	Very high	5 Å²	5	46.4 Å²	46.4	4%	0.035	24%	0.243	C	C	.	.			trans	-65.4	129.9	176.7	-173.3	0	0	0	0	109.9	A208 Y219	A208-S260 WeakPolarHBondContact CA-O 3.39Å; Y219-S260 PolarHBondContact N-OG 3.46Å
261	C	96.5	Very high	94.9	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.4	133.8	-176.1	175.7	0	0	0	0	111	Q152 L207 A208 C250 Y259	Q152-C261 PolarHBondContact OE1-SG 3.36Å; Q152-C261 VanDerWaalsContact OE1-SG 3.41Å; L207-C261 CarbonylContact O-C 3.17Å; L207-C261 VanDerWaalsContact O-CA 3.22Å; L207-C261 WeakPolarHBondContact O-CA 3.33Å; L207-C261 PolarHBondContact O-SG 3.44Å; A208-C261 HydrophobicContact CB-CB 4.07Å; C250-C261 VanDerWaalsContact C-CB 3.45Å; C250-C261 HydrophobicContact CB-CB 3.94Å; C250-C261 WeakPolarHBondContact CB-SG 3.5Å; C250-C261 PolarHBondContact N-O 3.01Å; C250-C261 WeakPolarHBondContact O-CB 3.48Å; C250-C261 WeakPolarHBondContact SG-CB 3.38Å; C250-C261 PolarHBondContact SG-O 3.32Å; C250-C261 CovalentContact SG-SG 2.03Å; C250-C261 PolarHBondContact SG-SG 3.28Å; Y259-C261 PolarHBondContact O-N 3.49Å
262	L	97.6	Very high	94.7	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.4	173.7	-59.4	-175.9	0	0	0	110.2	V85 D206 L207 W221 L249 C250	V85-L262 HydrophobicContact CB-CD1 3.62Å; V85-L262 HydrophobicContact CG1-CD1 4.28Å; V85-L262 HydrophobicContact CG2-CD1 3.68Å; D206-L262 WeakPolarHBondContact CA-O 3.41Å; L207-L262 HydrophobicContact CD1-CB 4.04Å; L207-L262 HydrophobicContact CD1-CD1 4.28Å; L207-L262 HydrophobicContact CD1-CG 4.23Å; L207-L262 HydrophobicContact CD2-CB 4.29Å; L207-L262 HydrophobicContact CG-CB 3.96Å; L207-L262 PolarHBondContact N-O 3.27Å; L207-L262 PolarHBondContact O-N 2.81Å; W221-L262 HydrophobicContact CD2-CD1 3.92Å; W221-L262 HydrophobicContact CE3-CD1 4.17Å; W221-L262 HydrophobicContact CG-CD1 4.3Å; W221-L262 HydrophobicContact CG-CD2 4.36Å; W221-L262 HydrophobicContact CH2-CB 4.25Å; W221-L262 HydrophobicContact CZ2-CB 3.6Å; W221-L262 HydrophobicContact CZ2-CD1 4.32Å; W221-L262 HydrophobicContact CZ2-CG 4.49Å; W221-L262 HydrophobicContact CZ3-CD1 4.46Å; L249-L262 HydrophobicContact CD2-CD2 3.35Å; C250-L262 PolarHBondContact SG-N 3.48Å; C250-L262 PolarHBondContact SG-O 3.32Å
263	R	97.8	Very high	94.7	Very high	78 Å²	78	52 Å²	52	29%	0.294	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	129.1	-178.8	173.1	164.1	-70.5	169.9	0.1	110.6	L204 I205 D206 W221 G248 C250 I265	L204-R263 HydrophobicContact CD2-CG 4.28Å; I205-R263 CarbonylContact O-C 3.52Å; I205-R263 WeakPolarHBondContact O-CA 3.42Å; D206-R263 VanDerWaalsContact OD1-CB 3.31Å; D206-R263 WeakPolarHBondContact OD1-CB 3.39Å; D206-R263 WeakPolarHBondContact OD1-CG 3.5Å; D206-R263 IonicContact OD1-CZ 3.79Å; D206-R263 IonicContact OD1-NE 3.52Å; D206-R263 PolarHBondContact OD1-NE 3.11Å; D206-R263 IonicContact OD1-NH2 3.4Å; D206-R263 IonicContact OD2-CZ 3.57Å; D206-R263 IonicContact OD2-NE 2.82Å; D206-R263 PolarHBondContact OD2-NE 2.98Å; D206-R263 IonicContact OD2-NH2 3.59Å; D206-R263 PolarHBondContact OD2-NH2 3.47Å; W221-R263 WeakPolarHBondContact CZ2-O 3.47Å; G248-R263 PolarHBondContact N-O 3.05Å; G248-R263 PolarHBondContact O-N 3.4Å; C250-R263 HydrophobicContact CB-CB 4.12Å; R263-I265 HydrophobicContact CG-CD1 4.5Å; R263-I265 HydrophobicContact CG-CG1 3.8Å
264	T	97.5	Very high	94.5	Very high	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.1	163.3	-50.3	0	0	0	0	108.7	L204 I205 W221 V227 V245 L266	L204-T264 CarbonylContact C-O 3.58Å; L204-T264 VanDerWaalsContact CA-O 3.31Å; L204-T264 WeakPolarHBondContact CA-O 2.98Å; I205-T264 PolarHBondContact N-O 3.22Å; I205-T264 PolarHBondContact O-N 2.8Å; W221-T264 WeakPolarHBondContact CH2-OG1 3.44Å; V227-T264 HydrophobicContact CG1-CG2 4.49Å; V227-T264 HydrophobicContact CG2-CG2 4.02Å; V245-T264 HydrophobicContact CG1-CG2 3.83Å; T264-L266 HydrophobicContact CG2-CD2 3.94Å
265	I	97.4	Very high	94.6	Very high	45 Å²	45	48.1 Å²	48.1	23%	0.231	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	117	179.1	-51.8	179.8	0	0	0	107.9	T202 L204 V245 I246 R263	T202-I265 HydrophobicContact CG2-CG2 3.43Å; T202-I265 VanDerWaalsContact CG2-CG2 3.43Å; L204-I265 HydrophobicContact CD2-CB 4.2Å; L204-I265 HydrophobicContact CD2-CG1 3.87Å; L204-I265 HydrophobicContact CD2-CG2 4.07Å; V245-I265 WeakPolarHBondContact CA-O 3.39Å; I246-I265 HydrophobicContact CB-CB 4.34Å; I246-I265 PolarHBondContact N-O 3.35Å; I246-I265 PolarHBondContact O-N 2.92Å; R263-I265 HydrophobicContact CG-CD1 4.5Å; R263-I265 HydrophobicContact CG-CG1 3.8Å
266	L	95.9	Very high	94.6	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	119.2	177.4	-53.9	177.6	0	0	0	109.1	M89 I92 Y102 T202 C203 I205 L242 V245 T264	M89-L266 HydrophobicContact CE-CD1 3.79Å; M89-L266 HydrophobicContact CE-CD2 3.74Å; M89-L266 HydrophobicContact CE-CG 4.45Å; M89-L266 HydrophobicContact SD-CD2 3.73Å; I92-L266 HydrophobicContact CD1-CD1 4.36Å; Y102-L266 HydrophobicContact CE2-CD1 3.89Å; T202-L266 WeakPolarHBondContact CA-O 3.39Å; C203-L266 PolarHBondContact N-O 3.43Å; C203-L266 WeakPolarHBondContact O-CB 3.44Å; C203-L266 PolarHBondContact O-N 2.83Å; I205-L266 HydrophobicContact CD1-CD1 4.17Å; I205-L266 HydrophobicContact CG1-CD1 4.34Å; L242-L266 HydrophobicContact CD1-CB 4.26Å; L242-L266 HydrophobicContact CD1-CD2 4.43Å; V245-L266 HydrophobicContact CB-CD2 4.32Å; V245-L266 HydrophobicContact CG1-CD2 3.87Å; V245-L266 HydrophobicContact CG2-CD2 3.73Å; T264-L266 HydrophobicContact CG2-CD2 3.94Å
267	T	96.1	Very high	94.7	Very high	24 Å²	24	44.2 Å²	44.2	15%	0.147	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	111.3	173.9	-57	0	0	0	0	109.7	Q243 D244	Q243-T267 HydrophobicContact CB-CG2 4.45Å; Q243-T267 PolarHBondContact N-O 2.93Å; D244-T267 PolarHBondContact O-N 3.19Å
268	L	94.7	Very high	94.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.4	-177.9	-62.8	164.9	0	0	0	109	I92 I95 R200 Q201 C203 L237 F240 E241 L242	I92-L268 HydrophobicContact CD1-CD2 4.15Å; I95-L268 HydrophobicContact CD1-CD1 3.88Å; I95-L268 HydrophobicContact CD1-CD2 4.45Å; R200-L268 CarbonylContact C-O 3.44Å; R200-L268 WeakPolarHBondContact CA-O 3.4Å; Q201-L268 HydrophobicContact CB-CB 4.47Å; Q201-L268 PolarHBondContact N-O 3.01Å; Q201-L268 PolarHBondContact O-N 3.31Å; C203-L268 HydrophobicContact CB-CD1 4.27Å; L237-L268 HydrophobicContact CD1-CD2 3.86Å; F240-L268 HydrophobicContact CD1-CB 4Å; E241-L268 WeakPolarHBondContact O-CA 3.49Å; L242-L268 HydrophobicContact CB-CD2 4.2Å; L242-L268 HydrophobicContact CD1-CD2 3.76Å
269	K	94.2	Very high	94.5	Very high	70 Å²	70	41.8 Å²	41.8	30%	0.304	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132.5	174.6	176.1	179.2	171.2	-164.8	0	109.7	R200 F240 E241 Q243	R200-K269 HydrophobicContact CG-CB 4.33Å; R200-K269 HydrophobicContact CG-CG 4.35Å; F240-K269 CarbonylContact C-O 3.48Å; F240-K269 WeakPolarHBondContact CA-O 3.25Å; E241-K269 PolarHBondContact N-O 3.29Å; E241-K269 PolarHBondContact O-N 2.94Å; Q243-K269 VanDerWaalsContact CD-CB 3.48Å; Q243-K269 HydrophobicContact CG-CB 3.71Å
270	R	94	Very high	94.5	Very high	5 Å²	5	41 Å²	41	2%	0.019	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	139.4	178.3	-166.1	178	-58	-90.7	-0.2	111.6	D97 Y196 P197 D199 S239 F240 Y272 Y275	D97-R270 IonicContact OD1-CZ 2.87Å; D97-R270 IonicContact OD1-NH1 3.93Å; D97-R270 PolarHBondContact OD1-NH1 2.9Å; D97-R270 IonicContact OD1-NH2 2.68Å; D97-R270 PolarHBondContact OD1-NH2 3.1Å; D97-R270 IonicContact OD2-CZ 2.97Å; D97-R270 IonicContact OD2-NH1 2.98Å; D97-R270 PolarHBondContact OD2-NH1 3.38Å; D97-R270 IonicContact OD2-NH2 2.76Å; Y196-R270 VanDerWaalsContact CE2-CZ 3.46Å; P197-R270 WeakPolarHBondContact O-CD 3.4Å; D199-R270 PolarHBondContact O-N 3.49Å; D199-R270 WeakPolarHBondContact OD1-CD 3.19Å; D199-R270 IonicContact OD1-CZ 2.79Å; D199-R270 IonicContact OD1-NE 3.55Å; D199-R270 PolarHBondContact OD1-NE 3.03Å; D199-R270 IonicContact OD1-NH2 3.64Å; D199-R270 IonicContact OD2-CZ 3.28Å; D199-R270 IonicContact OD2-NE 3.67Å; D199-R270 PolarHBondContact OD2-NE 2.71Å; D199-R270 IonicContact OD2-NH2 3.7Å; D199-R270 PolarHBondContact OD2-NH2 3.07Å; S239-R270 WeakPolarHBondContact O-CG 3.45Å; F240-R270 HydrophobicContact CD1-CB 4.09Å; F240-R270 HydrophobicContact CE1-CB 3.96Å; F240-R270 HydrophobicContact CE1-CG 4.27Å; F240-R270 HydrophobicContact CZ-CG 4.5Å; F240-R270 VanDerWaalsContact CZ-NH1 3.26Å; F240-R270 VanDerWaalsContact CZ-NH2 3.35Å; R270-Y272 PolarHBondContact O-N 3.41Å; R270-Y275 HydrophobicContact CG-CE2 4.24Å
271	E	92.2	Very high	94.5	Very high	78 Å²	78	44.3 Å²	44.3	36%	0.364	21%	0.214	S	C	.	.			trans	-79.7	103.6	172.3	-76.3	-67.7	172.4	0	0	110.3	S239	S239-E271 PolarHBondContact O-N 3.45Å
272	Y	90.6	Very high	94.4	Very high	90 Å²	90	46.5 Å²	46.5	35%	0.353	23%	0.227	S	C	.	.			trans	-83.1	-12.2	-172.7	71.1	-89.4	0	0	0	114.2	L198 R270 Y274 Y275 L276	L198-Y272 HydrophobicContact CD2-CD1 4.26Å; L198-Y272 HydrophobicContact CD2-CD2 4.09Å; L198-Y272 HydrophobicContact CD2-CG 3.75Å; R270-Y272 PolarHBondContact O-N 3.41Å; Y272-Y274 VanDerWaalsContact C-N 3.34Å; Y272-Y274 PolarHBondContact O-N 3.07Å; Y272-Y275 WeakPolarHBondContact O-CB 3.18Å; Y272-Y275 PolarHBondContact O-N 2.96Å; Y272-L276 HydrophobicContact CE2-CD1 4.24Å; Y272-L276 PolarHBondContact O-N 3.29Å
273	S	90.7	Very high	94.4	Very high	66 Å²	66	46.5 Å²	46.5	46%	0.462	23%	0.227	S	C	.	.	H	α-helix	trans	-57.9	-41.6	-174.7	58.3	0	0	0	0	113.3	Y275 L276 I277	S273-Y275 VanDerWaalsContact C-N 3.33Å; S273-Y275 PolarHBondContact O-N 3.12Å; S273-L276 WeakPolarHBondContact O-CB 3.45Å; S273-L276 PolarHBondContact O-N 3.5Å; S273-I277 PolarHBondContact O-N 3.03Å
274	Y	91.6	Very high	94.3	Very high	124 Å²	124	46.9 Å²	46.9	49%	0.486	23%	0.232	S	C	.	.	H	α-helix	trans	-59.2	-43.5	174.3	168.4	-93.4	0	0	0	111.9	Y272 L276 I277 T278	Y272-Y274 VanDerWaalsContact C-N 3.34Å; Y272-Y274 PolarHBondContact O-N 3.07Å; Y274-L276 VanDerWaalsContact C-N 3.34Å; Y274-I277 PolarHBondContact O-N 3.4Å; Y274-T278 HydrophobicContact CD2-CG2 4.03Å; Y274-T278 HydrophobicContact CE1-CG2 4.44Å; Y274-T278 WeakPolarHBondContact CE1-OG1 3.49Å; Y274-T278 HydrophobicContact CE2-CG2 3.64Å; Y274-T278 WeakPolarHBondContact O-CB 3.08Å; Y274-T278 WeakPolarHBondContact O-CG2 3.07Å; Y274-T278 PolarHBondContact O-N 3.44Å; Y274-T278 PolarHBondContact O-OG1 2.93Å
275	Y	93.1	Very high	94.2	Very high	29 Å²	29	52.5 Å²	52.5	11%	0.114	26%	0.259	C	S	.	.	H	α-helix	trans	-69.7	-33.8	179.9	-61.7	-88.1	0	0	0	111.5	Y196 P197 R270 Y272 S273 I277 L279 Y280	Y196-Y275 HydrophobicContact CE1-CE1 4.09Å; Y196-Y275 AromaticContact CZ-CE1 3.71Å; Y196-Y275 AromaticContact CZ-CZ 3.96Å; Y196-Y275 WeakPolarHBondContact OH-CE1 3.31Å; Y196-Y275 PolarHBondContact OH-OH 2.7Å; Y196-Y275 VanDerWaalsContact OH-OH 3.05Å; P197-Y275 HydrophobicContact CB-CD1 3.91Å; P197-Y275 HydrophobicContact CB-CD2 3.73Å; P197-Y275 HydrophobicContact CB-CE1 4.15Å; P197-Y275 HydrophobicContact CB-CE2 3.97Å; P197-Y275 HydrophobicContact CB-CG 3.68Å; P197-Y275 HydrophobicContact CG-CD1 4.09Å; P197-Y275 HydrophobicContact CG-CD2 4.18Å; P197-Y275 HydrophobicContact CG-CG 3.74Å; R270-Y275 HydrophobicContact CG-CE2 4.24Å; Y272-Y275 WeakPolarHBondContact O-CB 3.18Å; Y272-Y275 PolarHBondContact O-N 2.96Å; S273-Y275 VanDerWaalsContact C-N 3.33Å; S273-Y275 PolarHBondContact O-N 3.12Å; Y275-I277 PolarHBondContact O-N 3.45Å; Y275-L279 WeakPolarHBondContact O-CA 2.95Å; Y275-L279 WeakPolarHBondContact O-CB 3.46Å; Y275-L279 PolarHBondContact O-N 3.44Å; Y275-Y280 PolarHBondContact O-N 2.85Å; Y275-Y280 VanDerWaalsContact O-N 3.1Å
276	L	93.2	Very high	94.1	Very high	59 Å²	59	51.7 Å²	51.7	31%	0.309	26%	0.255	S	S	.	.	I	π-helix	trans	-57.4	-49.5	174.5	-165.3	158.4	0	0	0	111	Y272 S273 Y274 Y280 I281	Y272-L276 HydrophobicContact CE2-CD1 4.24Å; Y272-L276 PolarHBondContact O-N 3.29Å; S273-L276 WeakPolarHBondContact O-CB 3.45Å; S273-L276 PolarHBondContact O-N 3.5Å; Y274-L276 VanDerWaalsContact C-N 3.34Å; L276-Y280 PolarHBondContact O-N 3.2Å; L276-I281 HydrophobicContact CD2-CD1 3.5Å; L276-I281 HydrophobicContact CD2-CG1 3.81Å; L276-I281 WeakPolarHBondContact O-CG1 3.31Å; L276-I281 PolarHBondContact O-N 2.97Å
277	I	94.1	Very high	94.1	Very high	114 Å²	114	51.7 Å²	51.7	59%	0.585	26%	0.255	S	S	*	.	I	π-helix	trans	-76.8	-37.9	-175.5	-61.5	170.9	0	0	0	112.4	S273 Y274 Y275 P282	S273-I277 PolarHBondContact O-N 3.03Å; Y274-I277 PolarHBondContact O-N 3.4Å; Y275-I277 PolarHBondContact O-N 3.45Å; I277-P282 WeakPolarHBondContact O-CD 3.39Å
278	T	92.2	Very high	94	Very high	61 Å²	61	53.2 Å²	53.2	37%	0.374	26%	0.264	S	S	.	.	I	π-helix	trans	-92.6	-19.3	-173.3	60.2	0	0	0	0	114.1	Y274	Y274-T278 HydrophobicContact CD2-CG2 4.03Å; Y274-T278 HydrophobicContact CE1-CG2 4.44Å; Y274-T278 WeakPolarHBondContact CE1-OG1 3.49Å; Y274-T278 HydrophobicContact CE2-CG2 3.64Å; Y274-T278 WeakPolarHBondContact O-CB 3.08Å; Y274-T278 WeakPolarHBondContact O-CG2 3.07Å; Y274-T278 PolarHBondContact O-N 3.44Å; Y274-T278 PolarHBondContact O-OG1 2.93Å
279	L	93.9	Very high	94	Very high	6 Å²	6	56 Å²	56	3%	0.031	28%	0.281	C	S	.	.	I	π-helix	trans	-121.8	-62.6	-174.4	-164.7	166.9	0	0	0	111.8	Y275 S283 Q318 V322 I335	Y275-L279 WeakPolarHBondContact O-CA 2.95Å; Y275-L279 WeakPolarHBondContact O-CB 3.46Å; Y275-L279 PolarHBondContact O-N 3.44Å; L279-S283 WeakPolarHBondContact O-CB 3.49Å; L279-S283 PolarHBondContact O-N 2.87Å; L279-S283 VanDerWaalsContact O-N 3.07Å; L279-S283 PolarHBondContact O-OG 2.95Å; L279-Q318 PolarHBondContact O-NE2 3.36Å; L279-Q318 VanDerWaalsContact O-NE2 3.12Å; L279-V322 HydrophobicContact CD1-CB 4.39Å; L279-V322 HydrophobicContact CD1-CG1 4.09Å; L279-V322 HydrophobicContact CD1-CG2 3.37Å; L279-V322 HydrophobicContact CG-CG2 4.09Å; L279-I335 HydrophobicContact CD1-CD1 3.62Å; L279-I335 HydrophobicContact CD1-CG1 3.81Å; L279-I335 HydrophobicContact CD2-CD1 3.43Å; L279-I335 VanDerWaalsContact CD2-CD1 3.43Å; L279-I335 HydrophobicContact CD2-CG1 4.31Å; L279-I335 HydrophobicContact CG-CD1 4.18Å
280	Y	95.3	Very high	94	Very high	8 Å²	8	52.7 Å²	52.7	3%	0.031	27%	0.267	C	S	.	.	I	π-helix	trans	-66.7	-47.3	-172.9	-72.7	-84.3	0	0	0	112.7	P197 Y275 L276 S283 F284 I335 W338 Y519 W520	P197-Y280 HydrophobicContact CG-CE2 4.11Å; Y275-Y280 PolarHBondContact O-N 2.85Å; Y275-Y280 VanDerWaalsContact O-N 3.1Å; L276-Y280 PolarHBondContact O-N 3.2Å; Y280-S283 WeakPolarHBondContact CA-OG 3.24Å; Y280-S283 PolarHBondContact O-N 2.94Å; Y280-S283 PolarHBondContact O-OG 2.77Å; Y280-F284 VanDerWaalsContact O-CB 3.29Å; Y280-F284 WeakPolarHBondContact O-CB 3.44Å; Y280-F284 PolarHBondContact O-N 3.37Å; Y280-I335 HydrophobicContact CE1-CD1 4.32Å; Y280-I335 HydrophobicContact CE2-CD1 4.2Å; Y280-W338 AromaticContact CD1-CD2 3.59Å; Y280-W338 HydrophobicContact CD1-CD2 3.59Å; Y280-W338 AromaticContact CD1-CE2 3.43Å; Y280-W338 VanDerWaalsContact CD1-CE2 3.43Å; Y280-W338 HydrophobicContact CD1-CE3 4.02Å; Y280-W338 HydrophobicContact CD1-CG 4.01Å; Y280-W338 HydrophobicContact CD1-CH2 4.14Å; Y280-W338 AromaticContact CD1-CZ2 3.74Å; Y280-W338 HydrophobicContact CD1-CZ2 3.74Å; Y280-W338 HydrophobicContact CD1-CZ3 4.27Å; Y280-W338 AromaticContact CD1-NE1 3.72Å; Y280-W338 HydrophobicContact CE1-CB 4.24Å; Y280-W338 AromaticContact CE1-CD2 3.58Å; Y280-W338 HydrophobicContact CE1-CD2 3.58Å; Y280-W338 AromaticContact CE1-CE2 3.95Å; Y280-W338 AromaticContact CE1-CE3 3.91Å; Y280-W338 HydrophobicContact CE1-CE3 3.91Å; Y280-W338 AromaticContact CE1-CG 3.71Å; Y280-W338 HydrophobicContact CE1-CG 3.71Å; Y280-Y519 AromaticContact CE1-CE1 3.65Å; Y280-Y519 HydrophobicContact CE1-CE1 3.65Å; Y280-Y519 AromaticContact CE1-CZ 3.96Å; Y280-Y519 PolarHBondContact OH-OH 3.39Å; Y280-W520 AromaticContact CD1-CH2 3.92Å; Y280-W520 HydrophobicContact CD1-CH2 3.92Å; Y280-W520 AromaticContact CD1-CZ2 3.75Å; Y280-W520 HydrophobicContact CD1-CZ2 3.75Å; Y280-W520 HydrophobicContact CD2-CH2 4.32Å; Y280-W520 HydrophobicContact CE1-CH2 4.04Å; Y280-W520 HydrophobicContact CE1-CZ2 4.12Å; Y280-W520 HydrophobicContact CE2-CH2 4.4Å; Y280-W520 HydrophobicContact CG-CH2 4.07Å; Y280-W520 HydrophobicContact CG-CZ2 4.15Å
281	I	95.5	Very high	93.9	Very high	74 Å²	74	54.4 Å²	54.4	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-62.7	-50.1	179	-70.9	174.2	0	0	0	111.8	L276 S283 F284 M285	L276-I281 HydrophobicContact CD2-CD1 3.5Å; L276-I281 HydrophobicContact CD2-CG1 3.81Å; L276-I281 WeakPolarHBondContact O-CG1 3.31Å; L276-I281 PolarHBondContact O-N 2.97Å; I281-S283 PolarHBondContact O-N 2.79Å; I281-F284 PolarHBondContact O-N 3.18Å; I281-M285 HydrophobicContact CG2-CG 4.47Å; I281-M285 HydrophobicContact CG2-SD 4.09Å; I281-M285 WeakPolarHBondContact O-CG 3.43Å; I281-M285 PolarHBondContact O-N 3.01Å
282	P	95.9	Very high	93.9	Very high	45 Å²	45	54 Å²	54	29%	0.292	28%	0.276	S	S	.	.	H	α-helix	trans	-61.9	-41	178.2	-27.4	36.6	0	0	0	113.5	I277 M285 L286	I277-P282 WeakPolarHBondContact O-CD 3.39Å; P282-M285 PolarHBondContact O-N 3.5Å; P282-L286 WeakPolarHBondContact O-CG 3.31Å; P282-L286 PolarHBondContact O-N 3.36Å
283	S	95.8	Very high	93.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-66.5	-40.4	177.8	52.4	0	0	0	0	112.1	L279 Y280 I281 M285 L286 V287 W338	L279-S283 WeakPolarHBondContact O-CB 3.49Å; L279-S283 PolarHBondContact O-N 2.87Å; L279-S283 VanDerWaalsContact O-N 3.07Å; L279-S283 PolarHBondContact O-OG 2.95Å; Y280-S283 WeakPolarHBondContact CA-OG 3.24Å; Y280-S283 PolarHBondContact O-N 2.94Å; Y280-S283 PolarHBondContact O-OG 2.77Å; I281-S283 PolarHBondContact O-N 2.79Å; S283-M285 PolarHBondContact O-N 2.87Å; S283-L286 PolarHBondContact O-N 2.97Å; S283-V287 WeakPolarHBondContact O-CG2 3.35Å; S283-V287 PolarHBondContact O-N 3.43Å; S283-V287 VanDerWaalsContact O-N 3.1Å; S283-W338 PolarHBondContact OG-NE1 2.82Å
284	F	95.7	Very high	93.9	Very high	87 Å²	87	46.7 Å²	46.7	38%	0.382	24%	0.238	S	C	.	.	H	α-helix	trans	-58.2	-47.6	170.9	-179.6	-81.9	0	0	0	111.5	Y280 I281 L286 V287 V288 F512	Y280-F284 VanDerWaalsContact O-CB 3.29Å; Y280-F284 WeakPolarHBondContact O-CB 3.44Å; Y280-F284 PolarHBondContact O-N 3.37Å; I281-F284 PolarHBondContact O-N 3.18Å; F284-L286 VanDerWaalsContact C-N 3.32Å; F284-L286 PolarHBondContact O-N 3.44Å; F284-V287 PolarHBondContact O-N 2.94Å; F284-V288 HydrophobicContact CD1-CG2 4.11Å; F284-V288 HydrophobicContact CE1-CG2 3.7Å; F284-V288 HydrophobicContact CZ-CG2 4.22Å; F284-V288 WeakPolarHBondContact O-CG2 3.38Å; F284-V288 PolarHBondContact O-N 2.98Å; F284-F512 HydrophobicContact CD2-CD1 4.46Å; F284-F512 AromaticContact CD2-CE1 3.39Å; F284-F512 HydrophobicContact CD2-CE1 3.39Å; F284-F512 AromaticContact CD2-CZ 3.94Å; F284-F512 HydrophobicContact CD2-CZ 3.94Å; F284-F512 HydrophobicContact CE2-CD1 4.18Å; F284-F512 AromaticContact CE2-CE1 3.51Å; F284-F512 HydrophobicContact CE2-CE1 3.51Å; F284-F512 HydrophobicContact CE2-CZ 4.45Å; F284-F512 HydrophobicContact CG-CE1 4.21Å; F284-F512 HydrophobicContact CZ-CE1 4.41Å
285	M	95.3	Very high	93.8	Very high	118 Å²	118	49.1 Å²	49.1	58%	0.581	25%	0.246	S	C	*	.	H	α-helix	trans	-59.9	-40.7	177.2	-74.5	179.3	144	0	0	112.1	I281 P282 S283 V287 V288 V289	I281-M285 HydrophobicContact CG2-CG 4.47Å; I281-M285 HydrophobicContact CG2-SD 4.09Å; I281-M285 WeakPolarHBondContact O-CG 3.43Å; I281-M285 PolarHBondContact O-N 3.01Å; P282-M285 PolarHBondContact O-N 3.5Å; S283-M285 PolarHBondContact O-N 2.87Å; M285-V287 PolarHBondContact O-N 2.8Å; M285-V288 PolarHBondContact O-N 2.89Å; M285-V289 VanDerWaalsContact O-CG2 3.32Å; M285-V289 WeakPolarHBondContact O-CG2 3.25Å; M285-V289 PolarHBondContact O-N 3.37Å
286	L	95.9	Very high	93.7	Very high	28 Å²	28	49.6 Å²	49.6	15%	0.147	25%	0.25	C	S	.	.	H	α-helix	trans	-62.8	-40.3	176.8	-72.9	171.8	0	0	0	112.5	P282 S283 F284 V288 V289 S290 T314 M315 I346	P282-L286 WeakPolarHBondContact O-CG 3.31Å; P282-L286 PolarHBondContact O-N 3.36Å; S283-L286 PolarHBondContact O-N 2.97Å; F284-L286 VanDerWaalsContact C-N 3.32Å; F284-L286 PolarHBondContact O-N 3.44Å; L286-V288 VanDerWaalsContact C-N 3.34Å; L286-V289 PolarHBondContact O-N 3.47Å; L286-S290 PolarHBondContact O-N 3.05Å; L286-T314 HydrophobicContact CD1-CG2 3.74Å; L286-T314 HydrophobicContact CD2-CG2 3.92Å; L286-T314 HydrophobicContact CG-CG2 4.48Å; L286-M315 HydrophobicContact CD1-CB 4.46Å; L286-M315 HydrophobicContact CD1-SD 4.35Å; L286-I346 HydrophobicContact CB-CD1 4.3Å
287	V	96.1	Very high	93.4	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-43.5	174.2	175.6	0	0	0	0	110.4	S283 F284 M285 V289 S290 W291 C342 F345 I346 F512	S283-V287 WeakPolarHBondContact O-CG2 3.35Å; S283-V287 PolarHBondContact O-N 3.43Å; S283-V287 VanDerWaalsContact O-N 3.1Å; F284-V287 PolarHBondContact O-N 2.94Å; M285-V287 PolarHBondContact O-N 2.8Å; V287-V289 PolarHBondContact O-N 2.96Å; V287-S290 WeakPolarHBondContact O-CB 3.44Å; V287-S290 PolarHBondContact O-N 3.45Å; V287-S290 PolarHBondContact O-OG 3.03Å; V287-W291 HydrophobicContact CG1-CZ2 3.92Å; V287-W291 VanDerWaalsContact O-CD1 3.26Å; V287-W291 PolarHBondContact O-N 3.32Å; V287-W291 PolarHBondContact O-NE1 3.28Å; V287-C342 HydrophobicContact CG2-CB 3.77Å; V287-F345 HydrophobicContact CG1-CB 4.08Å; V287-I346 HydrophobicContact CG2-CD1 4.34Å; V287-I346 HydrophobicContact CG2-CG1 4.26Å; V287-F512 HydrophobicContact CB-CE1 4.24Å; V287-F512 HydrophobicContact CB-CE2 4.36Å; V287-F512 HydrophobicContact CB-CZ 4.04Å; V287-F512 HydrophobicContact CG1-CD1 4.06Å; V287-F512 HydrophobicContact CG1-CD2 4.01Å; V287-F512 HydrophobicContact CG1-CE1 4Å; V287-F512 HydrophobicContact CG1-CE2 4.01Å; V287-F512 HydrophobicContact CG1-CG 4.05Å; V287-F512 HydrophobicContact CG1-CZ 4Å; V287-F512 HydrophobicContact CG2-CE2 4.11Å; V287-F512 HydrophobicContact CG2-CZ 4.06Å
288	V	94.4	Very high	92.9	Very high	55 Å²	55	49 Å²	49	33%	0.333	25%	0.247	S	C	.	.	H	α-helix	trans	-63.9	-40.8	176.3	175.8	0	0	0	0	111.8	F284 M285 L286 S290 W291	F284-V288 HydrophobicContact CD1-CG2 4.11Å; F284-V288 HydrophobicContact CE1-CG2 3.7Å; F284-V288 HydrophobicContact CZ-CG2 4.22Å; F284-V288 WeakPolarHBondContact O-CG2 3.38Å; F284-V288 PolarHBondContact O-N 2.98Å; M285-V288 PolarHBondContact O-N 2.89Å; L286-V288 VanDerWaalsContact C-N 3.34Å; V288-S290 VanDerWaalsContact C-N 3.26Å; V288-S290 PolarHBondContact O-N 2.71Å; V288-W291 HydrophobicContact CG1-CE3 4.38Å; V288-W291 HydrophobicContact CG2-CE3 4.33Å; V288-W291 HydrophobicContact CG2-CH2 4.32Å; V288-W291 HydrophobicContact CG2-CZ3 4.04Å; V288-W291 WeakPolarHBondContact O-CB 3.38Å; V288-W291 PolarHBondContact O-N 3Å
289	V	94.1	Very high	92.5	Very high	60 Å²	60	51.9 Å²	51.9	36%	0.364	26%	0.26	S	S	.	.	H	α-helix	trans	-60.8	-36.9	175.1	171.1	0	0	0	0	111	M285 L286 V287 W291 V292 T311	M285-V289 VanDerWaalsContact O-CG2 3.32Å; M285-V289 WeakPolarHBondContact O-CG2 3.25Å; M285-V289 PolarHBondContact O-N 3.37Å; L286-V289 PolarHBondContact O-N 3.47Å; V287-V289 PolarHBondContact O-N 2.96Å; V289-W291 PolarHBondContact O-N 2.84Å; V289-V292 VanDerWaalsContact O-CB 3.26Å; V289-V292 WeakPolarHBondContact O-CB 3.26Å; V289-V292 WeakPolarHBondContact O-CG2 3.35Å; V289-V292 PolarHBondContact O-N 2.98Å; V289-T311 HydrophobicContact CB-CG2 4.29Å; V289-T311 HydrophobicContact CG1-CG2 3.73Å
290	S	94.2	Very high	92.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60.9	-27.5	175.9	82.2	0	0	0	0	113	L286 V287 V288 V292 N293	L286-S290 PolarHBondContact O-N 3.05Å; V287-S290 WeakPolarHBondContact O-CB 3.44Å; V287-S290 PolarHBondContact O-N 3.45Å; V287-S290 PolarHBondContact O-OG 3.03Å; V288-S290 VanDerWaalsContact C-N 3.26Å; V288-S290 PolarHBondContact O-N 2.71Å; S290-V292 VanDerWaalsContact C-N 3.31Å; S290-V292 PolarHBondContact O-N 3.24Å; S290-N293 WeakPolarHBondContact O-CB 3.31Å; S290-N293 PolarHBondContact O-N 3.4Å
291	W	92.6	Very high	92.2	Very high	41 Å²	41	55.1 Å²	55.1	16%	0.155	28%	0.284	C	S	.	.	H	α-helix	trans	-75.5	-19	177.6	-54.5	-14.5	0	0	0	113.5	V287 V288 V289 N293 F294 P509 F512	V287-W291 HydrophobicContact CG1-CZ2 3.92Å; V287-W291 VanDerWaalsContact O-CD1 3.26Å; V287-W291 PolarHBondContact O-N 3.32Å; V287-W291 PolarHBondContact O-NE1 3.28Å; V288-W291 HydrophobicContact CG1-CE3 4.38Å; V288-W291 HydrophobicContact CG2-CE3 4.33Å; V288-W291 HydrophobicContact CG2-CH2 4.32Å; V288-W291 HydrophobicContact CG2-CZ3 4.04Å; V288-W291 WeakPolarHBondContact O-CB 3.38Å; V288-W291 PolarHBondContact O-N 3Å; V289-W291 PolarHBondContact O-N 2.84Å; W291-N293 PolarHBondContact O-N 3.14Å; W291-F294 HydrophobicContact CB-CD2 3.95Å; W291-F294 HydrophobicContact CB-CE2 3.95Å; W291-F294 AromaticContact CD1-CE2 3.8Å; W291-F294 HydrophobicContact CG-CE2 4.06Å; W291-F294 WeakPolarHBondContact O-CB 3.28Å; W291-F294 WeakPolarHBondContact O-CD2 3.1Å; W291-F294 WeakPolarHBondContact O-CG 3.39Å; W291-F294 PolarHBondContact O-N 3.32Å; W291-P509 HydrophobicContact CD2-CG 4Å; W291-P509 HydrophobicContact CE3-CB 4.22Å; W291-P509 HydrophobicContact CE3-CG 3.72Å; W291-P509 VanDerWaalsContact CH2-CA 3.5Å; W291-P509 HydrophobicContact CH2-CB 3.72Å; W291-P509 HydrophobicContact CH2-CG 4.04Å; W291-P509 HydrophobicContact CZ2-CB 4.26Å; W291-P509 HydrophobicContact CZ2-CG 4.3Å; W291-P509 HydrophobicContact CZ3-CB 3.7Å; W291-P509 HydrophobicContact CZ3-CG 3.73Å; W291-F512 HydrophobicContact CH2-CB 4.33Å; W291-F512 HydrophobicContact CH2-CD1 4.03Å; W291-F512 HydrophobicContact CZ2-CB 3.78Å; W291-F512 AromaticContact CZ2-CD1 3.87Å; W291-F512 HydrophobicContact CZ2-CD1 3.87Å; W291-F512 HydrophobicContact CZ2-CG 4.08Å
292	V	91.4	Very high	92.1	Very high	70 Å²	70	55 Å²	55	42%	0.424	29%	0.288	S	S	.	.	H	α-helix	trans	-58.8	-29.5	174.8	179.9	0	0	0	0	110.3	V289 S290 F294 W295 I296	V289-V292 VanDerWaalsContact O-CB 3.26Å; V289-V292 WeakPolarHBondContact O-CB 3.26Å; V289-V292 WeakPolarHBondContact O-CG2 3.35Å; V289-V292 PolarHBondContact O-N 2.98Å; S290-V292 VanDerWaalsContact C-N 3.31Å; S290-V292 PolarHBondContact O-N 3.24Å; V292-F294 PolarHBondContact O-N 3.25Å; V292-F294 VanDerWaalsContact O-N 3.16Å; V292-W295 PolarHBondContact O-N 3.04Å; V292-I296 HydrophobicContact CG1-CD1 4.4Å; V292-I296 PolarHBondContact O-N 2.75Å
293	N	89.5	Confident	91.9	Very high	1 Å²	1	55 Å²	55	1%	0.005	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-31.2	174.8	-74.1	-24.5	0	0	0	113.7	S290 W291 W295 L307	S290-N293 WeakPolarHBondContact O-CB 3.31Å; S290-N293 PolarHBondContact O-N 3.4Å; W291-N293 PolarHBondContact O-N 3.14Å; N293-W295 PolarHBondContact O-N 3.46Å; N293-L307 WeakPolarHBondContact OD1-CB 3.22Å
294	F	91.7	Very high	91.8	Very high	1 Å²	1	55.1 Å²	55.1	0%	0.004	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-15.2	179.4	-49.1	-38.7	0	0	0	113.2	W291 V292 A349 E352 R505 F508	W291-F294 HydrophobicContact CB-CD2 3.95Å; W291-F294 HydrophobicContact CB-CE2 3.95Å; W291-F294 AromaticContact CD1-CE2 3.8Å; W291-F294 HydrophobicContact CG-CE2 4.06Å; W291-F294 WeakPolarHBondContact O-CB 3.28Å; W291-F294 WeakPolarHBondContact O-CD2 3.1Å; W291-F294 WeakPolarHBondContact O-CG 3.39Å; W291-F294 PolarHBondContact O-N 3.32Å; V292-F294 PolarHBondContact O-N 3.25Å; V292-F294 VanDerWaalsContact O-N 3.16Å; F294-A349 HydrophobicContact CE1-CB 4.04Å; F294-A349 HydrophobicContact CZ-CB 3.88Å; F294-E352 HydrophobicContact CD1-CG 4.23Å; F294-E352 HydrophobicContact CE1-CB 4.08Å; F294-E352 HydrophobicContact CE1-CG 3.79Å; F294-R505 HydrophobicContact CB-CG 3.76Å; F294-R505 VanDerWaalsContact O-CZ 3.28Å; F294-R505 PolarHBondContact O-NE 3.15Å; F294-R505 PolarHBondContact O-NH2 2.84Å; F294-F508 HydrophobicContact CE2-CB 3.85Å; F294-F508 HydrophobicContact CE2-CD1 4.31Å; F294-F508 AromaticContact CE2-CD2 4Å; F294-F508 HydrophobicContact CE2-CD2 4Å; F294-F508 AromaticContact CE2-CG 3.81Å; F294-F508 HydrophobicContact CE2-CG 3.81Å; F294-F508 HydrophobicContact CZ-CB 4.26Å; F294-F508 AromaticContact CZ-CD1 3.9Å; F294-F508 HydrophobicContact CZ-CD1 3.9Å; F294-F508 AromaticContact CZ-CD2 3.7Å; F294-F508 HydrophobicContact CZ-CD2 3.7Å; F294-F508 HydrophobicContact CZ-CE1 4.16Å; F294-F508 AromaticContact CZ-CE2 3.94Å; F294-F508 HydrophobicContact CZ-CE2 3.94Å; F294-F508 AromaticContact CZ-CG 3.69Å; F294-F508 HydrophobicContact CZ-CG 3.69Å; F294-F508 HydrophobicContact CZ-CZ 4.17Å
295	W	90.1	Very high	91.6	Very high	175 Å²	175	53.7 Å²	53.7	66%	0.663	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.6	-23.4	-178.7	-69.6	89.8	0	0	0	113.3	V292 N293	V292-W295 PolarHBondContact O-N 3.04Å; N293-W295 PolarHBondContact O-N 3.46Å
296	I	90	Very high	91.6	Very high	38 Å²	38	51.4 Å²	51.4	20%	0.195	29%	0.287	C	S	.	.	S	Bend	trans	-66.7	145.9	176.5	-65.9	172.9	0	0	0	109.2	V292 A300 R304 L307	V292-I296 HydrophobicContact CG1-CD1 4.4Å; V292-I296 PolarHBondContact O-N 2.75Å; I296-A300 HydrophobicContact CG2-CB 3.82Å; I296-R304 HydrophobicContact CB-CG 4Å; I296-R304 HydrophobicContact CG2-CG 3.67Å; I296-R304 PolarHBondContact O-NE 3.35Å; I296-R304 PolarHBondContact O-NH2 2.93Å; I296-L307 HydrophobicContact CD1-CD1 3.39Å
297	D	87.5	Confident	91.4	Very high	121 Å²	121	53 Å²	53	65%	0.647	30%	0.295	S	S	*	.			trans	-63.1	145.1	177.1	-75	-48.8	0	0	0	112.2	D299 A300 R304	D297-D299 PolarHBondContact O-N 3.18Å; D297-D299 VanDerWaalsContact O-N 3.11Å; D297-A300 PolarHBondContact O-N 2.92Å; D297-A300 VanDerWaalsContact O-N 3.13Å; D297-R304 PolarHBondContact O-NE 3.16Å
298	K	84	Confident	91.3	Very high	40 Å²	40	53 Å²	53	17%	0.174	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.6	-179.3	68.3	177	-178.9	60.9	0	113.5	V356 S497	K298-V356 HydrophobicContact CB-CG1 4.01Å; K298-S497 WeakPolarHBondContact CD-OG 3.38Å
299	D	84	Confident	91.3	Very high	122 Å²	122	54.1 Å²	54.1	65%	0.652	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-17.3	-177.6	-56.6	-41	0	0	0	111.4	D297 V301	D297-D299 PolarHBondContact O-N 3.18Å; D297-D299 VanDerWaalsContact O-N 3.11Å; D299-V301 VanDerWaalsContact C-N 3.25Å; D299-V301 PolarHBondContact O-N 2.81Å
300	A	90.9	Very high	91.3	Very high	38 Å²	38	54.8 Å²	54.8	31%	0.314	31%	0.307	S	S	.	.			trans	-85.1	59.2	176.1	0	0	0	0	0	112.1	I296 D297 A303 R304	I296-A300 HydrophobicContact CG2-CB 3.82Å; D297-A300 PolarHBondContact O-N 2.92Å; D297-A300 VanDerWaalsContact O-N 3.13Å; A300-A303 HydrophobicContact CB-CB 4.42Å; A300-A303 PolarHBondContact O-N 3.02Å; A300-R304 PolarHBondContact O-N 3.48Å
301	V	91.1	Very high	91.4	Very high	43 Å²	43	55 Å²	55	26%	0.261	31%	0.308	S	S	.	.	H	α-helix	trans	-55.6	-47	-176.3	179.6	0	0	0	0	113.2	D299 A303 R304 V305 F353	D299-V301 VanDerWaalsContact C-N 3.25Å; D299-V301 PolarHBondContact O-N 2.81Å; V301-A303 VanDerWaalsContact C-N 3.3Å; V301-A303 PolarHBondContact O-N 3.43Å; V301-R304 PolarHBondContact O-N 2.88Å; V301-V305 HydrophobicContact CG1-CG2 4.16Å; V301-V305 WeakPolarHBondContact O-CG2 3.24Å; V301-V305 PolarHBondContact O-N 3.16Å; V301-F353 HydrophobicContact CG1-CE2 4.39Å; V301-F353 HydrophobicContact CG1-CZ 3.99Å
302	P	93.1	Very high	91.5	Very high	71 Å²	71	55.3 Å²	55.3	46%	0.461	31%	0.312	S	S	.	.	H	α-helix	trans	-60.1	-39.4	-178	-24	34.9	0	0	0	113.1	S306	P302-S306 VanDerWaalsContact O-CB 3.25Å; P302-S306 WeakPolarHBondContact O-CB 3.42Å; P302-S306 PolarHBondContact O-N 3.4Å
303	A	93.2	Very high	91.8	Very high	46 Å²	46	57.3 Å²	57.3	38%	0.38	32%	0.32	S	S	.	.	H	α-helix	trans	-66.1	-47.5	179.5	0	0	0	0	0	111.9	A300 V301 S306 L307	A300-A303 HydrophobicContact CB-CB 4.42Å; A300-A303 PolarHBondContact O-N 3.02Å; V301-A303 VanDerWaalsContact C-N 3.3Å; V301-A303 PolarHBondContact O-N 3.43Å; A303-S306 PolarHBondContact O-N 3.23Å; A303-L307 WeakPolarHBondContact O-CG 3.41Å; A303-L307 PolarHBondContact O-N 3.37Å
304	R	92.3	Very high	92.1	Very high	2 Å²	2	60.1 Å²	60.1	1%	0.008	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-43.5	179.4	-68.6	-169.1	177.4	-152.1	8.9	112	I296 D297 A300 V301 G308 F353 D501	I296-R304 HydrophobicContact CB-CG 4Å; I296-R304 HydrophobicContact CG2-CG 3.67Å; I296-R304 PolarHBondContact O-NE 3.35Å; I296-R304 PolarHBondContact O-NH2 2.93Å; D297-R304 PolarHBondContact O-NE 3.16Å; A300-R304 PolarHBondContact O-N 3.48Å; V301-R304 PolarHBondContact O-N 2.88Å; R304-G308 PolarHBondContact O-N 3.32Å; R304-F353 HydrophobicContact CB-CD2 3.58Å; R304-F353 HydrophobicContact CB-CE2 3.68Å; R304-F353 HydrophobicContact CB-CG 4.28Å; R304-F353 HydrophobicContact CB-CZ 4.48Å; R304-F353 HydrophobicContact CG-CD2 4.23Å; R304-F353 HydrophobicContact CG-CE2 4.47Å; R304-D501 IonicContact CZ-OD1 2.73Å; R304-D501 IonicContact CZ-OD2 2.82Å; R304-D501 IonicContact NH1-OD1 2.93Å; R304-D501 PolarHBondContact NH1-OD1 2.76Å; R304-D501 IonicContact NH1-OD2 2.88Å; R304-D501 IonicContact NH2-OD1 3.82Å; R304-D501 PolarHBondContact NH2-OD1 3.05Å; R304-D501 IonicContact NH2-OD2 3.38Å; R304-D501 PolarHBondContact NH2-OD2 2.88Å
305	V	92.5	Very high	92.3	Very high	58 Å²	58	60.1 Å²	60.1	35%	0.352	34%	0.337	S	S	.	.	H	α-helix	trans	-62.5	-48.8	177.2	176.5	0	0	0	0	110.7	V301 L307 G308 V309 F353	V301-V305 HydrophobicContact CG1-CG2 4.16Å; V301-V305 WeakPolarHBondContact O-CG2 3.24Å; V301-V305 PolarHBondContact O-N 3.16Å; V305-L307 PolarHBondContact O-N 3.32Å; V305-G308 PolarHBondContact O-N 3.15Å; V305-V309 HydrophobicContact CG1-CG2 4.15Å; V305-V309 WeakPolarHBondContact O-CB 3.42Å; V305-V309 WeakPolarHBondContact O-CG2 3.24Å; V305-V309 PolarHBondContact O-N 3.43Å; V305-F353 HydrophobicContact CG2-CD1 4.47Å; V305-F353 HydrophobicContact CG2-CE1 3.39Å; V305-F353 HydrophobicContact CG2-CE2 4.35Å; V305-F353 HydrophobicContact CG2-CZ 3.31Å
306	S	94	Very high	92.6	Very high	70 Å²	70	54.7 Å²	54.7	49%	0.49	32%	0.323	S	S	.	.	H	α-helix	trans	-59	-48.1	-178	-179.8	0	0	0	0	111.7	P302 A303 T310	P302-S306 VanDerWaalsContact O-CB 3.25Å; P302-S306 WeakPolarHBondContact O-CB 3.42Å; P302-S306 PolarHBondContact O-N 3.4Å; A303-S306 PolarHBondContact O-N 3.23Å; S306-T310 WeakPolarHBondContact O-CB 3.46Å; S306-T310 PolarHBondContact O-N 3.07Å; S306-T310 PolarHBondContact O-OG1 3.12Å
307	L	93	Very high	92.9	Very high	61 Å²	61	57.1 Å²	57.1	32%	0.319	34%	0.34	S	S	.	.	H	α-helix	trans	-64.4	-44.3	178.3	-72.9	173	0	0	0	112.5	N293 I296 A303 V305 T311	N293-L307 WeakPolarHBondContact OD1-CB 3.22Å; I296-L307 HydrophobicContact CD1-CD1 3.39Å; A303-L307 WeakPolarHBondContact O-CG 3.41Å; A303-L307 PolarHBondContact O-N 3.37Å; V305-L307 PolarHBondContact O-N 3.32Å; L307-T311 WeakPolarHBondContact O-CB 3.31Å; L307-T311 VanDerWaalsContact O-CG2 3.3Å; L307-T311 WeakPolarHBondContact O-CG2 3.37Å; L307-T311 PolarHBondContact O-N 3.4Å; L307-T311 PolarHBondContact O-OG1 3.28Å
308	G	92.7	Very high	93.2	Very high	0 Å²	0	53 Å²	53	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64	-45.9	179.4	0	0	0	0	0	113.1	R304 V305 T311 L312 L350	R304-G308 PolarHBondContact O-N 3.32Å; V305-G308 PolarHBondContact O-N 3.15Å; G308-T311 PolarHBondContact O-OG1 2.79Å; G308-L312 PolarHBondContact O-N 3.49Å; G308-L350 VanDerWaalsContact CA-CD2 3.49Å; G308-L350 WeakPolarHBondContact O-CD1 3.48Å
309	V	94.5	Very high	93.7	Very high	79 Å²	79	51.6 Å²	51.6	48%	0.479	31%	0.313	S	S	.	.	H	α-helix	trans	-68.6	-41.6	179	174.7	0	0	0	0	111.2	V305 L312 L313	V305-V309 HydrophobicContact CG1-CG2 4.15Å; V305-V309 WeakPolarHBondContact O-CB 3.42Å; V305-V309 WeakPolarHBondContact O-CG2 3.24Å; V305-V309 PolarHBondContact O-N 3.43Å; V309-L312 PolarHBondContact O-N 2.97Å; V309-L313 WeakPolarHBondContact O-CB 3.17Å; V309-L313 PolarHBondContact O-N 2.98Å
310	T	95.7	Very high	94.2	Very high	74 Å²	74	49.3 Å²	49.3	45%	0.454	31%	0.306	S	S	.	.	H	α-helix	trans	-64.7	-42.3	-179.8	-57.4	0	0	0	0	111.8	S306 L313 T314	S306-T310 WeakPolarHBondContact O-CB 3.46Å; S306-T310 PolarHBondContact O-N 3.07Å; S306-T310 PolarHBondContact O-OG1 3.12Å; T310-L313 PolarHBondContact O-N 2.93Å; T310-T314 WeakPolarHBondContact O-CB 3.39Å; T310-T314 PolarHBondContact O-N 3.25Å; T310-T314 PolarHBondContact O-OG1 2.79Å
311	T	95.2	Very high	94.3	Very high	5 Å²	5	49.3 Å²	49.3	3%	0.031	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-41.3	177	48	0	0	0	0	111.9	V289 L307 G308 T314 M315	V289-T311 HydrophobicContact CB-CG2 4.29Å; V289-T311 HydrophobicContact CG1-CG2 3.73Å; L307-T311 WeakPolarHBondContact O-CB 3.31Å; L307-T311 VanDerWaalsContact O-CG2 3.3Å; L307-T311 WeakPolarHBondContact O-CG2 3.37Å; L307-T311 PolarHBondContact O-N 3.4Å; L307-T311 PolarHBondContact O-OG1 3.28Å; G308-T311 PolarHBondContact O-OG1 2.79Å; T311-T314 PolarHBondContact O-N 2.78Å; T311-M315 WeakPolarHBondContact O-CB 3.12Å; T311-M315 PolarHBondContact O-N 3.28Å
312	L	95.5	Very high	94.4	Very high	47 Å²	47	48.1 Å²	48.1	25%	0.246	30%	0.303	C	S	.	.	H	α-helix	trans	-63.7	-45.3	176.2	-176.4	64.5	0	0	0	112	G308 V309 M315 T316 L343 I346 L350	G308-L312 PolarHBondContact O-N 3.49Å; V309-L312 PolarHBondContact O-N 2.97Å; L312-M315 PolarHBondContact O-N 2.92Å; L312-T316 WeakPolarHBondContact O-CB 3.42Å; L312-T316 PolarHBondContact O-N 2.69Å; L312-T316 PolarHBondContact O-OG1 3.06Å; L312-L343 HydrophobicContact CD1-CD2 3.91Å; L312-I346 HydrophobicContact CB-CG2 3.97Å; L312-I346 HydrophobicContact CD1-CG2 4.27Å; L312-L350 HydrophobicContact CB-CD1 4.07Å; L312-L350 HydrophobicContact CD2-CD1 3.76Å; L312-L350 HydrophobicContact CG-CD1 4.48Å
313	L	96.6	Very high	94.4	Very high	111 Å²	111	48.1 Å²	48.1	58%	0.581	30%	0.299	S	S	*	.	H	α-helix	trans	-61.5	-47.1	177.1	178.7	61.6	0	0	0	110.9	V309 T310 M315 T316 T317	V309-L313 WeakPolarHBondContact O-CB 3.17Å; V309-L313 PolarHBondContact O-N 2.98Å; T310-L313 PolarHBondContact O-N 2.93Å; L313-M315 VanDerWaalsContact C-N 3.33Å; L313-M315 PolarHBondContact O-N 3.42Å; L313-T316 WeakPolarHBondContact O-CB 3.27Å; L313-T316 PolarHBondContact O-N 2.68Å; L313-T316 VanDerWaalsContact O-N 3.14Å; L313-T317 PolarHBondContact O-N 3.29Å; L313-T317 PolarHBondContact O-OG1 3.09Å; L313-T317 VanDerWaalsContact O-OG1 3.05Å
314	T	96.5	Very high	94.3	Very high	61 Å²	61	50 Å²	50	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-60.1	-44.2	-179.3	-53.2	0	0	0	0	111.4	L286 T310 T311 T317 Q318	L286-T314 HydrophobicContact CD1-CG2 3.74Å; L286-T314 HydrophobicContact CD2-CG2 3.92Å; L286-T314 HydrophobicContact CG-CG2 4.48Å; T310-T314 WeakPolarHBondContact O-CB 3.39Å; T310-T314 PolarHBondContact O-N 3.25Å; T310-T314 PolarHBondContact O-OG1 2.79Å; T311-T314 PolarHBondContact O-N 2.78Å; T314-T317 PolarHBondContact O-N 2.75Å; T314-Q318 WeakPolarHBondContact O-CB 3.47Å; T314-Q318 PolarHBondContact O-N 3.31Å
315	M	95.5	Very high	94.2	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-65.2	-39.3	176.8	-171.1	70.5	-161.7	0	0	111.9	L286 T311 L312 L313 Q318 A319 I339 C342 L343 I346	L286-M315 HydrophobicContact CD1-CB 4.46Å; L286-M315 HydrophobicContact CD1-SD 4.35Å; T311-M315 WeakPolarHBondContact O-CB 3.12Å; T311-M315 PolarHBondContact O-N 3.28Å; L312-M315 PolarHBondContact O-N 2.92Å; L313-M315 VanDerWaalsContact C-N 3.33Å; L313-M315 PolarHBondContact O-N 3.42Å; M315-Q318 PolarHBondContact O-N 3.12Å; M315-A319 PolarHBondContact O-N 2.82Å; M315-I339 HydrophobicContact CE-CB 3.98Å; M315-I339 HydrophobicContact CE-CG1 3.95Å; M315-I339 HydrophobicContact CE-CG2 3.84Å; M315-C342 HydrophobicContact CE-CB 3.46Å; M315-C342 VanDerWaalsContact CE-CB 3.46Å; M315-C342 HydrophobicContact SD-CB 4.08Å; M315-L343 HydrophobicContact CB-CD2 3.64Å; M315-L343 HydrophobicContact CB-CG 4.43Å; M315-L343 HydrophobicContact CG-CD2 3.34Å; M315-L343 HydrophobicContact CG-CG 3.58Å; M315-I346 HydrophobicContact CB-CD1 3.75Å; M315-I346 HydrophobicContact CG-CD1 3.92Å; M315-I346 HydrophobicContact SD-CD1 4.4Å
316	T	95.7	Very high	94.2	Very high	61 Å²	61	53.5 Å²	53.5	37%	0.374	33%	0.326	S	S	.	.	H	α-helix	trans	-65.2	-43.3	176.4	-54.9	0	0	0	0	111.4	L312 L313 Q318 A319 S320	L312-T316 WeakPolarHBondContact O-CB 3.42Å; L312-T316 PolarHBondContact O-N 2.69Å; L312-T316 PolarHBondContact O-OG1 3.06Å; L313-T316 WeakPolarHBondContact O-CB 3.27Å; L313-T316 PolarHBondContact O-N 2.68Å; L313-T316 VanDerWaalsContact O-N 3.14Å; T316-Q318 VanDerWaalsContact C-N 3.34Å; T316-Q318 PolarHBondContact O-N 3.4Å; T316-A319 WeakPolarHBondContact O-CB 3.36Å; T316-A319 PolarHBondContact O-N 3.26Å; T316-S320 PolarHBondContact O-N 3.14Å; T316-S320 PolarHBondContact O-OG 3.34Å
317	T	96.3	Very high	94.3	Very high	89 Å²	89	50.7 Å²	50.7	55%	0.546	31%	0.306	S	S	.	.	H	α-helix	trans	-61.7	-42	174.9	-58.2	0	0	0	0	111.6	L313 T314 A319 S320 G321	L313-T317 PolarHBondContact O-N 3.29Å; L313-T317 PolarHBondContact O-OG1 3.09Å; L313-T317 VanDerWaalsContact O-OG1 3.05Å; T314-T317 PolarHBondContact O-N 2.75Å; T317-A319 VanDerWaalsContact C-N 3.33Å; T317-A319 PolarHBondContact O-N 3.08Å; T317-S320 PolarHBondContact O-N 3.39Å; T317-G321 PolarHBondContact O-N 2.94Å
318	Q	94.5	Very high	94.2	Very high	35 Å²	35	54.2 Å²	54.2	16%	0.164	33%	0.333	C	S	.	.	H	α-helix	trans	-61.4	-43	175.5	-168.8	178.2	16.7	0	0	111.3	L279 T314 M315 T316 S320 G321 V322	L279-Q318 PolarHBondContact O-NE2 3.36Å; L279-Q318 VanDerWaalsContact O-NE2 3.12Å; T314-Q318 WeakPolarHBondContact O-CB 3.47Å; T314-Q318 PolarHBondContact O-N 3.31Å; M315-Q318 PolarHBondContact O-N 3.12Å; T316-Q318 VanDerWaalsContact C-N 3.34Å; T316-Q318 PolarHBondContact O-N 3.4Å; Q318-S320 PolarHBondContact O-N 2.98Å; Q318-G321 PolarHBondContact O-N 2.83Å; Q318-V322 WeakPolarHBondContact O-CG2 3.43Å; Q318-V322 PolarHBondContact O-N 2.91Å; Q318-V322 VanDerWaalsContact O-N 3.15Å
319	A	94.1	Very high	94.3	Very high	11 Å²	11	55.8 Å²	55.8	9%	0.091	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-46.7	176.3	0	0	0	0	0	112.7	M315 T316 T317 G321 V322 N323 I339	M315-A319 PolarHBondContact O-N 2.82Å; T316-A319 WeakPolarHBondContact O-CB 3.36Å; T316-A319 PolarHBondContact O-N 3.26Å; T317-A319 VanDerWaalsContact C-N 3.33Å; T317-A319 PolarHBondContact O-N 3.08Å; A319-G321 VanDerWaalsContact C-N 3.32Å; A319-G321 PolarHBondContact O-N 2.86Å; A319-V322 PolarHBondContact O-N 2.92Å; A319-N323 PolarHBondContact O-N 2.79Å; A319-N323 VanDerWaalsContact O-N 3.07Å; A319-N323 PolarHBondContact O-ND2 3.24Å; A319-I339 HydrophobicContact CB-CD1 4.44Å; A319-I339 HydrophobicContact CB-CG2 3.51Å
320	S	94.4	Very high	94.2	Very high	73 Å²	73	58.2 Å²	58.2	51%	0.51	36%	0.362	S	S	.	.	H	α-helix	trans	-61.3	-39.9	175.8	-58.4	0	0	0	0	112.3	T316 T317 Q318 V322 N323 A324	T316-S320 PolarHBondContact O-N 3.14Å; T316-S320 PolarHBondContact O-OG 3.34Å; T317-S320 PolarHBondContact O-N 3.39Å; Q318-S320 PolarHBondContact O-N 2.98Å; S320-V322 VanDerWaalsContact C-N 3.31Å; S320-V322 PolarHBondContact O-N 2.89Å; S320-N323 PolarHBondContact O-N 2.83Å; S320-A324 WeakPolarHBondContact O-CB 3.44Å; S320-A324 PolarHBondContact O-N 3Å
321	G	93.9	Very high	94.2	Very high	39 Å²	39	58.8 Å²	58.8	40%	0.402	36%	0.357	S	S	.	.	H	α-helix	trans	-66.2	-29.4	179.4	0	0	0	0	0	114.3	T317 Q318 A319	T317-G321 PolarHBondContact O-N 2.94Å; Q318-G321 PolarHBondContact O-N 2.83Å; A319-G321 VanDerWaalsContact C-N 3.32Å; A319-G321 PolarHBondContact O-N 2.86Å
322	V	93	Very high	94.1	Very high	17 Å²	17	63.6 Å²	63.6	10%	0.103	39%	0.387	C	S	.	.	H	α-helix	trans	-76.8	-47.7	174.4	176.4	0	0	0	0	110.4	L279 Q318 A319 S320 A324 K325 L326 I335 I339	L279-V322 HydrophobicContact CD1-CB 4.39Å; L279-V322 HydrophobicContact CD1-CG1 4.09Å; L279-V322 HydrophobicContact CD1-CG2 3.37Å; L279-V322 HydrophobicContact CG-CG2 4.09Å; Q318-V322 WeakPolarHBondContact O-CG2 3.43Å; Q318-V322 PolarHBondContact O-N 2.91Å; Q318-V322 VanDerWaalsContact O-N 3.15Å; A319-V322 PolarHBondContact O-N 2.92Å; S320-V322 VanDerWaalsContact C-N 3.31Å; S320-V322 PolarHBondContact O-N 2.89Å; V322-A324 VanDerWaalsContact C-N 3.27Å; V322-A324 PolarHBondContact O-N 3.08Å; V322-K325 PolarHBondContact O-N 3.16Å; V322-K325 VanDerWaalsContact O-N 3.12Å; V322-L326 HydrophobicContact CG1-CD1 4.34Å; V322-I335 HydrophobicContact CG1-CG1 4.17Å; V322-I335 HydrophobicContact CG1-CG2 4.41Å; V322-I339 HydrophobicContact CB-CD1 4.47Å; V322-I339 HydrophobicContact CG2-CD1 4.43Å
323	N	92.2	Very high	94.1	Very high	72 Å²	72	61.9 Å²	61.9	39%	0.385	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-27.7	-178.6	-74.7	-28.2	0	0	0	113.2	A319 S320 K325 L326	A319-N323 PolarHBondContact O-N 2.79Å; A319-N323 VanDerWaalsContact O-N 3.07Å; A319-N323 PolarHBondContact O-ND2 3.24Å; S320-N323 PolarHBondContact O-N 2.83Å; N323-K325 PolarHBondContact O-N 3.02Å; N323-L326 PolarHBondContact O-N 2.04Å
324	A	92.9	Very high	94	Very high	85 Å²	85	56.6 Å²	56.6	70%	0.702	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-17.3	175	0	0	0	0	0	114.1	S320 V322	S320-A324 WeakPolarHBondContact O-CB 3.44Å; S320-A324 PolarHBondContact O-N 3Å; V322-A324 VanDerWaalsContact C-N 3.27Å; V322-A324 PolarHBondContact O-N 3.08Å
325	K	90.4	Very high	93.9	Very high	122 Å²	122	53.7 Å²	53.7	53%	0.53	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-2.5	179.3	-62.2	-179.9	-177.5	179.6	0	113.2	V98 V322 N323	V98-K325 WeakPolarHBondContact CG2-O 3.4Å; V322-K325 PolarHBondContact O-N 3.16Å; V322-K325 VanDerWaalsContact O-N 3.12Å; N323-K325 PolarHBondContact O-N 3.02Å
326	L	92.5	Very high	93.9	Very high	11 Å²	11	55.7 Å²	55.7	6%	0.058	34%	0.342	C	S	.	.	S	Bend	trans	-121.2	149.9	-172.7	-65.3	176	0	0	0	110.1	D97 L193 Y196 V322 N323 K333	D97-L326 HydrophobicContact CB-CD2 4.38Å; L193-L326 HydrophobicContact CD1-CD2 4.43Å; Y196-L326 HydrophobicContact CD1-CD1 3.83Å; Y196-L326 HydrophobicContact CD2-CD2 4.02Å; Y196-L326 HydrophobicContact CE1-CD1 3.67Å; Y196-L326 HydrophobicContact CE1-CD2 4.15Å; Y196-L326 HydrophobicContact CE1-CG 4.38Å; Y196-L326 HydrophobicContact CE2-CD2 3.55Å; Y196-L326 HydrophobicContact CG-CD1 4.33Å; Y196-L326 HydrophobicContact CG-CD2 4.46Å; V322-L326 HydrophobicContact CG1-CD1 4.34Å; N323-L326 PolarHBondContact O-N 2.04Å; L326-K333 HydrophobicContact CD1-CD 4.14Å
327	P	94.3	Very high	93.8	Very high	11 Å²	11	54.8 Å²	54.8	7%	0.071	34%	0.337	C	S	.	.			trans	-65	149.1	171.7	28.6	-32.9	0	0	0	110	D97 M100 L193 V329	D97-P327 VanDerWaalsContact O-CD 3.25Å; D97-P327 WeakPolarHBondContact O-CD 3.3Å; D97-P327 VanDerWaalsContact O-CG 3.24Å; D97-P327 WeakPolarHBondContact O-CG 3.45Å; M100-P327 HydrophobicContact CE-CG 4.18Å; L193-P327 HydrophobicContact CD1-CG 3.64Å; P327-V329 HydrophobicContact CG-CG1 4.12Å; P327-V329 PolarHBondContact O-N 3.19Å
328	P	92.8	Very high	93.8	Very high	136 Å²	136	50.7 Å²	50.7	88%	0.883	31%	0.311	S	S	*	.			trans	-69.9	94	173.3	29.8	-33.6	0	0	0	109.7
329	V	93	Very high	93.9	Very high	33 Å²	33	49.5 Å²	49.5	20%	0.2	31%	0.306	C	S	.	.			trans	-90.6	147.7	175.4	-65.4	0	0	0	0	111	P327 Y331 K333	P327-V329 HydrophobicContact CG-CG1 4.12Å; P327-V329 PolarHBondContact O-N 3.19Å; V329-Y331 HydrophobicContact CB-CD1 4.18Å; V329-Y331 HydrophobicContact CB-CD2 4.42Å; V329-Y331 HydrophobicContact CB-CE1 3.83Å; V329-Y331 HydrophobicContact CB-CE2 4.07Å; V329-Y331 HydrophobicContact CB-CG 4.48Å; V329-Y331 HydrophobicContact CG1-CE1 4.06Å; V329-Y331 HydrophobicContact CG1-CE2 4.41Å; V329-Y331 HydrophobicContact CG2-CD2 4.16Å; V329-Y331 HydrophobicContact CG2-CE2 3.88Å; V329-K333 HydrophobicContact CG2-CD 3.88Å; V329-K333 HydrophobicContact CG2-CG 4.05Å
330	S	94	Very high	94	Very high	129 Å²	129	50.7 Å²	50.7	90%	0.902	32%	0.319	S	S	*	.	S	Bend	trans	-83.4	-9.2	-178.3	54.7	0	0	0	0	114.4
331	Y	94.4	Very high	94	Very high	86 Å²	86	49.7 Å²	49.7	34%	0.337	31%	0.308	S	S	.	.	S	Bend	trans	-103.6	159.6	179.4	53.9	-100.3	0	0	0	112	L193 E194 V329 K333	L193-Y331 HydrophobicContact CB-CE2 4.36Å; L193-Y331 PolarHBondContact N-OH 3.05Å; L193-Y331 VanDerWaalsContact N-OH 3.08Å; E194-Y331 HydrophobicContact CB-CE2 4.46Å; V329-Y331 HydrophobicContact CB-CD1 4.18Å; V329-Y331 HydrophobicContact CB-CD2 4.42Å; V329-Y331 HydrophobicContact CB-CE1 3.83Å; V329-Y331 HydrophobicContact CB-CE2 4.07Å; V329-Y331 HydrophobicContact CB-CG 4.48Å; V329-Y331 HydrophobicContact CG1-CE1 4.06Å; V329-Y331 HydrophobicContact CG1-CE2 4.41Å; V329-Y331 HydrophobicContact CG2-CD2 4.16Å; V329-Y331 HydrophobicContact CG2-CE2 3.88Å; Y331-K333 HydrophobicContact CD2-CG 4.45Å; Y331-K333 HydrophobicContact CE2-CG 4.27Å
332	T	93.9	Very high	94.2	Very high	107 Å²	107	47.9 Å²	47.9	66%	0.656	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-80.1	127.4	178.2	51.8	0	0	0	0	111.3
333	K	94.8	Very high	94.3	Very high	11 Å²	11	49 Å²	49	5%	0.048	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-90.7	156.6	176.4	-55.7	177.6	-63.6	-57.3	0	110.9	L193 E194 L326 V329 Y331 I335 D336 V337	L193-K333 HydrophobicContact CB-CD 4.28Å; L193-K333 WeakPolarHBondContact O-CG 3.03Å; E194-K333 CarbonylContact O-C 3.47Å; E194-K333 WeakPolarHBondContact O-CA 3.25Å; L326-K333 HydrophobicContact CD1-CD 4.14Å; V329-K333 HydrophobicContact CG2-CD 3.88Å; V329-K333 HydrophobicContact CG2-CG 4.05Å; Y331-K333 HydrophobicContact CD2-CG 4.45Å; Y331-K333 HydrophobicContact CE2-CG 4.27Å; K333-I335 HydrophobicContact CB-CG2 4.04Å; K333-I335 PolarHBondContact O-N 2.8Å; K333-I335 VanDerWaalsContact O-N 3.16Å; K333-D336 WeakPolarHBondContact CB-OD2 3.22Å; K333-D336 WeakPolarHBondContact CE-OD1 3.16Å; K333-D336 WeakPolarHBondContact CE-OD2 3.18Å; K333-D336 PolarHBondContact N-OD2 2.77Å; K333-D336 IonicContact NZ-OD1 3.44Å; K333-D336 PolarHBondContact NZ-OD1 2.95Å; K333-D336 IonicContact NZ-OD2 3.3Å; K333-D336 PolarHBondContact NZ-OD2 3.36Å; K333-D336 WeakPolarHBondContact O-CB 3.5Å; K333-D336 PolarHBondContact O-N 2.86Å; K333-V337 PolarHBondContact O-N 3.29Å; K333-V337 VanDerWaalsContact O-N 3.16Å
334	A	95	Very high	94.5	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-53.8	-36.4	173.9	0	0	0	0	0	112.3	E194 W338 Y519 Y523	E194-A334 PolarHBondContact O-N 2.77Å; A334-W338 PolarHBondContact O-N 2.87Å; A334-Y519 VanDerWaalsContact O-CE2 3.31Å; A334-Y519 WeakPolarHBondContact O-CE2 3.42Å; A334-Y519 PolarHBondContact O-OH 3.42Å; A334-Y523 HydrophobicContact CB-CD1 3.4Å; A334-Y523 HydrophobicContact CB-CD2 4.4Å; A334-Y523 HydrophobicContact CB-CE1 3.45Å; A334-Y523 VanDerWaalsContact CB-CE1 3.45Å; A334-Y523 HydrophobicContact CB-CE2 4.44Å; A334-Y523 HydrophobicContact CB-CG 3.91Å
335	I	94.2	Very high	94.6	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-69.5	-33.3	175.5	-158.9	56.7	0	0	0	113.7	Y196 L279 Y280 V322 K333 V337 W338 I339	Y196-I335 HydrophobicContact CD1-CB 4.25Å; Y196-I335 HydrophobicContact CD1-CG2 3.87Å; Y196-I335 WeakPolarHBondContact O-CB 3.44Å; Y196-I335 PolarHBondContact O-N 2.6Å; L279-I335 HydrophobicContact CD1-CD1 3.62Å; L279-I335 HydrophobicContact CD1-CG1 3.81Å; L279-I335 HydrophobicContact CD2-CD1 3.43Å; L279-I335 VanDerWaalsContact CD2-CD1 3.43Å; L279-I335 HydrophobicContact CD2-CG1 4.31Å; L279-I335 HydrophobicContact CG-CD1 4.18Å; Y280-I335 HydrophobicContact CE1-CD1 4.32Å; Y280-I335 HydrophobicContact CE2-CD1 4.2Å; V322-I335 HydrophobicContact CG1-CG1 4.17Å; V322-I335 HydrophobicContact CG1-CG2 4.41Å; K333-I335 HydrophobicContact CB-CG2 4.04Å; K333-I335 PolarHBondContact O-N 2.8Å; K333-I335 VanDerWaalsContact O-N 3.16Å; I335-V337 VanDerWaalsContact C-N 3.33Å; I335-W338 HydrophobicContact CD1-CB 4.5Å; I335-W338 PolarHBondContact O-N 3.32Å; I335-I339 HydrophobicContact CG1-CD1 3.93Å; I335-I339 HydrophobicContact CG1-CG1 4.46Å; I335-I339 WeakPolarHBondContact O-CB 3.42Å; I335-I339 VanDerWaalsContact O-CG1 3.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.42Å; I335-I339 PolarHBondContact O-N 2.81Å
336	D	94.9	Very high	94.9	Very high	42 Å²	42	40.5 Å²	40.5	23%	0.225	25%	0.249	C	C	.	.	H	α-helix	trans	-67.7	-38.6	177.7	-58.6	-30.9	0	0	0	110.1	K333 G340	K333-D336 WeakPolarHBondContact CB-OD2 3.22Å; K333-D336 WeakPolarHBondContact CE-OD1 3.16Å; K333-D336 WeakPolarHBondContact CE-OD2 3.18Å; K333-D336 PolarHBondContact N-OD2 2.77Å; K333-D336 IonicContact NZ-OD1 3.44Å; K333-D336 PolarHBondContact NZ-OD1 2.95Å; K333-D336 IonicContact NZ-OD2 3.3Å; K333-D336 PolarHBondContact NZ-OD2 3.36Å; K333-D336 WeakPolarHBondContact O-CB 3.5Å; K333-D336 PolarHBondContact O-N 2.86Å; D336-G340 WeakPolarHBondContact O-CA 3.37Å; D336-G340 PolarHBondContact O-N 3.49Å
337	V	95.3	Very high	95	Very high	42 Å²	42	45 Å²	45	26%	0.255	27%	0.268	S	S	.	.	H	α-helix	trans	-63.1	-45.9	174.9	176.7	0	0	0	0	110.7	K333 I335 I341	K333-V337 PolarHBondContact O-N 3.29Å; K333-V337 VanDerWaalsContact O-N 3.16Å; I335-V337 VanDerWaalsContact C-N 3.33Å; V337-I341 HydrophobicContact CG1-CD1 3.78Å; V337-I341 WeakPolarHBondContact O-CB 3.35Å; V337-I341 WeakPolarHBondContact O-CG1 2.88Å; V337-I341 PolarHBondContact O-N 3.43Å
338	W	96.1	Very high	95	Very high	3 Å²	3	45.4 Å²	45.4	1%	0.011	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-52	176.6	177.2	-93.2	0	0	0	112.3	Y280 S283 A334 I335 I341 C342 F515 N516 Y519 W520	Y280-W338 AromaticContact CD1-CD2 3.59Å; Y280-W338 HydrophobicContact CD1-CD2 3.59Å; Y280-W338 AromaticContact CD1-CE2 3.43Å; Y280-W338 VanDerWaalsContact CD1-CE2 3.43Å; Y280-W338 HydrophobicContact CD1-CE3 4.02Å; Y280-W338 HydrophobicContact CD1-CG 4.01Å; Y280-W338 HydrophobicContact CD1-CH2 4.14Å; Y280-W338 AromaticContact CD1-CZ2 3.74Å; Y280-W338 HydrophobicContact CD1-CZ2 3.74Å; Y280-W338 HydrophobicContact CD1-CZ3 4.27Å; Y280-W338 AromaticContact CD1-NE1 3.72Å; Y280-W338 HydrophobicContact CE1-CB 4.24Å; Y280-W338 AromaticContact CE1-CD2 3.58Å; Y280-W338 HydrophobicContact CE1-CD2 3.58Å; Y280-W338 AromaticContact CE1-CE2 3.95Å; Y280-W338 AromaticContact CE1-CE3 3.91Å; Y280-W338 HydrophobicContact CE1-CE3 3.91Å; Y280-W338 AromaticContact CE1-CG 3.71Å; Y280-W338 HydrophobicContact CE1-CG 3.71Å; S283-W338 PolarHBondContact OG-NE1 2.82Å; A334-W338 PolarHBondContact O-N 2.87Å; I335-W338 HydrophobicContact CD1-CB 4.5Å; I335-W338 PolarHBondContact O-N 3.32Å; W338-I341 PolarHBondContact O-N 2.86Å; W338-C342 WeakPolarHBondContact O-CB 3.42Å; W338-C342 PolarHBondContact O-N 2.79Å; W338-C342 PolarHBondContact O-SG 2.89Å; W338-F515 HydrophobicContact CD2-CE1 4.35Å; W338-F515 HydrophobicContact CD2-CZ 4.43Å; W338-F515 AromaticContact CE3-CE1 3.63Å; W338-F515 HydrophobicContact CE3-CE1 3.63Å; W338-F515 AromaticContact CE3-CZ 3.69Å; W338-F515 HydrophobicContact CE3-CZ 3.69Å; W338-F515 AromaticContact CZ3-CE1 3.75Å; W338-F515 HydrophobicContact CZ3-CE1 3.75Å; W338-F515 HydrophobicContact CZ3-CZ 4.2Å; W338-N516 WeakPolarHBondContact CH2-OD1 3.22Å; W338-N516 WeakPolarHBondContact CZ3-OD1 3.32Å; W338-Y519 HydrophobicContact CB-CE2 3.76Å; W338-Y519 HydrophobicContact CD2-CE1 4.4Å; W338-Y519 AromaticContact CE3-CD1 3.56Å; W338-Y519 HydrophobicContact CE3-CD1 3.56Å; W338-Y519 HydrophobicContact CE3-CD2 4.12Å; W338-Y519 AromaticContact CE3-CE1 3.64Å; W338-Y519 HydrophobicContact CE3-CE1 3.64Å; W338-Y519 HydrophobicContact CE3-CE2 4.19Å; W338-Y519 AromaticContact CE3-CG 3.82Å; W338-Y519 HydrophobicContact CE3-CG 3.82Å; W338-Y519 AromaticContact CE3-CZ 3.96Å; W338-Y519 AromaticContact CZ3-CD1 3.87Å; W338-Y519 HydrophobicContact CZ3-CD1 3.87Å; W338-Y519 HydrophobicContact CZ3-CE1 4.26Å; W338-Y519 HydrophobicContact CZ3-CG 4.24Å; W338-W520 AromaticContact CZ3-NE1 3.91Å
339	I	95.7	Very high	95	Very high	9 Å²	9	39 Å²	39	5%	0.046	23%	0.232	C	C	.	.	H	α-helix	trans	-64.2	-44.8	-178.7	-71.7	172.2	0	0	0	110.7	M315 A319 V322 I335 I341 C342 L343	M315-I339 HydrophobicContact CE-CB 3.98Å; M315-I339 HydrophobicContact CE-CG1 3.95Å; M315-I339 HydrophobicContact CE-CG2 3.84Å; A319-I339 HydrophobicContact CB-CD1 4.44Å; A319-I339 HydrophobicContact CB-CG2 3.51Å; V322-I339 HydrophobicContact CB-CD1 4.47Å; V322-I339 HydrophobicContact CG2-CD1 4.43Å; I335-I339 HydrophobicContact CG1-CD1 3.93Å; I335-I339 HydrophobicContact CG1-CG1 4.46Å; I335-I339 WeakPolarHBondContact O-CB 3.42Å; I335-I339 VanDerWaalsContact O-CG1 3.31Å; I335-I339 WeakPolarHBondContact O-CG1 3.42Å; I335-I339 PolarHBondContact O-N 2.81Å; I339-I341 VanDerWaalsContact C-N 3.34Å; I339-I341 PolarHBondContact O-N 2.84Å; I339-C342 PolarHBondContact O-N 3.34Å; I339-L343 HydrophobicContact CG2-CD1 3.85Å; I339-L343 HydrophobicContact CG2-CG 4.43Å; I339-L343 WeakPolarHBondContact O-CB 3.22Å; I339-L343 WeakPolarHBondContact O-CG 3.48Å; I339-L343 PolarHBondContact O-N 2.64Å
340	G	95.6	Very high	95	Very high	37 Å²	37	38.7 Å²	38.7	38%	0.381	23%	0.23	S	C	.	.	H	α-helix	trans	-60.6	-41.9	179	0	0	0	0	0	112.5	D336 L343 A344	D336-G340 WeakPolarHBondContact O-CA 3.37Å; D336-G340 PolarHBondContact O-N 3.49Å; G340-L343 PolarHBondContact O-N 2.96Å; G340-A344 WeakPolarHBondContact O-CB 3.25Å; G340-A344 PolarHBondContact O-N 2.84Å
341	I	95.9	Very high	95	Very high	52 Å²	52	36.8 Å²	36.8	27%	0.267	21%	0.209	S	C	.	.	H	α-helix	trans	-71.9	-42.8	177.9	-69.5	169	0	0	0	111.1	V337 W338 I339 L343 A344 F345 F515	V337-I341 HydrophobicContact CG1-CD1 3.78Å; V337-I341 WeakPolarHBondContact O-CB 3.35Å; V337-I341 WeakPolarHBondContact O-CG1 2.88Å; V337-I341 PolarHBondContact O-N 3.43Å; W338-I341 PolarHBondContact O-N 2.86Å; I339-I341 VanDerWaalsContact C-N 3.34Å; I339-I341 PolarHBondContact O-N 2.84Å; I341-L343 VanDerWaalsContact C-N 3.31Å; I341-L343 PolarHBondContact O-N 2.85Å; I341-A344 WeakPolarHBondContact O-CB 3.29Å; I341-A344 PolarHBondContact O-N 2.94Å; I341-A344 VanDerWaalsContact O-N 3.11Å; I341-F345 HydrophobicContact CG2-CD2 3.75Å; I341-F345 HydrophobicContact CG2-CE2 3.59Å; I341-F345 VanDerWaalsContact O-CD2 3.27Å; I341-F345 WeakPolarHBondContact O-CD2 3.48Å; I341-F345 PolarHBondContact O-N 2.72Å; I341-F515 HydrophobicContact CB-CD2 4.38Å; I341-F515 HydrophobicContact CB-CE1 4.21Å; I341-F515 HydrophobicContact CB-CE2 4.01Å; I341-F515 HydrophobicContact CB-CZ 3.9Å; I341-F515 HydrophobicContact CD1-CD2 3.54Å; I341-F515 HydrophobicContact CD1-CE2 3.16Å; I341-F515 HydrophobicContact CD1-CZ 3.89Å; I341-F515 HydrophobicContact CG1-CD2 4.49Å; I341-F515 HydrophobicContact CG1-CE2 4.14Å; I341-F515 HydrophobicContact CG1-CZ 4.48Å; I341-F515 HydrophobicContact CG2-CD1 3.69Å; I341-F515 HydrophobicContact CG2-CD2 3.77Å; I341-F515 HydrophobicContact CG2-CE1 3.77Å; I341-F515 HydrophobicContact CG2-CE2 3.88Å; I341-F515 HydrophobicContact CG2-CG 3.68Å; I341-F515 HydrophobicContact CG2-CZ 3.86Å
342	C	96.6	Very high	95	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-43.8	173.5	-69.3	0	0	0	0	111.8	V287 M315 W338 I339 A344 F345 I346	V287-C342 HydrophobicContact CG2-CB 3.77Å; M315-C342 HydrophobicContact CE-CB 3.46Å; M315-C342 VanDerWaalsContact CE-CB 3.46Å; M315-C342 HydrophobicContact SD-CB 4.08Å; W338-C342 WeakPolarHBondContact O-CB 3.42Å; W338-C342 PolarHBondContact O-N 2.79Å; W338-C342 PolarHBondContact O-SG 2.89Å; I339-C342 PolarHBondContact O-N 3.34Å; C342-A344 VanDerWaalsContact C-N 3.35Å; C342-A344 PolarHBondContact O-N 3.25Å; C342-F345 PolarHBondContact O-N 2.79Å; C342-I346 WeakPolarHBondContact O-CG1 3.35Å; C342-I346 PolarHBondContact O-N 3.48Å
343	L	95.7	Very high	94.9	Very high	40 Å²	40	28.9 Å²	28.9	21%	0.209	17%	0.167	C	C	.	.	H	α-helix	trans	-60.2	-42.4	173.4	-78.7	168.7	0	0	0	111.9	L312 M315 I339 G340 I341 F345 I346 F347	L312-L343 HydrophobicContact CD1-CD2 3.91Å; M315-L343 HydrophobicContact CB-CD2 3.64Å; M315-L343 HydrophobicContact CB-CG 4.43Å; M315-L343 HydrophobicContact CG-CD2 3.34Å; M315-L343 HydrophobicContact CG-CG 3.58Å; I339-L343 HydrophobicContact CG2-CD1 3.85Å; I339-L343 HydrophobicContact CG2-CG 4.43Å; I339-L343 WeakPolarHBondContact O-CB 3.22Å; I339-L343 WeakPolarHBondContact O-CG 3.48Å; I339-L343 PolarHBondContact O-N 2.64Å; G340-L343 PolarHBondContact O-N 2.96Å; I341-L343 VanDerWaalsContact C-N 3.31Å; I341-L343 PolarHBondContact O-N 2.85Å; L343-F345 PolarHBondContact O-N 2.8Å; L343-I346 PolarHBondContact O-N 2.87Å; L343-F347 VanDerWaalsContact O-CB 3.26Å; L343-F347 WeakPolarHBondContact O-CB 3.28Å; L343-F347 PolarHBondContact O-N 3.35Å
344	A	95.9	Very high	94.7	Very high	60 Å²	60	30.8 Å²	30.8	50%	0.496	19%	0.185	S	C	.	.	H	α-helix	trans	-62.8	-39.4	177.6	0	0	0	0	0	112.4	G340 I341 C342 G348	G340-A344 WeakPolarHBondContact O-CB 3.25Å; G340-A344 PolarHBondContact O-N 2.84Å; I341-A344 WeakPolarHBondContact O-CB 3.29Å; I341-A344 PolarHBondContact O-N 2.94Å; I341-A344 VanDerWaalsContact O-N 3.11Å; C342-A344 VanDerWaalsContact C-N 3.35Å; C342-A344 PolarHBondContact O-N 3.25Å; A344-G348 PolarHBondContact O-N 2.92Å
345	F	95.9	Very high	94.6	Very high	40 Å²	40	35.8 Å²	35.8	18%	0.175	21%	0.211	C	C	.	.	H	α-helix	trans	-65.7	-44.2	174.3	-84.3	-79.9	0	0	0	112.2	V287 I341 C342 L343 G348 A349 F508 F512	V287-F345 HydrophobicContact CG1-CB 4.08Å; I341-F345 HydrophobicContact CG2-CD2 3.75Å; I341-F345 HydrophobicContact CG2-CE2 3.59Å; I341-F345 VanDerWaalsContact O-CD2 3.27Å; I341-F345 WeakPolarHBondContact O-CD2 3.48Å; I341-F345 PolarHBondContact O-N 2.72Å; C342-F345 PolarHBondContact O-N 2.79Å; L343-F345 PolarHBondContact O-N 2.8Å; F345-G348 PolarHBondContact O-N 2.82Å; F345-A349 PolarHBondContact O-N 2.84Å; F345-F508 AromaticContact CD1-CD1 3.83Å; F345-F508 HydrophobicContact CD1-CD1 3.83Å; F345-F508 HydrophobicContact CD1-CE1 4.43Å; F345-F508 WeakPolarHBondContact O-CE1 3.36Å; F345-F512 HydrophobicContact CD1-CB 4.4Å; F345-F512 AromaticContact CD2-CD2 3.73Å; F345-F512 HydrophobicContact CD2-CD2 3.73Å; F345-F512 HydrophobicContact CD2-CE2 4.44Å; F345-F512 HydrophobicContact CE1-CB 4.01Å; F345-F512 HydrophobicContact CE2-CB 4.29Å; F345-F512 AromaticContact CE2-CD2 3.79Å; F345-F512 HydrophobicContact CE2-CD2 3.79Å; F345-F512 HydrophobicContact CG-CD2 4.24Å; F345-F512 HydrophobicContact CZ-CB 3.97Å; F345-F512 HydrophobicContact CZ-CD2 4.33Å
346	I	95.8	Very high	94.5	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-64.2	-44.6	177.6	-66.2	168.4	0	0	0	110.6	L286 V287 L312 M315 C342 L343 G348 A349 L350	L286-I346 HydrophobicContact CB-CD1 4.3Å; V287-I346 HydrophobicContact CG2-CD1 4.34Å; V287-I346 HydrophobicContact CG2-CG1 4.26Å; L312-I346 HydrophobicContact CB-CG2 3.97Å; L312-I346 HydrophobicContact CD1-CG2 4.27Å; M315-I346 HydrophobicContact CB-CD1 3.75Å; M315-I346 HydrophobicContact CG-CD1 3.92Å; M315-I346 HydrophobicContact SD-CD1 4.4Å; C342-I346 WeakPolarHBondContact O-CG1 3.35Å; C342-I346 PolarHBondContact O-N 3.48Å; L343-I346 PolarHBondContact O-N 2.87Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 3.25Å; I346-A349 WeakPolarHBondContact O-CB 3.22Å; I346-A349 PolarHBondContact O-N 3.34Å; I346-L350 PolarHBondContact O-N 2.8Å; I346-L350 VanDerWaalsContact O-N 3.14Å
347	F	95.2	Very high	94.2	Very high	107 Å²	107	35.4 Å²	35.4	47%	0.469	21%	0.209	S	C	.	.	H	α-helix	trans	-63.5	-39.1	175	-176.6	-107.4	0	0	0	111.9	L343 A349 L350 L351	L343-F347 VanDerWaalsContact O-CB 3.26Å; L343-F347 WeakPolarHBondContact O-CB 3.28Å; L343-F347 PolarHBondContact O-N 3.35Å; F347-A349 VanDerWaalsContact C-N 3.31Å; F347-A349 PolarHBondContact O-N 2.76Å; F347-L350 WeakPolarHBondContact O-CB 3.18Å; F347-L350 PolarHBondContact O-N 2.94Å; F347-L350 VanDerWaalsContact O-N 3.16Å; F347-L351 HydrophobicContact CD1-CD1 3.93Å; F347-L351 HydrophobicContact CD1-CG 4.24Å; F347-L351 HydrophobicContact CE1-CD1 3.51Å; F347-L351 HydrophobicContact CE1-CD2 4.3Å; F347-L351 HydrophobicContact CE1-CG 3.88Å; F347-L351 HydrophobicContact CZ-CD1 4.18Å; F347-L351 HydrophobicContact CZ-CD2 4.13Å; F347-L351 HydrophobicContact CZ-CG 4.12Å; F347-L351 PolarHBondContact O-N 2.94Å
348	G	94.4	Very high	94.1	Very high	18 Å²	18	41.3 Å²	41.3	19%	0.186	23%	0.228	C	C	.	.	H	α-helix	trans	-59	-40.3	172.8	0	0	0	0	0	112.6	A344 F345 I346 L350 L351 E352 F508	A344-G348 PolarHBondContact O-N 2.92Å; F345-G348 PolarHBondContact O-N 2.82Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 3.25Å; G348-L350 VanDerWaalsContact C-N 3.34Å; G348-L351 PolarHBondContact O-N 3.47Å; G348-E352 WeakPolarHBondContact O-CB 3.41Å; G348-E352 PolarHBondContact O-N 2.95Å; G348-F508 VanDerWaalsContact C-CZ 3.49Å
349	A	93.6	Very high	93.8	Very high	1 Å²	1	42 Å²	42	1%	0.008	24%	0.235	C	C	.	.	H	α-helix	trans	-67	-33.7	175.6	0	0	0	0	0	112.5	F294 F345 I346 F347 E352 F353 F508	F294-A349 HydrophobicContact CE1-CB 4.04Å; F294-A349 HydrophobicContact CZ-CB 3.88Å; F345-A349 PolarHBondContact O-N 2.84Å; I346-A349 WeakPolarHBondContact O-CB 3.22Å; I346-A349 PolarHBondContact O-N 3.34Å; F347-A349 VanDerWaalsContact C-N 3.31Å; F347-A349 PolarHBondContact O-N 2.76Å; A349-E352 WeakPolarHBondContact O-CB 3.27Å; A349-F353 PolarHBondContact O-N 3.08Å; A349-F353 VanDerWaalsContact O-N 3.1Å; A349-F508 HydrophobicContact CB-CE1 4.34Å
350	L	92.8	Very high	93.5	Very high	28 Å²	28	42.1 Å²	42.1	15%	0.147	24%	0.238	C	C	.	.	H	α-helix	trans	-67.5	-43	171.9	-86.9	172.6	0	0	0	112.7	G308 L312 I346 F347 G348 E352 F353 A354	G308-L350 VanDerWaalsContact CA-CD2 3.49Å; G308-L350 WeakPolarHBondContact O-CD1 3.48Å; L312-L350 HydrophobicContact CB-CD1 4.07Å; L312-L350 HydrophobicContact CD2-CD1 3.76Å; L312-L350 HydrophobicContact CG-CD1 4.48Å; I346-L350 PolarHBondContact O-N 2.8Å; I346-L350 VanDerWaalsContact O-N 3.14Å; F347-L350 WeakPolarHBondContact O-CB 3.18Å; F347-L350 PolarHBondContact O-N 2.94Å; F347-L350 VanDerWaalsContact O-N 3.16Å; G348-L350 VanDerWaalsContact C-N 3.34Å; L350-E352 VanDerWaalsContact C-N 3.31Å; L350-F353 PolarHBondContact O-N 2.72Å; L350-A354 PolarHBondContact O-N 2.77Å
351	L	93.7	Very high	93.2	Very high	89 Å²	89	47.9 Å²	47.9	47%	0.466	25%	0.249	S	C	.	.	H	α-helix	trans	-63	-40.2	174.9	-73.7	-179.7	0	0	0	111.6	F347 G348 A354 L355	F347-L351 HydrophobicContact CD1-CD1 3.93Å; F347-L351 HydrophobicContact CD1-CG 4.24Å; F347-L351 HydrophobicContact CE1-CD1 3.51Å; F347-L351 HydrophobicContact CE1-CD2 4.3Å; F347-L351 HydrophobicContact CE1-CG 3.88Å; F347-L351 HydrophobicContact CZ-CD1 4.18Å; F347-L351 HydrophobicContact CZ-CD2 4.13Å; F347-L351 HydrophobicContact CZ-CG 4.12Å; F347-L351 PolarHBondContact O-N 2.94Å; G348-L351 PolarHBondContact O-N 3.47Å; L351-A354 WeakPolarHBondContact O-CB 3.43Å; L351-A354 PolarHBondContact O-N 2.93Å; L351-L355 WeakPolarHBondContact O-CG 3.45Å; L351-L355 PolarHBondContact O-N 2.9Å
352	E	93.7	Very high	93	Very high	8 Å²	8	47.6 Å²	47.6	4%	0.037	25%	0.249	C	C	.	.	H	α-helix	trans	-56.6	-49.8	174	-168.3	-78.5	167.6	0	0	111	F294 G348 A349 L350 A354 L355 V356 I500 D501 S504	F294-E352 HydrophobicContact CD1-CG 4.23Å; F294-E352 HydrophobicContact CE1-CB 4.08Å; F294-E352 HydrophobicContact CE1-CG 3.79Å; G348-E352 WeakPolarHBondContact O-CB 3.41Å; G348-E352 PolarHBondContact O-N 2.95Å; A349-E352 WeakPolarHBondContact O-CB 3.27Å; L350-E352 VanDerWaalsContact C-N 3.31Å; E352-A354 VanDerWaalsContact C-N 3.31Å; E352-A354 PolarHBondContact O-N 3.5Å; E352-L355 WeakPolarHBondContact O-CB 3.32Å; E352-L355 PolarHBondContact O-N 2.03Å; E352-L355 VanDerWaalsContact O-N 3.12Å; E352-V356 WeakPolarHBondContact O-CG2 3.36Å; E352-V356 PolarHBondContact O-N 2.88Å; E352-V356 VanDerWaalsContact OE1-CG2 3.28Å; E352-V356 WeakPolarHBondContact OE1-CG2 3.46Å; E352-I500 HydrophobicContact CG-CG2 4.12Å; E352-I500 WeakPolarHBondContact OE1-CG2 3.3Å; E352-D501 VanDerWaalsContact OE1-CA 3.3Å; E352-D501 WeakPolarHBondContact OE1-CA 3.4Å; E352-D501 PolarHBondContact OE1-N 2.86Å; E352-S504 WeakPolarHBondContact CG-OG 3.44Å; E352-S504 PolarHBondContact OE1-OG 3.44Å; E352-S504 VanDerWaalsContact OE1-OG 3.05Å
353	F	91.2	Very high	92.6	Very high	18 Å²	18	48.6 Å²	48.6	8%	0.079	25%	0.254	C	S	.	.	H	α-helix	trans	-58.1	-43.2	175.2	157.9	-103.2	0	0	0	112.1	V301 R304 V305 A349 L350 L355 V356 N357	V301-F353 HydrophobicContact CG1-CE2 4.39Å; V301-F353 HydrophobicContact CG1-CZ 3.99Å; R304-F353 HydrophobicContact CB-CD2 3.58Å; R304-F353 HydrophobicContact CB-CE2 3.68Å; R304-F353 HydrophobicContact CB-CG 4.28Å; R304-F353 HydrophobicContact CB-CZ 4.48Å; R304-F353 HydrophobicContact CG-CD2 4.23Å; R304-F353 HydrophobicContact CG-CE2 4.47Å; V305-F353 HydrophobicContact CG2-CD1 4.47Å; V305-F353 HydrophobicContact CG2-CE1 3.39Å; V305-F353 HydrophobicContact CG2-CE2 4.35Å; V305-F353 HydrophobicContact CG2-CZ 3.31Å; A349-F353 PolarHBondContact O-N 3.08Å; A349-F353 VanDerWaalsContact O-N 3.1Å; L350-F353 PolarHBondContact O-N 2.72Å; F353-L355 VanDerWaalsContact C-N 3.31Å; F353-L355 PolarHBondContact O-N 3.3Å; F353-V356 PolarHBondContact O-N 3.47Å; F353-N357 HydrophobicContact CE2-CB 4.18Å; F353-N357 HydrophobicContact CZ-CB 4.35Å; F353-N357 VanDerWaalsContact O-CB 3.31Å; F353-N357 WeakPolarHBondContact O-CB 3.4Å; F353-N357 PolarHBondContact O-N 2.75Å
354	A	92.2	Very high	92.2	Very high	51 Å²	51	52.7 Å²	52.7	42%	0.421	27%	0.27	S	S	.	.	H	α-helix	trans	-60.9	-41.3	177.4	0	0	0	0	0	111.7	L350 L351 E352 Y358	L350-A354 PolarHBondContact O-N 2.77Å; L351-A354 WeakPolarHBondContact O-CB 3.43Å; L351-A354 PolarHBondContact O-N 2.93Å; E352-A354 VanDerWaalsContact C-N 3.31Å; E352-A354 PolarHBondContact O-N 3.5Å; A354-Y358 WeakPolarHBondContact O-CB 3.2Å; A354-Y358 PolarHBondContact O-N 2.83Å
355	L	92.3	Very high	91.9	Very high	105 Å²	105	55.4 Å²	55.4	55%	0.55	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-42.4	175.7	-68.3	173.1	0	0	0	112.2	L351 E352 F353 Y358 A359	L351-L355 WeakPolarHBondContact O-CG 3.45Å; L351-L355 PolarHBondContact O-N 2.9Å; E352-L355 WeakPolarHBondContact O-CB 3.32Å; E352-L355 PolarHBondContact O-N 2.03Å; E352-L355 VanDerWaalsContact O-N 3.12Å; F353-L355 VanDerWaalsContact C-N 3.31Å; F353-L355 PolarHBondContact O-N 3.3Å; L355-Y358 PolarHBondContact O-N 2.94Å; L355-A359 VanDerWaalsContact O-CB 3.28Å; L355-A359 WeakPolarHBondContact O-CB 3.32Å; L355-A359 PolarHBondContact O-N 3.04Å
356	V	91.1	Very high	91.7	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	29%	0.287	C	S	.	.	H	α-helix	trans	-64.2	-44.1	177	172.3	0	0	0	0	111	K298 E352 F353 A359 G360 I500	K298-V356 HydrophobicContact CB-CG1 4.01Å; E352-V356 WeakPolarHBondContact O-CG2 3.36Å; E352-V356 PolarHBondContact O-N 2.88Å; E352-V356 VanDerWaalsContact OE1-CG2 3.28Å; E352-V356 WeakPolarHBondContact OE1-CG2 3.46Å; F353-V356 PolarHBondContact O-N 3.47Å; V356-A359 PolarHBondContact O-N 2.88Å; V356-G360 PolarHBondContact O-N 2.77Å; V356-I500 HydrophobicContact CG2-CB 3.9Å; V356-I500 HydrophobicContact CG2-CG2 3.76Å
357	N	90.3	Very high	91.3	Very high	33 Å²	33	62.1 Å²	62.1	18%	0.176	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-44	177.4	-172.6	6	0	0	0	111.1	F353 G360 R361	F353-N357 HydrophobicContact CE2-CB 4.18Å; F353-N357 HydrophobicContact CZ-CB 4.35Å; F353-N357 VanDerWaalsContact O-CB 3.31Å; F353-N357 WeakPolarHBondContact O-CB 3.4Å; F353-N357 PolarHBondContact O-N 2.75Å; N357-G360 PolarHBondContact O-N 2.88Å; N357-R361 WeakPolarHBondContact O-CG 3.47Å; N357-R361 PolarHBondContact O-N 3.1Å; N357-R361 PolarHBondContact OD1-NE 2.81Å
358	Y	91.4	Very high	91	Very high	165 Å²	165	60 Å²	60	65%	0.647	30%	0.298	S	S	*	.	H	α-helix	trans	-60.6	-49.7	174.2	179.3	-100.2	0	0	0	111.9	A354 L355 G360 R361 V362	A354-Y358 WeakPolarHBondContact O-CB 3.2Å; A354-Y358 PolarHBondContact O-N 2.83Å; L355-Y358 PolarHBondContact O-N 2.94Å; Y358-G360 VanDerWaalsContact C-N 3.32Å; Y358-G360 PolarHBondContact O-N 2.83Å; Y358-R361 PolarHBondContact O-N 2.93Å; Y358-V362 HydrophobicContact CD1-CG2 4.38Å; Y358-V362 HydrophobicContact CE1-CG2 3.96Å; Y358-V362 HydrophobicContact CE2-CG2 4.3Å; Y358-V362 WeakPolarHBondContact O-CG2 3.15Å; Y358-V362 PolarHBondContact O-N 2.77Å
359	A	90.8	Very high	90.8	Very high	18 Å²	18	67 Å²	67	15%	0.149	32%	0.319	C	S	.	.	H	α-helix	trans	-61	-40.6	177.3	0	0	0	0	0	112	L355 V356 V362 E363 I500	L355-A359 VanDerWaalsContact O-CB 3.28Å; L355-A359 WeakPolarHBondContact O-CB 3.32Å; L355-A359 PolarHBondContact O-N 3.04Å; V356-A359 PolarHBondContact O-N 2.88Å; A359-V362 PolarHBondContact O-N 3.07Å; A359-E363 WeakPolarHBondContact O-CB 3.46Å; A359-E363 VanDerWaalsContact O-CG 3.26Å; A359-E363 WeakPolarHBondContact O-CG 3.4Å; A359-E363 PolarHBondContact O-N 2.84Å; A359-I500 HydrophobicContact CB-CD1 4.23Å
360	G	89	Confident	90.6	Very high	12 Å²	12	73.4 Å²	73.4	12%	0.124	35%	0.346	C	S	.	.	H	α-helix	trans	-63.2	-41.4	176.2	0	0	0	0	0	112.8	V356 N357 Y358 E363 F364	V356-G360 PolarHBondContact O-N 2.77Å; N357-G360 PolarHBondContact O-N 2.88Å; Y358-G360 VanDerWaalsContact C-N 3.32Å; Y358-G360 PolarHBondContact O-N 2.83Å; G360-E363 PolarHBondContact O-N 2.89Å; G360-F364 WeakPolarHBondContact O-CB 3.25Å; G360-F364 PolarHBondContact O-N 2.93Å
361	R	89.6	Confident	90.3	Very high	158 Å²	158	78 Å²	78	60%	0.596	37%	0.365	S	S	*	.	H	α-helix	trans	-64.1	-45.6	174	-73.9	177.4	-176.6	-150.1	-3.3	111.9	N357 Y358 E363 F364 L365	N357-R361 WeakPolarHBondContact O-CG 3.47Å; N357-R361 PolarHBondContact O-N 3.1Å; N357-R361 PolarHBondContact OD1-NE 2.81Å; Y358-R361 PolarHBondContact O-N 2.93Å; R361-E363 PolarHBondContact O-N 3.36Å; R361-F364 WeakPolarHBondContact O-CB 3.2Å; R361-F364 PolarHBondContact O-N 3.45Å; R361-L365 WeakPolarHBondContact O-CG 3.33Å; R361-L365 PolarHBondContact O-N 3.38Å
362	V	91	Very high	90	Very high	46 Å²	46	79.5 Å²	79.5	28%	0.279	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-45.2	176.7	173.1	0	0	0	0	110.7	Y358 A359 F364 L365 E366	Y358-V362 HydrophobicContact CD1-CG2 4.38Å; Y358-V362 HydrophobicContact CE1-CG2 3.96Å; Y358-V362 HydrophobicContact CE2-CG2 4.3Å; Y358-V362 WeakPolarHBondContact O-CG2 3.15Å; Y358-V362 PolarHBondContact O-N 2.77Å; A359-V362 PolarHBondContact O-N 3.07Å; V362-F364 VanDerWaalsContact C-N 3.33Å; V362-F364 PolarHBondContact O-N 3.41Å; V362-L365 PolarHBondContact O-N 3.11Å; V362-E366 HydrophobicContact CG1-CG 4.47Å; V362-E366 WeakPolarHBondContact O-CG 3.23Å; V362-E366 PolarHBondContact O-N 2.77Å
363	E	88.3	Confident	89.5	Confident	20 Å²	20	84.8 Å²	84.8	9%	0.093	39%	0.392	C	S	.	.	H	α-helix	trans	-62.3	-38.3	176.5	-75.7	174.8	170.1	0	0	113.1	A359 G360 R361 K367 R496 S497	A359-E363 WeakPolarHBondContact O-CB 3.46Å; A359-E363 VanDerWaalsContact O-CG 3.26Å; A359-E363 WeakPolarHBondContact O-CG 3.4Å; A359-E363 PolarHBondContact O-N 2.84Å; G360-E363 PolarHBondContact O-N 2.89Å; R361-E363 PolarHBondContact O-N 3.36Å; E363-K367 WeakPolarHBondContact O-CB 3.25Å; E363-K367 VanDerWaalsContact O-CG 3.26Å; E363-K367 WeakPolarHBondContact O-CG 3.38Å; E363-K367 PolarHBondContact O-N 3.32Å; E363-R496 VanDerWaalsContact OE1-CA 3.26Å; E363-R496 WeakPolarHBondContact OE1-CA 3.24Å; E363-R496 WeakPolarHBondContact OE1-CB 3.23Å; E363-R496 PolarHBondContact OE1-N 2.91Å; E363-S497 PolarHBondContact OE1-N 2.99Å; E363-S497 VanDerWaalsContact OE1-N 3.16Å; E363-S497 WeakPolarHBondContact OE2-CB 3.41Å; E363-S497 PolarHBondContact OE2-OG 3.38Å
364	F	88.1	Confident	89.1	Confident	127 Å²	127	88.6 Å²	88.6	56%	0.557	42%	0.417	S	S	*	.	H	α-helix	trans	-62.5	-49.2	174.6	179.8	-96.8	0	0	0	111	G360 R361 V362 E366 K367 E368	G360-F364 WeakPolarHBondContact O-CB 3.25Å; G360-F364 PolarHBondContact O-N 2.93Å; R361-F364 WeakPolarHBondContact O-CB 3.2Å; R361-F364 PolarHBondContact O-N 3.45Å; V362-F364 VanDerWaalsContact C-N 3.33Å; V362-F364 PolarHBondContact O-N 3.41Å; F364-E366 VanDerWaalsContact C-N 3.35Å; F364-E366 PolarHBondContact O-N 3.46Å; F364-K367 PolarHBondContact O-N 3.17Å; F364-E368 HydrophobicContact CD1-CG 4.38Å; F364-E368 HydrophobicContact CE1-CG 3.98Å; F364-E368 HydrophobicContact CE2-CG 4.48Å; F364-E368 HydrophobicContact CZ-CG 4.04Å; F364-E368 WeakPolarHBondContact O-CG 3.42Å; F364-E368 PolarHBondContact O-N 3.45Å
365	L	90.4	Very high	88.5	Confident	117 Å²	117	88.9 Å²	88.9	61%	0.613	42%	0.416	S	S	*	.	H	α-helix	trans	-61.7	-39.7	177	-66.9	174.1	0	0	0	112.4	R361 V362 E368 R369	R361-L365 WeakPolarHBondContact O-CG 3.33Å; R361-L365 PolarHBondContact O-N 3.38Å; V362-L365 PolarHBondContact O-N 3.11Å; L365-E368 PolarHBondContact O-N 3.42Å; L365-R369 WeakPolarHBondContact O-CB 3.47Å; L365-R369 PolarHBondContact O-N 3.1Å
366	E	90	Very high	88	Confident	87 Å²	87	89.2 Å²	89.2	41%	0.407	42%	0.417	S	S	.	.	H	α-helix	trans	-65.5	-39.1	175.1	-75.8	-175.6	-178.3	0	0	112.7	V362 F364 K370	V362-E366 HydrophobicContact CG1-CG 4.47Å; V362-E366 WeakPolarHBondContact O-CG 3.23Å; V362-E366 PolarHBondContact O-N 2.77Å; F364-E366 VanDerWaalsContact C-N 3.35Å; F364-E366 PolarHBondContact O-N 3.46Å; E366-K370 WeakPolarHBondContact O-CB 3.22Å; E366-K370 VanDerWaalsContact O-CG 3.32Å; E366-K370 WeakPolarHBondContact O-CG 3.23Å; E366-K370 PolarHBondContact O-N 3.23Å
367	K	88.5	Confident	87.4	Confident	95 Å²	95	95.2 Å²	95.2	41%	0.413	45%	0.449	S	S	.	.	H	α-helix	trans	-65.2	-44.3	175.4	-76.4	173.1	-177.2	177.9	0	110.8	E363 F364 K370 K371 E495	E363-K367 WeakPolarHBondContact O-CB 3.25Å; E363-K367 VanDerWaalsContact O-CG 3.26Å; E363-K367 WeakPolarHBondContact O-CG 3.38Å; E363-K367 PolarHBondContact O-N 3.32Å; F364-K367 PolarHBondContact O-N 3.17Å; K367-K370 PolarHBondContact O-N 3.03Å; K367-K371 WeakPolarHBondContact O-CG 3.46Å; K367-K371 PolarHBondContact O-N 2.9Å; K367-E495 IonicContact NZ-OE1 3.49Å; K367-E495 PolarHBondContact NZ-OE1 2.96Å
368	E	89.3	Confident	86.6	Confident	62 Å²	62	96.5 Å²	96.5	29%	0.29	46%	0.461	S	S	.	.	H	α-helix	trans	-63.6	-43	176	-69.8	-54.6	121.5	0	0	111.9	F364 L365 K370 K371 Q372	F364-E368 HydrophobicContact CD1-CG 4.38Å; F364-E368 HydrophobicContact CE1-CG 3.98Å; F364-E368 HydrophobicContact CE2-CG 4.48Å; F364-E368 HydrophobicContact CZ-CG 4.04Å; F364-E368 WeakPolarHBondContact O-CG 3.42Å; F364-E368 PolarHBondContact O-N 3.45Å; L365-E368 PolarHBondContact O-N 3.42Å; E368-K370 VanDerWaalsContact C-N 3.3Å; E368-K370 PolarHBondContact O-N 3.44Å; E368-K371 PolarHBondContact O-N 2.81Å; E368-K371 IonicContact OE1-NZ 2.69Å; E368-K371 PolarHBondContact OE1-NZ 2.78Å; E368-Q372 WeakPolarHBondContact O-CG 3.41Å; E368-Q372 PolarHBondContact O-N 2.52Å
369	R	89.5	Confident	85.4	Confident	166 Å²	166	94.2 Å²	94.2	63%	0.626	46%	0.459	S	S	*	.	H	α-helix	trans	-62	-35.7	174.6	-167.2	178.1	-177.4	-174	1.8	112.5	L365 K373	L365-R369 WeakPolarHBondContact O-CB 3.47Å; L365-R369 PolarHBondContact O-N 3.1Å; R369-K373 WeakPolarHBondContact O-CG 3.38Å; R369-K373 PolarHBondContact O-N 2.82Å; R369-K373 VanDerWaalsContact O-N 3.13Å
370	K	88.6	Confident	83.9	Confident	134 Å²	134	98.9 Å²	98.9	58%	0.583	48%	0.482	S	S	*	.	H	α-helix	trans	-70	-41.5	174.6	-75.9	171.5	-176.6	168.4	0	111.8	E366 K367 E368 K373 V374	E366-K370 WeakPolarHBondContact O-CB 3.22Å; E366-K370 VanDerWaalsContact O-CG 3.32Å; E366-K370 WeakPolarHBondContact O-CG 3.23Å; E366-K370 PolarHBondContact O-N 3.23Å; K367-K370 PolarHBondContact O-N 3.03Å; E368-K370 VanDerWaalsContact C-N 3.3Å; E368-K370 PolarHBondContact O-N 3.44Å; K370-K373 PolarHBondContact O-N 2.83Å; K370-V374 WeakPolarHBondContact O-CG2 3.49Å; K370-V374 PolarHBondContact O-N 3Å
371	K	88.3	Confident	82.3	Confident	125 Å²	125	108.8 Å²	108.8	54%	0.543	52%	0.515	S	S	.	.	H	α-helix	trans	-60.5	-45.2	174.7	-71.3	175.3	-173.2	169.8	0	111.5	K367 E368 K373 V374 S375	K367-K371 WeakPolarHBondContact O-CG 3.46Å; K367-K371 PolarHBondContact O-N 2.9Å; E368-K371 PolarHBondContact O-N 2.81Å; E368-K371 IonicContact OE1-NZ 2.69Å; E368-K371 PolarHBondContact OE1-NZ 2.78Å; K371-K373 PolarHBondContact O-N 2.9Å; K371-V374 PolarHBondContact O-N 2.74Å; K371-S375 PolarHBondContact O-N 2.94Å; K371-S375 PolarHBondContact O-OG 2.89Å
372	Q	85.9	Confident	80.3	Confident	121 Å²	121	112 Å²	112	57%	0.565	53%	0.528	S	S	*	.	H	α-helix	trans	-61.6	-40.2	176	-73.8	177.2	-13.3	0	0	112.8	E368 S375 L376	E368-Q372 WeakPolarHBondContact O-CG 3.41Å; E368-Q372 PolarHBondContact O-N 2.52Å; Q372-S375 WeakPolarHBondContact CA-OG 3.29Å; Q372-S375 PolarHBondContact O-OG 3.35Å; Q372-L376 WeakPolarHBondContact O-CB 3.37Å; Q372-L376 VanDerWaalsContact O-CG 3.26Å; Q372-L376 WeakPolarHBondContact O-CG 3.5Å; Q372-L376 PolarHBondContact O-N 2.96Å
373	K	83.3	Confident	78.2	Confident	119 Å²	119	115.2 Å²	115.2	52%	0.517	54%	0.542	S	S	.	.	H	α-helix	trans	-65.5	-39.8	174.6	-75.7	-177.9	177.8	-168.6	0	112.4	R369 K370 K371 L377	R369-K373 WeakPolarHBondContact O-CG 3.38Å; R369-K373 PolarHBondContact O-N 2.82Å; R369-K373 VanDerWaalsContact O-N 3.13Å; K370-K373 PolarHBondContact O-N 2.83Å; K371-K373 PolarHBondContact O-N 2.9Å; K373-L377 WeakPolarHBondContact O-CB 3.21Å; K373-L377 VanDerWaalsContact O-CG 3.26Å; K373-L377 WeakPolarHBondContact O-CG 3.3Å; K373-L377 PolarHBondContact O-N 2.99Å
374	V	82.5	Confident	76.2	Confident	98 Å²	98	118.9 Å²	118.9	59%	0.594	57%	0.567	S	S	*	*	H	α-helix	trans	-69.7	-38.9	177.9	172.9	0	0	0	0	111.2	K370 K371 L377 S378	K370-V374 WeakPolarHBondContact O-CG2 3.49Å; K370-V374 PolarHBondContact O-N 3Å; K371-V374 PolarHBondContact O-N 2.74Å; V374-L377 PolarHBondContact O-N 3.26Å; V374-S378 VanDerWaalsContact O-CB 3.27Å; V374-S378 WeakPolarHBondContact O-CB 3.49Å; V374-S378 PolarHBondContact O-N 2.96Å
375	S	81.1	Confident	74.6	Confident	56 Å²	56	118.2 Å²	118.2	39%	0.392	59%	0.585	S	S	.	*	H	α-helix	trans	-66.1	-42.8	175	64.8	0	0	0	0	111.8	K371 Q372 L377 S378 D379	K371-S375 PolarHBondContact O-N 2.94Å; K371-S375 PolarHBondContact O-OG 2.89Å; Q372-S375 WeakPolarHBondContact CA-OG 3.29Å; Q372-S375 PolarHBondContact O-OG 3.35Å; S375-L377 VanDerWaalsContact C-N 3.32Å; S375-L377 PolarHBondContact O-N 2.9Å; S375-S378 WeakPolarHBondContact O-CB 3.37Å; S375-S378 PolarHBondContact O-N 3.42Å; S375-S378 VanDerWaalsContact O-N 3.15Å; S375-D379 PolarHBondContact O-N 3.16Å
376	L	80.9	Confident	72.8	Confident	112 Å²	112	120.9 Å²	120.9	59%	0.586	60%	0.597	S	S	*	*	H	α-helix	trans	-62.8	-36.7	174.7	-74.4	170	0	0	0	112.9	Q372 N380	Q372-L376 WeakPolarHBondContact O-CB 3.37Å; Q372-L376 VanDerWaalsContact O-CG 3.26Å; Q372-L376 WeakPolarHBondContact O-CG 3.5Å; Q372-L376 PolarHBondContact O-N 2.96Å; L376-N380 PolarHBondContact O-N 3.12Å
377	L	77.7	Confident	70.9	Confident	128 Å²	128	121.6 Å²	121.6	67%	0.67	61%	0.608	S	S	*	*	H	α-helix	trans	-73.7	-28.2	174.9	-73.9	169.1	0	0	0	112.8	K373 V374 S375	K373-L377 WeakPolarHBondContact O-CB 3.21Å; K373-L377 VanDerWaalsContact O-CG 3.26Å; K373-L377 WeakPolarHBondContact O-CG 3.3Å; K373-L377 PolarHBondContact O-N 2.99Å; V374-L377 PolarHBondContact O-N 3.26Å; S375-L377 VanDerWaalsContact C-N 3.32Å; S375-L377 PolarHBondContact O-N 2.9Å
378	S	74.1	Confident	68.8	Low	61 Å²	61	123.7 Å²	123.7	43%	0.427	62%	0.622	S	S	.	*	H	α-helix	trans	-71.9	-45.5	175.2	167.2	0	0	0	0	111.7	V374 S375 N380 R381	V374-S378 VanDerWaalsContact O-CB 3.27Å; V374-S378 WeakPolarHBondContact O-CB 3.49Å; V374-S378 PolarHBondContact O-N 2.96Å; S375-S378 WeakPolarHBondContact O-CB 3.37Å; S375-S378 PolarHBondContact O-N 3.42Å; S375-S378 VanDerWaalsContact O-N 3.15Å; S378-N380 VanDerWaalsContact C-N 3.32Å; S378-N380 PolarHBondContact O-N 3.41Å; S378-R381 WeakPolarHBondContact O-CB 3.42Å; S378-R381 PolarHBondContact O-N 2.78Å; S378-R381 VanDerWaalsContact O-N 3.08Å
379	D	66.4	Low	66.8	Low	117 Å²	117	127.2 Å²	127.2	63%	0.626	65%	0.651	S	S	*	*	H	α-helix	trans	-66.7	-32.7	-179.2	-76.6	-18.7	0	0	0	112.3	S375 R381	S375-D379 PolarHBondContact O-N 3.16Å; D379-R381 VanDerWaalsContact C-N 3.27Å; D379-R381 PolarHBondContact O-N 2.82Å
380	N	60.2	Low	64.9	Low	115 Å²	115	126.8 Å²	126.8	62%	0.615	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-79.2	-4.5	174.3	-73.9	-7.7	0	0	0	114	L376 S378 W382	L376-N380 PolarHBondContact O-N 3.12Å; S378-N380 VanDerWaalsContact C-N 3.32Å; S378-N380 PolarHBondContact O-N 3.41Å; N380-W382 VanDerWaalsContact C-N 3.34Å
381	R	55.6	Low	62.7	Low	220 Å²	220	128.8 Å²	128.8	83%	0.83	67%	0.673	S	S	*	*	G	3₁₀ helix	trans	-85.6	-5.7	-178.5	-144.3	172.3	-155.9	-160.3	2.7	113.9	S378 D379	S378-R381 WeakPolarHBondContact O-CB 3.42Å; S378-R381 PolarHBondContact O-N 2.78Å; S378-R381 VanDerWaalsContact O-N 3.08Å; D379-R381 VanDerWaalsContact C-N 3.27Å; D379-R381 PolarHBondContact O-N 2.82Å
382	W	46.5	Very low	60.9	Low	227 Å²	227	132 Å²	132	86%	0.86	69%	0.693	S	S	*	*	G	3₁₀ helix	trans	-105.1	17.2	176.4	-68.9	93.7	0	0	0	113.9	N380 P384	N380-W382 VanDerWaalsContact C-N 3.34Å; W382-P384 WeakPolarHBondContact O-CD 3.28Å
383	I	47.1	Very low	59	Low	113 Å²	113	134.7 Å²	134.7	58%	0.579	71%	0.705	S	S	*	*	S	Bend	trans	-87.8	105	164.2	-53.6	176.4	0	0	0	106.9	A385	I383-A385 PolarHBondContact O-N 3.31Å
384	P	46.6	Very low	57	Low	96 Å²	96	137.9 Å²	137.9	62%	0.623	72%	0.722	S	S	*	*			trans	-61	134.1	175.3	23	-27.5	0	0	0	108.7	W382 M386	W382-P384 WeakPolarHBondContact O-CD 3.28Å; P384-M386 PolarHBondContact O-N 3.44Å
385	A	53.9	Low	54.9	Low	113 Å²	113	144 Å²	144	93%	0.934	74%	0.735	S	S	*	*	S	Bend	trans	-67.8	40.4	-179.3	0	0	0	0	0	113.6	I383	I383-A385 PolarHBondContact O-N 3.31Å
386	M	52	Low	52.8	Low	173 Å²	173	146.6 Å²	146.6	85%	0.852	75%	0.752	S	S	*	*			trans	-120.4	13.4	-171.1	-144.5	174	-86	0	0	113.3	P384	P384-M386 PolarHBondContact O-N 3.44Å
387	T	51.8	Low	50.9	Low	103 Å²	103	146.7 Å²	146.7	63%	0.632	76%	0.763	S	S	*	*	S	Bend	trans	-135	127.4	172.5	52.1	0	0	0	0	110
388	L	44.6	Very low	49.3	Very low	138 Å²	138	147.6 Å²	147.6	72%	0.723	77%	0.773	S	S	*	*	S	Bend	trans	89.9	70.1	174.6	-69	69.7	0	0	0	115
389	P	46.4	Very low	47.7	Very low	136 Å²	136	148.6 Å²	148.6	88%	0.883	79%	0.785	S	S	*	*	S	Bend		-123.4	88.3	91	32	-24.6	0	0	0	111.6
390	L	48.7	Very low	46.7	Very low	157 Å²	157	151.4 Å²	151.4	82%	0.822	80%	0.797	S	S	*	*			trans	-146.9	27	170.9	-117.8	160.1	0	0	0	111.9
391	M	44.4	Very low	45.9	Very low	176 Å²	176	152.6 Å²	152.6	87%	0.867	80%	0.803	S	S	*	*	S	Bend	trans	-115.3	18.8	176	-76.5	-94.8	158.1	0	0	112.3
392	M	50.4	Low	45.6	Very low	193 Å²	193	148.2 Å²	148.2	95%	0.951	80%	0.801	S	S	*	*	S	Bend	trans	-109.4	7.8	177.8	-111.3	179.6	173.7	0	0	114.2
393	Q	45.1	Very low	45.7	Very low	178 Å²	178	142.8 Å²	142.8	83%	0.832	80%	0.795	S	S	*	*			trans	-148.1	62.8	-171.1	-159.4	141.1	-2.6	0	0	114.6
394	Q	41.8	Very low	46.4	Very low	185 Å²	185	142.8 Å²	142.8	86%	0.864	80%	0.802	S	S	*	*			trans	-147.8	90.8	156.4	-140.3	159.1	-33.8	0	0	107.6
395	R	37.7	Very low	46.6	Very low	227 Å²	227	143.3 Å²	143.3	86%	0.857	81%	0.805	S	S	*	*				55.3	95.9	103.2	-84.1	179.4	167.7	175.8	-4.1	110.3
396	S	37	Very low	46	Very low	110 Å²	110	145.8 Å²	145.8	77%	0.769	80%	0.803	S	S	*	*				51.5	123.9	80.2	-49.4	0	0	0	0	112.2
397	S	41.5	Very low	45.6	Very low	115 Å²	115	146.4 Å²	146.4	80%	0.804	81%	0.806	S	S	*	*			trans	77.8	109.3	175.9	66.1	0	0	0	0	117
398	V	44.5	Very low	45.1	Very low	146 Å²	146	145.5 Å²	145.5	89%	0.885	82%	0.817	S	S	*	*				-177.3	142.8	93.3	161.7	0	0	0	0	108.4
399	A	39.9	Very low	44.6	Very low	83 Å²	83	150.3 Å²	150.3	69%	0.686	83%	0.826	S	S	*	*			trans	-98.5	170.7	-167.6	0	0	0	0	0	113.9
400	M	45.6	Very low	44.4	Very low	175 Å²	175	148.6 Å²	148.6	86%	0.862	82%	0.815	S	S	*	*			trans	105.1	125	145.6	-71.5	-174.1	166.8	0	0	121.2
401	N	42.1	Very low	43.9	Very low	140 Å²	140	145.9 Å²	145.9	75%	0.749	81%	0.809	S	S	*	*			trans	94.7	83.2	147.5	-66	-6.9	0	0	0	121.3
402	V	50.8	Low	43.8	Very low	129 Å²	129	144.2 Å²	144.2	78%	0.782	80%	0.802	S	S	*	*				25.8	146.3	96.6	-176.7	0	0	0	0	116.9
403	P	48.3	Very low	43.4	Very low	113 Å²	113	142.9 Å²	142.9	73%	0.734	79%	0.794	S	S	*	*			cis	-138.5	175.2	21.3	16.2	12.1	0	0	0	119.3
404	P	60.7	Low	43.4	Very low	113 Å²	113	140 Å²	140	73%	0.734	79%	0.79	S	S	*	*			trans	-106.8	-149.5	171.5	45.4	-32.9	0	0	0	110.2
405	P	51.1	Low	43.5	Very low	107 Å²	107	136.2 Å²	136.2	70%	0.695	78%	0.782	S	S	*	*			cis	-130	177.2	-23.3	36.6	-18.8	0	0	0	112.9
406	N	42.7	Very low	43.7	Very low	164 Å²	164	134 Å²	134	88%	0.877	78%	0.781	S	S	*	*				-164.8	144	128.8	-118.7	-15.4	0	0	0	115.9
407	M	43.3	Very low	43.6	Very low	187 Å²	187	132.5 Å²	132.5	92%	0.921	78%	0.776	S	S	*	*			trans	-79.6	156	-175.7	-66.9	174.9	174.9	0	0	113.5
408	G	40.2	Very low	43.4	Very low	84 Å²	84	133.6 Å²	133.6	87%	0.866	78%	0.777	S	S	*	*			trans	172.7	99.1	160.7	0	0	0	0	0	114.5
409	R	33.8	Very low	43.3	Very low	239 Å²	239	132 Å²	132	90%	0.902	77%	0.77	S	S	*	*			trans	-122	-179.6	165.1	-140.4	-160	-169.7	-175.2	3.8	106.1
410	P	43.8	Very low	43.3	Very low	100 Å²	100	133.1 Å²	133.1	65%	0.649	77%	0.771	S	S	*	*			cis	-119.4	178.3	-37.4	23.6	-0.1	0	0	0	110.5
411	S	37.6	Very low	42.9	Very low	100 Å²	100	133.8 Å²	133.8	70%	0.699	77%	0.771	S	S	*	*				147	159	91.8	57.1	0	0	0	0	112.3
412	L	41.6	Very low	42.5	Very low	140 Å²	140	135.9 Å²	135.9	73%	0.733	78%	0.776	S	S	*	*			trans	89.1	102.4	153.5	-98.7	77.5	0	0	0	123.5
413	Q	42.7	Very low	41.9	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	78%	0.784	S	S	*	*				78.3	133.8	125.2	-77.7	168.6	-11.6	0	0	123.9
414	P	45.7	Very low	41.2	Very low	116 Å²	116	138 Å²	138	75%	0.753	79%	0.789	S	S	*	*			trans	-92.3	-171.1	169	43	-35	0	0	0	110.4
415	P	43.4	Very low	39.9	Very low	107 Å²	107	140.9 Å²	140.9	70%	0.695	80%	0.797	S	S	*	*			cis	-145.8	-168.1	19	33.3	-6	0	0	0	116.2
416	H	40.6	Very low	39.3	Very low	180 Å²	180	144 Å²	144	83%	0.833	80%	0.802	S	S	*	*			trans	127.1	125	147.2	-84	-70.9	0	0	0	119.2
417	A	35.3	Very low	39	Very low	79 Å²	79	143.1 Å²	143.1	65%	0.653	80%	0.797	S	S	*	*			trans	-58.5	156.8	167.9	0	0	0	0	0	112.4
418	T	38.5	Very low	38.7	Very low	137 Å²	137	144.9 Å²	144.9	84%	0.84	80%	0.795	S	S	*	*				-169.6	169.4	74.1	16.7	0	0	0	0	112.2
419	P	41	Very low	38.6	Very low	114 Å²	114	146 Å²	146	74%	0.74	79%	0.787	S	S	*	*			trans	-97.3	-158	-156.1	45.2	-39.5	0	0	0	112
420	P	40.6	Very low	38.6	Very low	106 Å²	106	142 Å²	142	69%	0.688	78%	0.782	S	S	*	*			cis	-138.8	179.6	1.7	36.5	-13.8	0	0	0	116.2
421	Q	37.9	Very low	38.3	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	79%	0.79	S	S	*	*				167.1	133.6	122.7	-87.5	-179.2	8.9	0	0	113.1
422	H	32.4	Very low	38.5	Very low	185 Å²	185	145.9 Å²	145.9	86%	0.856	80%	0.798	S	S	*	*			trans	-82.3	140.9	-176.5	-94.6	-90.9	0	0	0	112.9
423	H	38.5	Very low	38.6	Very low	205 Å²	205	146.3 Å²	146.3	95%	0.949	80%	0.799	S	S	*	*			trans	-162	136.8	145.3	-99.3	-66.1	0	0	0	110.8
424	G	34.7	Very low	38.4	Very low	80 Å²	80	141.8 Å²	141.8	83%	0.825	79%	0.786	S	S	*	*			trans	111.4	87.7	160.4	0	0	0	0	0	116.4
425	I	32.2	Very low	38.6	Very low	175 Å²	175	141.8 Å²	141.8	90%	0.897	79%	0.786	S	S	*	*			trans	-90.9	120.6	172.3	-66.6	169.5	0	0	0	108.2
426	E	38.4	Very low	39	Very low	172 Å²	172	142.4 Å²	142.4	80%	0.804	78%	0.779	S	S	*	*			trans	-142.2	107.1	167.5	-140.1	170.6	-165.9	0	0	110.7
427	N	36.5	Very low	39.1	Very low	145 Å²	145	137.8 Å²	137.8	78%	0.775	77%	0.766	S	S	*	*			trans	44.5	100.1	148.1	-58.2	-27.5	0	0	0	120.7
428	Y	37.5	Very low	39.6	Very low	224 Å²	224	142.6 Å²	142.6	88%	0.878	77%	0.772	S	S	*	*			trans	-96.2	131.7	154.9	-86.7	-92.8	0	0	0	110.4	I430	Y428-I430 PolarHBondContact O-N 3.17Å
429	P	37.8	Very low	39.9	Very low	107 Å²	107	139.2 Å²	139.2	70%	0.695	76%	0.758	S	S	*	*			trans	-74.8	127.3	175.5	-8.7	24.6	0	0	0	111.7	E431	P429-E431 VanDerWaalsContact C-N 3.34Å; P429-E431 PolarHBondContact O-N 2.82Å
430	I	35	Very low	40.1	Very low	157 Å²	157	140.8 Å²	140.8	81%	0.805	76%	0.756	S	S	*	*			trans	-71.4	82.1	169.9	-57.7	174.8	0	0	0	108.2	Y428	Y428-I430 PolarHBondContact O-N 3.17Å
431	E	35.9	Very low	40.2	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.822	76%	0.756	S	S	*	*			trans	-135.5	14.6	179.2	-77.8	-169.2	155.7	0	0	115.1	P429	P429-E431 VanDerWaalsContact C-N 3.34Å; P429-E431 PolarHBondContact O-N 2.82Å
432	A	42.3	Very low	40.6	Very low	104 Å²	104	138 Å²	138	86%	0.86	74%	0.739	S	S	*	*	S	Bend	trans	-93.1	9.1	-178.5	0	0	0	0	0	115.5
433	I	43.8	Very low	41.3	Very low	149 Å²	149	136.2 Å²	136.2	76%	0.764	73%	0.731	S	S	*	*	S	Bend	trans	-111.1	-3.4	-164.2	-64.4	174.1	0	0	0	115
434	C	39.4	Very low	41.8	Very low	72 Å²	72	133.7 Å²	133.7	49%	0.486	72%	0.72	S	S	.	*			trans	-133.4	103.4	-179.2	-150.6	0	0	0	0	114.1	E436	C434-E436 PolarHBondContact O-N 2.9Å
435	P	49.1	Very low	42.1	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	-14.6	172.9	-15.8	30.1	0	0	0	113.9
436	E	52.1	Low	42.5	Very low	120 Å²	120	137.6 Å²	137.6	56%	0.561	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.5	-27.1	178.5	-107.8	93.6	-163.2	0	0	113.3	C434 K438 A439	C434-E436 PolarHBondContact O-N 2.9Å; E436-K438 VanDerWaalsContact C-N 3.33Å; E436-K438 PolarHBondContact O-N 3.29Å; E436-A439 PolarHBondContact O-N 2.87Å
437	C	42.8	Very low	42.6	Very low	82 Å²	82	140.3 Å²	140.3	55%	0.554	71%	0.711	S	S	*	*	H	α-helix	trans	-74.2	-16.7	-173.6	-60.3	0	0	0	0	114.7
438	K	44.4	Very low	42.8	Very low	180 Å²	180	137.9 Å²	137.9	78%	0.783	71%	0.705	S	S	*	*	H	α-helix	trans	-84.9	-16.8	177.8	-83.3	-175	176.9	176.6	0	113.8	E436 T442	E436-K438 VanDerWaalsContact C-N 3.33Å; E436-K438 PolarHBondContact O-N 3.29Å; K438-T442 PolarHBondContact O-OG1 2.87Å
439	A	45.2	Very low	42.9	Very low	66 Å²	66	137.4 Å²	137.4	55%	0.545	70%	0.703	S	S	.	*	H	α-helix	trans	-78.1	-39	-177.7	0	0	0	0	0	112.4	E436 T442 E443	E436-A439 PolarHBondContact O-N 2.87Å; A439-T442 PolarHBondContact O-N 2.94Å; A439-E443 PolarHBondContact O-N 3.18Å
440	E	45.3	Very low	42.7	Very low	148 Å²	148	137.6 Å²	137.6	69%	0.692	71%	0.707	S	S	*	*	H	α-helix	trans	-70.7	-35.5	-178.6	-81.1	-178.4	133.3	0	0	113.9	T442 E443 Q444	E440-T442 PolarHBondContact O-N 2.83Å; E440-E443 PolarHBondContact O-N 3.12Å; E440-Q444 PolarHBondContact O-N 3.39Å
441	Q	43.6	Very low	42.6	Very low	150 Å²	150	133.5 Å²	133.5	70%	0.701	70%	0.704	S	S	*	*	H	α-helix	trans	-69.7	-23.5	177.3	-67.3	-160.9	0.3	0	0	113	K445	Q441-K445 PolarHBondContact O-N 2.85Å
442	T	46.5	Very low	42.5	Very low	84 Å²	84	134.7 Å²	134.7	52%	0.515	71%	0.706	S	S	.	*	H	α-helix	trans	-81.8	-25.4	-179.7	-45.9	0	0	0	0	112	K438 A439 E440	K438-T442 PolarHBondContact O-OG1 2.87Å; A439-T442 PolarHBondContact O-N 2.94Å; E440-T442 PolarHBondContact O-N 2.83Å
443	E	47.4	Very low	42.2	Very low	148 Å²	148	137.9 Å²	137.9	69%	0.692	70%	0.704	S	S	*	*	H	α-helix	trans	-82.1	-34.7	173.8	-76.7	-160.6	142.1	0	0	113.4	A439 E440 K445 K446 R447	A439-E443 PolarHBondContact O-N 3.18Å; E440-E443 PolarHBondContact O-N 3.12Å; E443-K445 VanDerWaalsContact C-N 3.31Å; E443-K445 PolarHBondContact O-N 3.1Å; E443-K446 PolarHBondContact O-N 3.37Å; E443-R447 PolarHBondContact O-N 3.36Å
444	Q	47	Very low	41.9	Very low	153 Å²	153	140.2 Å²	140.2	72%	0.715	71%	0.708	S	S	*	*	H	α-helix	trans	-64.1	-34.9	173.5	-81.5	-175.7	-13.5	0	0	112.5	E440 K446 R447	E440-Q444 PolarHBondContact O-N 3.39Å; Q444-K446 VanDerWaalsContact C-N 3.31Å; Q444-K446 PolarHBondContact O-N 2.74Å; Q444-R447 PolarHBondContact O-N 3.47Å
445	K	41.5	Very low	42	Very low	172 Å²	172	141.6 Å²	141.6	75%	0.748	72%	0.716	S	S	*	*	H	α-helix	trans	-72.3	-21	178.8	-143.7	172.2	-172.8	175.2	0	113.7	Q441 E443	Q441-K445 PolarHBondContact O-N 2.85Å; E443-K445 VanDerWaalsContact C-N 3.31Å; E443-K445 PolarHBondContact O-N 3.1Å
446	K	42.1	Very low	41.4	Very low	164 Å²	164	143.6 Å²	143.6	71%	0.713	72%	0.72	S	S	*	*	H	α-helix	trans	-86.5	-21.5	176.2	-78.9	-178.5	178.9	175.5	0	114.1	E443 Q444 S448	E443-K446 PolarHBondContact O-N 3.37Å; Q444-K446 VanDerWaalsContact C-N 3.31Å; Q444-K446 PolarHBondContact O-N 2.74Å; K446-S448 VanDerWaalsContact C-N 3.34Å
447	R	39.1	Very low	40.6	Very low	229 Å²	229	146.5 Å²	146.5	86%	0.864	74%	0.738	S	S	*	*	H	α-helix	trans	-79.4	-12.4	174.6	-88.2	-179.7	175.2	163.7	0.7	114.1	E443 Q444	E443-R447 PolarHBondContact O-N 3.36Å; Q444-R447 PolarHBondContact O-N 3.47Å
448	S	40.8	Very low	40.1	Very low	95 Å²	95	145.5 Å²	145.5	66%	0.664	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89	-0.3	-177	-156.8	0	0	0	0	115.5	K446	K446-S448 VanDerWaalsContact C-N 3.34Å
449	Y	39.6	Very low	39.6	Very low	213 Å²	213	144.8 Å²	144.8	84%	0.835	75%	0.747	S	S	*	*	S	Bend	trans	-127.7	19.3	-170.3	-95.4	-84.7	0	0	0	115.3
450	S	34.6	Very low	38.8	Very low	111 Å²	111	151.1 Å²	151.1	78%	0.776	76%	0.762	S	S	*	*			trans	-113.9	81	172.1	66.5	0	0	0	0	110.9
451	G	32.1	Very low	38.4	Very low	71 Å²	71	148.8 Å²	148.8	73%	0.732	76%	0.762	S	S	*	*			trans	-142.4	131.1	167.7	0	0	0	0	0	108.6
452	F	33.9	Very low	37.9	Very low	201 Å²	201	147.1 Å²	147.1	88%	0.882	75%	0.754	S	S	*	*			trans	101	133.2	166.6	-134.3	-103.8	0	0	0	118.6
453	E	37.1	Very low	37.2	Very low	171 Å²	171	152.1 Å²	152.1	80%	0.799	77%	0.765	S	S	*	*			trans	-91.3	168.1	-147.7	-71.3	161.7	107.2	0	0	115.4
454	K	36.7	Very low	36.6	Very low	198 Å²	198	150.5 Å²	150.5	86%	0.861	77%	0.766	S	S	*	*			trans	-89.7	-166.1	174.6	-61.5	177.9	167.1	176.2	0	111.7
455	P	40.7	Very low	35.9	Very low	101 Å²	101	148.9 Å²	148.9	66%	0.656	77%	0.766	S	S	*	*				-133.9	-170.1	-82.4	41	-21	0	0	0	112.2
456	L	36.7	Very low	35.6	Very low	158 Å²	158	147.3 Å²	147.3	83%	0.827	77%	0.771	S	S	*	*			trans	146.6	155.3	134.2	-77.1	-179.6	0	0	0	115.7
457	L	35.5	Very low	35.2	Very low	182 Å²	182	145.2 Å²	145.2	95%	0.953	78%	0.777	S	S	*	*			trans	94.1	130.6	173.2	-66	153.9	0	0	0	115.3
458	G	32	Very low	35	Very low	61 Å²	61	137.7 Å²	137.7	63%	0.629	77%	0.771	S	S	*	*			cis	171	172.2	4	0	0	0	0	0	110.8
459	N	34.6	Very low	34.8	Very low	165 Å²	165	143.1 Å²	143.1	88%	0.882	78%	0.783	S	S	*	*			trans	85.4	115.8	169.1	-57.3	-8.9	0	0	0	117.2
460	F	28.7	Very low	34.5	Very low	199 Å²	199	141.9 Å²	141.9	87%	0.873	79%	0.787	S	S	*	*			cis	94.1	132.1	31.3	-143.5	-80	0	0	0	114.6
461	S	35.5	Very low	34.7	Very low	98 Å²	98	142 Å²	142	69%	0.685	79%	0.785	S	S	*	*			trans	115.1	135.9	164.4	-170.2	0	0	0	0	114.2
462	E	33.3	Very low	34.9	Very low	116 Å²	116	142 Å²	142	54%	0.542	79%	0.785	S	S	.	*			cis	174.6	165.3	-13.3	-148.6	166.2	174.3	0	0	106.7
463	Y	32.6	Very low	35.2	Very low	189 Å²	189	138.6 Å²	138.6	74%	0.741	78%	0.78	S	S	*	*			trans	72.7	136	154	-70.9	-52.1	0	0	0	120
464	T	34.6	Very low	35.2	Very low	114 Å²	114	138 Å²	138	70%	0.699	78%	0.782	S	S	*	*			cis	-164.8	152.7	8	-60.5	0	0	0	0	110
465	T	31.9	Very low	35	Very low	118 Å²	118	138.4 Å²	138.4	72%	0.724	78%	0.783	S	S	*	*			trans	-33.1	150	168.5	3.9	0	0	0	0	122.1
466	T	36.3	Very low	35	Very low	139 Å²	139	137.4 Å²	137.4	85%	0.853	78%	0.784	S	S	*	*				151.6	146.5	122.2	44	0	0	0	0	108.3
467	S	32.9	Very low	35.2	Very low	121 Å²	121	137.3 Å²	137.3	85%	0.846	79%	0.789	S	S	*	*			cis	170.5	133.2	-7.9	167.6	0	0	0	0	104.1
468	G	35.5	Very low	35.6	Very low	71 Å²	71	136.4 Å²	136.4	73%	0.732	78%	0.78	S	S	*	*			trans	160.5	75.4	171.1	0	0	0	0	0	120.4
469	K	35.2	Very low	36.1	Very low	209 Å²	209	143.3 Å²	143.3	91%	0.909	79%	0.793	S	S	*	*			trans	65.5	93	144.3	-61.7	-176.8	179.1	177.6	0	122
470	M	34.1	Very low	37	Very low	187 Å²	187	144 Å²	144	92%	0.921	78%	0.783	S	S	*	*				42.1	163.5	106.7	-110	-158.5	-175.3	0	0	123.3
471	P	39.9	Very low	38.8	Very low	113 Å²	113	137.4 Å²	137.4	73%	0.734	76%	0.761	S	S	*	*				-134.3	-172.1	-97.1	44	-25	0	0	0	115.7
472	G	34.4	Very low	40.3	Very low	71 Å²	71	141.3 Å²	141.3	73%	0.732	76%	0.761	S	S	*	*			trans	91.6	141.3	162	0	0	0	0	0	114.2
473	V	41	Very low	42	Very low	130 Å²	130	140.5 Å²	140.5	79%	0.788	76%	0.76	S	S	*	*				179.6	156	53.7	160.5	0	0	0	0	108.3
474	L	37.3	Very low	43.8	Very low	158 Å²	158	134.2 Å²	134.2	83%	0.827	74%	0.742	S	S	*	*			trans	82.7	104	158.1	-81.9	154.6	0	0	0	121
475	K	32.7	Very low	45.6	Very low	206 Å²	206	136.5 Å²	136.5	90%	0.896	74%	0.737	S	S	*	*			trans	-61.4	125.5	152.6	-68.3	175.1	177.9	175	0	109.6
476	A	39.9	Very low	47.5	Very low	81 Å²	81	134 Å²	134	67%	0.669	72%	0.72	S	S	*	*			trans	-126.1	110.5	162.7	0	0	0	0	0	109.3	Q478	A476-Q478 VanDerWaalsContact C-N 3.35Å; A476-Q478 PolarHBondContact O-N 2.54Å
477	V	40.5	Very low	49.2	Very low	155 Å²	155	136.3 Å²	136.3	94%	0.939	71%	0.713	S	S	*	*			trans	-72.9	91.2	169.4	173.7	0	0	0	0	106.8
478	Q	44.3	Very low	51	Low	163 Å²	163	134 Å²	134	76%	0.762	69%	0.69	S	S	*	*			trans	-96.7	114.3	-178.1	-163.7	152.6	-19.6	0	0	110.8	A476 R480	A476-Q478 VanDerWaalsContact C-N 3.35Å; A476-Q478 PolarHBondContact O-N 2.54Å; Q478-R480 PolarHBondContact O-N 3.01Å
479	K	42.2	Very low	52.6	Low	207 Å²	207	132.7 Å²	132.7	90%	0.9	66%	0.663	S	S	*	*			trans	-34.4	100.2	168.1	-149.8	173.7	-173.1	179.6	0	110.1	S481	K479-S481 PolarHBondContact O-N 3.26Å; K479-S481 VanDerWaalsContact O-N 3.07Å
480	R	53.3	Low	54.3	Low	180 Å²	180	126.4 Å²	126.4	68%	0.679	64%	0.639	S	S	*	*			trans	-66.2	111.2	-178.7	-94.8	-179.2	175.6	166.4	-2.7	109.2	Q478 T484 L488	Q478-R480 PolarHBondContact O-N 3.01Å; R480-T484 HydrophobicContact CG-CG2 4.38Å; R480-L488 VanDerWaalsContact NH1-CD1 3.34Å
481	S	66.9	Low	55.7	Low	59 Å²	59	123 Å²	123	41%	0.413	63%	0.629	S	S	.	*			trans	-57.3	147.6	168.2	165.4	0	0	0	0	110.2	K479 L483 T484 W485	K479-S481 PolarHBondContact O-N 3.26Å; K479-S481 VanDerWaalsContact O-N 3.07Å; S481-L483 PolarHBondContact O-N 2.75Å; S481-L483 PolarHBondContact OG-N 3.32Å; S481-T484 PolarHBondContact N-OG1 3.25Å; S481-T484 WeakPolarHBondContact O-CA 3.19Å; S481-T484 WeakPolarHBondContact O-CB 3.5Å; S481-T484 PolarHBondContact O-N 3.3Å; S481-T484 PolarHBondContact O-OG1 2.92Å; S481-W485 PolarHBondContact O-N 3.13Å
482	W	66.5	Low	56.8	Low	180 Å²	180	125.3 Å²	125.3	68%	0.682	63%	0.627	S	S	*	*	H	α-helix	trans	-48.4	-33.3	174.3	155.7	70.7	0	0	0	112.6	T484 W485 L486	W482-T484 PolarHBondContact O-N 3.5Å; W482-W485 PolarHBondContact O-N 3.08Å; W482-L486 HydrophobicContact CZ2-CD1 4.48Å; W482-L486 WeakPolarHBondContact O-CB 3.43Å; W482-L486 PolarHBondContact O-N 3.38Å
483	L	70.2	Confident	58.2	Low	99 Å²	99	125 Å²	125	52%	0.518	60%	0.604	S	S	.	*	H	α-helix	trans	-61.3	-37.9	173.8	-77.6	148	0	0	0	113.4	S481 L486 R487	S481-L483 PolarHBondContact O-N 2.75Å; S481-L483 PolarHBondContact OG-N 3.32Å; L483-L486 PolarHBondContact O-N 3.41Å; L483-R487 WeakPolarHBondContact O-CG 3.44Å; L483-R487 PolarHBondContact O-N 2.83Å
484	T	70	Confident	59.2	Low	57 Å²	57	127.9 Å²	127.9	35%	0.35	61%	0.606	S	S	.	*	H	α-helix	trans	-71.1	-37.4	177.3	-8.4	0	0	0	0	110.9	R480 S481 W482 R487 L488	R480-T484 HydrophobicContact CG-CG2 4.38Å; S481-T484 PolarHBondContact N-OG1 3.25Å; S481-T484 WeakPolarHBondContact O-CA 3.19Å; S481-T484 WeakPolarHBondContact O-CB 3.5Å; S481-T484 PolarHBondContact O-N 3.3Å; S481-T484 PolarHBondContact O-OG1 2.92Å; W482-T484 PolarHBondContact O-N 3.5Å; T484-R487 PolarHBondContact O-N 2.92Å; T484-L488 WeakPolarHBondContact O-CB 3.3Å; T484-L488 VanDerWaalsContact O-CD1 3.32Å; T484-L488 WeakPolarHBondContact O-CD1 3.32Å; T484-L488 VanDerWaalsContact O-CG 3.29Å; T484-L488 WeakPolarHBondContact O-CG 3.39Å; T484-L488 PolarHBondContact O-N 3.44Å
485	W	71.8	Confident	61	Low	162 Å²	162	122.4 Å²	122.4	61%	0.614	58%	0.577	S	S	*	*	H	α-helix	trans	-65.1	-43.4	173	-167.1	87.2	0	0	0	111.4	S481 W482 R487 L488 W489	S481-W485 PolarHBondContact O-N 3.13Å; W482-W485 PolarHBondContact O-N 3.08Å; W485-R487 PolarHBondContact O-N 3.12Å; W485-L488 PolarHBondContact O-N 3.41Å; W485-W489 HydrophobicContact CZ3-CG 4.48Å; W485-W489 WeakPolarHBondContact O-CB 3.42Å; W485-W489 PolarHBondContact O-N 3.41Å
486	L	72.6	Confident	63.1	Low	67 Å²	67	119.6 Å²	119.6	35%	0.351	56%	0.56	S	S	.	*	H	α-helix	trans	-59.8	-44.8	175.5	-159.2	94.2	0	0	0	111.8	W482 L483 W489 L490	W482-L486 HydrophobicContact CZ2-CD1 4.48Å; W482-L486 WeakPolarHBondContact O-CB 3.43Å; W482-L486 PolarHBondContact O-N 3.38Å; L483-L486 PolarHBondContact O-N 3.41Å; L486-W489 PolarHBondContact O-N 3.43Å; L486-L490 WeakPolarHBondContact O-CB 3.29Å; L486-L490 WeakPolarHBondContact O-CG 3.46Å; L486-L490 PolarHBondContact O-N 3.38Å
487	R	72.6	Confident	65	Low	187 Å²	187	115.7 Å²	115.7	71%	0.706	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-46.8	175.1	-77	-172.9	-173.1	-170.5	3.3	112.2	L483 T484 W485 W489 L490 V491	L483-R487 WeakPolarHBondContact O-CG 3.44Å; L483-R487 PolarHBondContact O-N 2.83Å; T484-R487 PolarHBondContact O-N 2.92Å; W485-R487 PolarHBondContact O-N 3.12Å; R487-W489 VanDerWaalsContact C-N 3.26Å; R487-W489 PolarHBondContact O-N 3.29Å; R487-L490 PolarHBondContact O-N 2.85Å; R487-V491 WeakPolarHBondContact O-CG2 3.5Å; R487-V491 PolarHBondContact O-N 3.28Å
488	L	70.8	Confident	67	Low	71 Å²	71	113 Å²	113	37%	0.372	50%	0.504	S	S	.	.	H	α-helix	trans	-61.7	-37.7	176.9	-75.8	158.5	0	0	0	111.8	R480 T484 W485 V491 K492	R480-L488 VanDerWaalsContact NH1-CD1 3.34Å; T484-L488 WeakPolarHBondContact O-CB 3.3Å; T484-L488 VanDerWaalsContact O-CD1 3.32Å; T484-L488 WeakPolarHBondContact O-CD1 3.32Å; T484-L488 VanDerWaalsContact O-CG 3.29Å; T484-L488 WeakPolarHBondContact O-CG 3.39Å; T484-L488 PolarHBondContact O-N 3.44Å; W485-L488 PolarHBondContact O-N 3.41Å; L488-V491 PolarHBondContact O-N 2.84Å; L488-K492 WeakPolarHBondContact O-CB 3.25Å; L488-K492 PolarHBondContact O-N 2.9Å
489	W	69	Low	69	Low	45 Å²	45	108.3 Å²	108.3	17%	0.17	48%	0.479	C	S	.	.	H	α-helix	trans	-68.6	-42	178.2	-173.3	91.6	0	0	0	111.9	W485 L486 R487 V491 K492 Y493 R499 V502 I503	W485-W489 HydrophobicContact CZ3-CG 4.48Å; W485-W489 WeakPolarHBondContact O-CB 3.42Å; W485-W489 PolarHBondContact O-N 3.41Å; L486-W489 PolarHBondContact O-N 3.43Å; R487-W489 VanDerWaalsContact C-N 3.26Å; R487-W489 PolarHBondContact O-N 3.29Å; W489-V491 VanDerWaalsContact C-N 3.27Å; W489-V491 PolarHBondContact O-N 3.37Å; W489-K492 PolarHBondContact O-N 2.71Å; W489-Y493 AromaticContact CD1-CE2 3.88Å; W489-Y493 HydrophobicContact CD2-CD2 4.1Å; W489-Y493 AromaticContact CE2-CD2 3.65Å; W489-Y493 AromaticContact CE2-CE2 3.89Å; W489-Y493 HydrophobicContact CG-CD2 4.29Å; W489-Y493 HydrophobicContact CZ2-CD2 4.03Å; W489-Y493 HydrophobicContact CZ2-CE2 4.38Å; W489-Y493 AromaticContact NE1-CD2 3.62Å; W489-Y493 AromaticContact NE1-CE2 3.4Å; W489-Y493 PolarHBondContact O-N 2.91Å; W489-R499 HydrophobicContact CE3-CG 4.47Å; W489-R499 HydrophobicContact CH2-CB 4.46Å; W489-R499 HydrophobicContact CH2-CG 3.14Å; W489-R499 HydrophobicContact CZ2-CG 4.05Å; W489-R499 HydrophobicContact CZ3-CG 3.42Å; W489-R499 VanDerWaalsContact CZ3-CG 3.42Å; W489-V502 HydrophobicContact CZ2-CB 4.4Å; W489-V502 HydrophobicContact CZ2-CG1 3.91Å; W489-I503 HydrophobicContact CH2-CD1 3.59Å; W489-I503 HydrophobicContact CH2-CG1 3.44Å; W489-I503 VanDerWaalsContact CH2-CG1 3.44Å; W489-I503 HydrophobicContact CZ2-CG1 3.92Å; W489-I503 HydrophobicContact CZ3-CD1 4.21Å; W489-I503 HydrophobicContact CZ3-CG1 4.43Å
490	L	71.2	Confident	71.1	Confident	76 Å²	76	100.8 Å²	100.8	40%	0.398	45%	0.448	S	S	.	.	H	α-helix	trans	-61.5	-33.9	171.7	-74.4	171.7	0	0	0	112.7	L486 R487	L486-L490 WeakPolarHBondContact O-CB 3.29Å; L486-L490 WeakPolarHBondContact O-CG 3.46Å; L486-L490 PolarHBondContact O-N 3.38Å; R487-L490 PolarHBondContact O-N 2.85Å
491	V	62.9	Low	72.8	Confident	116 Å²	116	92.5 Å²	92.5	70%	0.703	42%	0.417	S	S	*	.	H	α-helix	trans	-72.4	-39.9	174	172.3	0	0	0	0	111.3	R487 L488 W489	R487-V491 WeakPolarHBondContact O-CG2 3.5Å; R487-V491 PolarHBondContact O-N 3.28Å; L488-V491 PolarHBondContact O-N 2.84Å; W489-V491 VanDerWaalsContact C-N 3.27Å; W489-V491 PolarHBondContact O-N 3.37Å
492	K	62.5	Low	73.7	Confident	162 Å²	162	91 Å²	91	70%	0.704	41%	0.406	S	S	*	.	H	α-helix	trans	-65.5	-39.8	-179.7	-170.1	176.3	-178.2	-179.8	0	112.2	L488 W489	L488-K492 WeakPolarHBondContact O-CB 3.25Å; L488-K492 PolarHBondContact O-N 2.9Å; W489-K492 PolarHBondContact O-N 2.71Å
493	Y	63.3	Low	74.8	Confident	63 Å²	63	86.2 Å²	86.2	25%	0.247	39%	0.393	C	S	.	.			trans	-104.6	75.8	177.7	-64.7	-74.6	0	0	0	110.9	W489 E495 V502	W489-Y493 AromaticContact CD1-CE2 3.88Å; W489-Y493 HydrophobicContact CD2-CD2 4.1Å; W489-Y493 AromaticContact CE2-CD2 3.65Å; W489-Y493 AromaticContact CE2-CE2 3.89Å; W489-Y493 HydrophobicContact CG-CD2 4.29Å; W489-Y493 HydrophobicContact CZ2-CD2 4.03Å; W489-Y493 HydrophobicContact CZ2-CE2 4.38Å; W489-Y493 AromaticContact NE1-CD2 3.62Å; W489-Y493 AromaticContact NE1-CE2 3.4Å; W489-Y493 PolarHBondContact O-N 2.91Å; Y493-E495 VanDerWaalsContact C-N 3.28Å; Y493-E495 PolarHBondContact O-N 2.87Å; Y493-V502 HydrophobicContact CD1-CG2 4.2Å; Y493-V502 HydrophobicContact CE1-CG2 3.68Å; Y493-V502 HydrophobicContact CE2-CG1 4.02Å
494	K	63.7	Low	75.9	Confident	192 Å²	192	81.9 Å²	81.9	84%	0.835	37%	0.371	S	S	*	.			trans	-62.9	-32	180	-171.7	176.6	-178.5	178.2	0	113.1
495	E	73.6	Confident	77	Confident	43 Å²	43	83.2 Å²	83.2	20%	0.201	37%	0.369	C	S	.	.			trans	-84.2	117.5	176.1	-63.7	-176.6	152.7	0	0	109.2	K367 Y493 S497 K498 R499	K367-E495 IonicContact NZ-OE1 3.49Å; K367-E495 PolarHBondContact NZ-OE1 2.96Å; Y493-E495 VanDerWaalsContact C-N 3.28Å; Y493-E495 PolarHBondContact O-N 2.87Å; E495-S497 PolarHBondContact O-N 2.97Å; E495-K498 HydrophobicContact CB-CB 4.33Å; E495-K498 HydrophobicContact CB-CD 4.45Å; E495-K498 HydrophobicContact CB-CG 4.37Å; E495-K498 PolarHBondContact O-N 3.15Å; E495-K498 VanDerWaalsContact OE2-CD 3.27Å; E495-K498 WeakPolarHBondContact OE2-CD 3.49Å; E495-K498 WeakPolarHBondContact OE2-CE 3.49Å; E495-K498 IonicContact OE2-NZ 2.77Å; E495-K498 PolarHBondContact OE2-NZ 3.08Å; E495-R499 WeakPolarHBondContact O-CB 3.35Å; E495-R499 PolarHBondContact O-N 2.61Å
496	R	77.8	Confident	77.9	Confident	146 Å²	146	80.8 Å²	80.8	55%	0.551	37%	0.368	S	S	*	.	H	α-helix	trans	-56.7	-39.7	174.7	-55.8	-178	174	179.6	-1.1	110.8	E363 R499 I500	E363-R496 VanDerWaalsContact OE1-CA 3.26Å; E363-R496 WeakPolarHBondContact OE1-CA 3.24Å; E363-R496 WeakPolarHBondContact OE1-CB 3.23Å; E363-R496 PolarHBondContact OE1-N 2.91Å; R496-R499 WeakPolarHBondContact O-CB 3.43Å; R496-R499 PolarHBondContact O-N 2.82Å; R496-I500 WeakPolarHBondContact O-CG1 3.33Å; R496-I500 PolarHBondContact O-N 2.88Å; R496-I500 VanDerWaalsContact O-N 3.16Å
497	S	80.1	Confident	78.9	Confident	0 Å²	0	81.4 Å²	81.4	0%	0	37%	0.374	C	S	.	.	H	α-helix	trans	-55.8	-56.7	177.6	52.7	0	0	0	0	111.9	K298 E363 E495 R499 I500 D501	K298-S497 WeakPolarHBondContact CD-OG 3.38Å; E363-S497 PolarHBondContact OE1-N 2.99Å; E363-S497 VanDerWaalsContact OE1-N 3.16Å; E363-S497 WeakPolarHBondContact OE2-CB 3.41Å; E363-S497 PolarHBondContact OE2-OG 3.38Å; E495-S497 PolarHBondContact O-N 2.97Å; S497-R499 PolarHBondContact O-N 3.38Å; S497-I500 PolarHBondContact O-N 3.49Å; S497-D501 PolarHBondContact O-N 2.76Å
498	K	82.8	Confident	79.9	Confident	98 Å²	98	74 Å²	74	43%	0.426	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-32.3	176.8	-71.1	-177.1	175.5	147.6	0	113.4	E495 I500 D501 V502	E495-K498 HydrophobicContact CB-CB 4.33Å; E495-K498 HydrophobicContact CB-CD 4.45Å; E495-K498 HydrophobicContact CB-CG 4.37Å; E495-K498 PolarHBondContact O-N 3.15Å; E495-K498 VanDerWaalsContact OE2-CD 3.27Å; E495-K498 WeakPolarHBondContact OE2-CD 3.49Å; E495-K498 WeakPolarHBondContact OE2-CE 3.49Å; E495-K498 IonicContact OE2-NZ 2.77Å; E495-K498 PolarHBondContact OE2-NZ 3.08Å; K498-I500 VanDerWaalsContact C-N 3.3Å; K498-I500 PolarHBondContact O-N 2.96Å; K498-D501 PolarHBondContact O-N 3.37Å; K498-V502 VanDerWaalsContact O-CG2 3.24Å; K498-V502 WeakPolarHBondContact O-CG2 3.46Å; K498-V502 PolarHBondContact O-N 3.05Å
499	R	84.5	Confident	81	Confident	65 Å²	65	72.4 Å²	72.4	25%	0.245	34%	0.341	C	S	.	.	H	α-helix	trans	-64.8	-36	179.5	-168.6	175.9	62.4	-154.2	0.2	112	W489 E495 R496 S497 I503	W489-R499 HydrophobicContact CE3-CG 4.47Å; W489-R499 HydrophobicContact CH2-CB 4.46Å; W489-R499 HydrophobicContact CH2-CG 3.14Å; W489-R499 HydrophobicContact CZ2-CG 4.05Å; W489-R499 HydrophobicContact CZ3-CG 3.42Å; W489-R499 VanDerWaalsContact CZ3-CG 3.42Å; E495-R499 WeakPolarHBondContact O-CB 3.35Å; E495-R499 PolarHBondContact O-N 2.61Å; R496-R499 WeakPolarHBondContact O-CB 3.43Å; R496-R499 PolarHBondContact O-N 2.82Å; S497-R499 PolarHBondContact O-N 3.38Å; R499-I503 HydrophobicContact CG-CD1 4.41Å; R499-I503 WeakPolarHBondContact O-CG1 3.26Å; R499-I503 PolarHBondContact O-N 2.93Å
500	I	87.4	Confident	82.2	Confident	49 Å²	49	75 Å²	75	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-65.6	-54.1	176.1	-62.2	162.8	0	0	0	109	E352 V356 A359 R496 S497 K498 V502 I503 S504	E352-I500 HydrophobicContact CG-CG2 4.12Å; E352-I500 WeakPolarHBondContact OE1-CG2 3.3Å; V356-I500 HydrophobicContact CG2-CB 3.9Å; V356-I500 HydrophobicContact CG2-CG2 3.76Å; A359-I500 HydrophobicContact CB-CD1 4.23Å; R496-I500 WeakPolarHBondContact O-CG1 3.33Å; R496-I500 PolarHBondContact O-N 2.88Å; R496-I500 VanDerWaalsContact O-N 3.16Å; S497-I500 PolarHBondContact O-N 3.49Å; K498-I500 VanDerWaalsContact C-N 3.3Å; K498-I500 PolarHBondContact O-N 2.96Å; I500-V502 PolarHBondContact O-N 2.86Å; I500-V502 VanDerWaalsContact O-N 3.14Å; I500-I503 PolarHBondContact O-N 3.36Å; I500-S504 PolarHBondContact O-N 3.13Å; I500-S504 PolarHBondContact O-OG 3.42Å
501	D	88	Confident	83.3	Confident	5 Å²	5	72.7 Å²	72.7	3%	0.027	35%	0.352	C	S	.	.	H	α-helix	trans	-50.6	-44.1	177.2	-74.4	-46.4	0	0	0	111.4	R304 E352 S497 K498 S504 R505	R304-D501 IonicContact CZ-OD1 2.73Å; R304-D501 IonicContact CZ-OD2 2.82Å; R304-D501 IonicContact NH1-OD1 2.93Å; R304-D501 PolarHBondContact NH1-OD1 2.76Å; R304-D501 IonicContact NH1-OD2 2.88Å; R304-D501 IonicContact NH2-OD1 3.82Å; R304-D501 PolarHBondContact NH2-OD1 3.05Å; R304-D501 IonicContact NH2-OD2 3.38Å; R304-D501 PolarHBondContact NH2-OD2 2.88Å; E352-D501 VanDerWaalsContact OE1-CA 3.3Å; E352-D501 WeakPolarHBondContact OE1-CA 3.4Å; E352-D501 PolarHBondContact OE1-N 2.86Å; S497-D501 PolarHBondContact O-N 2.76Å; K498-D501 PolarHBondContact O-N 3.37Å; D501-S504 PolarHBondContact O-N 3.27Å; D501-R505 VanDerWaalsContact O-CG 3.26Å; D501-R505 WeakPolarHBondContact O-CG 3.28Å; D501-R505 PolarHBondContact O-N 3.07Å
502	V	87.4	Confident	84.9	Confident	29 Å²	29	67.3 Å²	67.3	18%	0.176	32%	0.319	C	S	.	.	H	α-helix	trans	-68	-35.2	-178.9	173.9	0	0	0	0	113.2	W489 Y493 K498 I500	W489-V502 HydrophobicContact CZ2-CB 4.4Å; W489-V502 HydrophobicContact CZ2-CG1 3.91Å; Y493-V502 HydrophobicContact CD1-CG2 4.2Å; Y493-V502 HydrophobicContact CE1-CG2 3.68Å; Y493-V502 HydrophobicContact CE2-CG1 4.02Å; K498-V502 VanDerWaalsContact O-CG2 3.24Å; K498-V502 WeakPolarHBondContact O-CG2 3.46Å; K498-V502 PolarHBondContact O-N 3.05Å; I500-V502 PolarHBondContact O-N 2.86Å; I500-V502 VanDerWaalsContact O-N 3.14Å
503	I	89.8	Confident	86.4	Confident	79 Å²	79	66.3 Å²	66.3	41%	0.405	32%	0.315	S	S	.	.	H	α-helix	trans	-68.6	-45.9	173.8	-69.1	165.3	0	0	0	109.4	W489 R499 I500 R505 L506 V507	W489-I503 HydrophobicContact CH2-CD1 3.59Å; W489-I503 HydrophobicContact CH2-CG1 3.44Å; W489-I503 VanDerWaalsContact CH2-CG1 3.44Å; W489-I503 HydrophobicContact CZ2-CG1 3.92Å; W489-I503 HydrophobicContact CZ3-CD1 4.21Å; W489-I503 HydrophobicContact CZ3-CG1 4.43Å; R499-I503 HydrophobicContact CG-CD1 4.41Å; R499-I503 WeakPolarHBondContact O-CG1 3.26Å; R499-I503 PolarHBondContact O-N 2.93Å; I500-I503 PolarHBondContact O-N 3.36Å; I503-R505 PolarHBondContact O-N 3.03Å; I503-L506 PolarHBondContact O-N 3.35Å; I503-V507 HydrophobicContact CG2-CG2 3.61Å; I503-V507 WeakPolarHBondContact O-CG2 3.45Å; I503-V507 PolarHBondContact O-N 2.86Å
504	S	91.9	Very high	88	Confident	8 Å²	8	70.3 Å²	70.3	6%	0.056	33%	0.334	C	S	.	.	H	α-helix	trans	-58.2	-37.5	-178.3	-52.9	0	0	0	0	112	E352 I500 D501 L506 V507 F508	E352-S504 WeakPolarHBondContact CG-OG 3.44Å; E352-S504 PolarHBondContact OE1-OG 3.44Å; E352-S504 VanDerWaalsContact OE1-OG 3.05Å; I500-S504 PolarHBondContact O-N 3.13Å; I500-S504 PolarHBondContact O-OG 3.42Å; D501-S504 PolarHBondContact O-N 3.27Å; S504-L506 PolarHBondContact O-N 2.93Å; S504-L506 VanDerWaalsContact O-N 3.1Å; S504-V507 PolarHBondContact O-N 2.83Å; S504-F508 WeakPolarHBondContact O-CB 3.3Å; S504-F508 WeakPolarHBondContact O-CD2 3.43Å; S504-F508 PolarHBondContact O-N 3.19Å; S504-F508 VanDerWaalsContact O-N 3.15Å
505	R	92.5	Very high	89.5	Confident	85 Å²	85	62.3 Å²	62.3	32%	0.321	30%	0.299	S	S	.	.	H	α-helix	trans	-56.5	-23.4	173.9	-73.7	171.2	-161.8	-175.1	2	114.6	F294 D501 I503 P509	F294-R505 HydrophobicContact CB-CG 3.76Å; F294-R505 VanDerWaalsContact O-CZ 3.28Å; F294-R505 PolarHBondContact O-NE 3.15Å; F294-R505 PolarHBondContact O-NH2 2.84Å; D501-R505 VanDerWaalsContact O-CG 3.26Å; D501-R505 WeakPolarHBondContact O-CG 3.28Å; D501-R505 PolarHBondContact O-N 3.07Å; I503-R505 PolarHBondContact O-N 3.03Å; R505-P509 WeakPolarHBondContact O-CD 3.3Å; R505-P509 WeakPolarHBondContact O-CG 3.36Å
506	L	91.3	Very high	90.5	Very high	110 Å²	110	61.3 Å²	61.3	58%	0.576	30%	0.295	S	S	*	.	H	α-helix	trans	-104.6	-44.1	178.9	-173.8	123.2	0	0	0	111.7	I503 S504 I510	I503-L506 PolarHBondContact O-N 3.35Å; S504-L506 PolarHBondContact O-N 2.93Å; S504-L506 VanDerWaalsContact O-N 3.1Å; L506-I510 HydrophobicContact CD1-CD1 4.16Å; L506-I510 HydrophobicContact CD2-CD1 3.59Å; L506-I510 HydrophobicContact CG-CD1 3.53Å; L506-I510 HydrophobicContact CG-CG1 4.44Å; L506-I510 WeakPolarHBondContact O-CB 3.38Å; L506-I510 VanDerWaalsContact O-CG1 3.23Å; L506-I510 WeakPolarHBondContact O-CG1 3.42Å; L506-I510 PolarHBondContact O-N 3.44Å
507	V	92.9	Very high	91.3	Very high	81 Å²	81	57.1 Å²	57.1	49%	0.491	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-44.7	-174.4	173.3	0	0	0	0	111.8	I503 S504 G511	I503-V507 HydrophobicContact CG2-CG2 3.61Å; I503-V507 WeakPolarHBondContact O-CG2 3.45Å; I503-V507 PolarHBondContact O-N 2.86Å; S504-V507 PolarHBondContact O-N 2.83Å; V507-G511 PolarHBondContact O-N 2.97Å
508	F	94	Very high	92	Very high	31 Å²	31	60.3 Å²	60.3	14%	0.136	31%	0.307	C	S	.	.	H	α-helix	trans	-66.2	-51	-176.9	-81.3	-107.1	0	0	0	112.2	F294 F345 G348 A349 S504 I510 G511 F512	F294-F508 HydrophobicContact CE2-CB 3.85Å; F294-F508 HydrophobicContact CE2-CD1 4.31Å; F294-F508 AromaticContact CE2-CD2 4Å; F294-F508 HydrophobicContact CE2-CD2 4Å; F294-F508 AromaticContact CE2-CG 3.81Å; F294-F508 HydrophobicContact CE2-CG 3.81Å; F294-F508 HydrophobicContact CZ-CB 4.26Å; F294-F508 AromaticContact CZ-CD1 3.9Å; F294-F508 HydrophobicContact CZ-CD1 3.9Å; F294-F508 AromaticContact CZ-CD2 3.7Å; F294-F508 HydrophobicContact CZ-CD2 3.7Å; F294-F508 HydrophobicContact CZ-CE1 4.16Å; F294-F508 AromaticContact CZ-CE2 3.94Å; F294-F508 HydrophobicContact CZ-CE2 3.94Å; F294-F508 AromaticContact CZ-CG 3.69Å; F294-F508 HydrophobicContact CZ-CG 3.69Å; F294-F508 HydrophobicContact CZ-CZ 4.17Å; F345-F508 AromaticContact CD1-CD1 3.83Å; F345-F508 HydrophobicContact CD1-CD1 3.83Å; F345-F508 HydrophobicContact CD1-CE1 4.43Å; F345-F508 WeakPolarHBondContact O-CE1 3.36Å; G348-F508 VanDerWaalsContact C-CZ 3.49Å; A349-F508 HydrophobicContact CB-CE1 4.34Å; S504-F508 WeakPolarHBondContact O-CB 3.3Å; S504-F508 WeakPolarHBondContact O-CD2 3.43Å; S504-F508 PolarHBondContact O-N 3.19Å; S504-F508 VanDerWaalsContact O-N 3.15Å; F508-I510 PolarHBondContact O-N 3.31Å; F508-G511 PolarHBondContact O-N 3.06Å; F508-F512 WeakPolarHBondContact O-CB 3.27Å; F508-F512 PolarHBondContact O-N 3.13Å
509	P	94	Very high	92.6	Very high	37 Å²	37	55.8 Å²	55.8	24%	0.24	29%	0.287	C	S	.	.	H	α-helix	trans	-62.7	-41.1	177.7	-25.3	35.8	0	0	0	114.1	W291 R505 F512 F513	W291-P509 HydrophobicContact CD2-CG 4Å; W291-P509 HydrophobicContact CE3-CB 4.22Å; W291-P509 HydrophobicContact CE3-CG 3.72Å; W291-P509 VanDerWaalsContact CH2-CA 3.5Å; W291-P509 HydrophobicContact CH2-CB 3.72Å; W291-P509 HydrophobicContact CH2-CG 4.04Å; W291-P509 HydrophobicContact CZ2-CB 4.26Å; W291-P509 HydrophobicContact CZ2-CG 4.3Å; W291-P509 HydrophobicContact CZ3-CB 3.7Å; W291-P509 HydrophobicContact CZ3-CG 3.73Å; R505-P509 WeakPolarHBondContact O-CD 3.3Å; R505-P509 WeakPolarHBondContact O-CG 3.36Å; P509-F512 PolarHBondContact O-N 3.24Å; P509-F513 WeakPolarHBondContact O-CB 3.44Å; P509-F513 PolarHBondContact O-N 3.4Å
510	I	94.2	Very high	93	Very high	99 Å²	99	55.9 Å²	55.9	51%	0.508	29%	0.287	S	S	.	.	H	α-helix	trans	-65.7	-44.3	178.3	-68.5	177.9	0	0	0	110.7	L506 F508 F512 F513 F514	L506-I510 HydrophobicContact CD1-CD1 4.16Å; L506-I510 HydrophobicContact CD2-CD1 3.59Å; L506-I510 HydrophobicContact CG-CD1 3.53Å; L506-I510 HydrophobicContact CG-CG1 4.44Å; L506-I510 WeakPolarHBondContact O-CB 3.38Å; L506-I510 VanDerWaalsContact O-CG1 3.23Å; L506-I510 WeakPolarHBondContact O-CG1 3.42Å; L506-I510 PolarHBondContact O-N 3.44Å; F508-I510 PolarHBondContact O-N 3.31Å; I510-F512 VanDerWaalsContact C-N 3.34Å; I510-F512 PolarHBondContact O-N 3.41Å; I510-F513 PolarHBondContact O-N 3.38Å; I510-F514 PolarHBondContact O-N 2.84Å
511	G	95.2	Very high	93.2	Very high	28 Å²	28	58.2 Å²	58.2	29%	0.289	30%	0.304	S	S	.	.	H	α-helix	trans	-60.8	-44	177.3	0	0	0	0	0	112	V507 F508 F514 F515	V507-G511 PolarHBondContact O-N 2.97Å; F508-G511 PolarHBondContact O-N 3.06Å; G511-F514 PolarHBondContact O-N 3.15Å; G511-F515 PolarHBondContact O-N 3.01Å
512	F	95.6	Very high	93.4	Very high	3 Å²	3	60.7 Å²	60.7	1%	0.013	33%	0.326	C	S	.	.	H	α-helix	trans	-69.9	-35.7	179.3	-169.8	-117.6	0	0	0	112.6	F284 V287 W291 F345 F508 P509 I510 F515 N516	F284-F512 HydrophobicContact CD2-CD1 4.46Å; F284-F512 AromaticContact CD2-CE1 3.39Å; F284-F512 HydrophobicContact CD2-CE1 3.39Å; F284-F512 AromaticContact CD2-CZ 3.94Å; F284-F512 HydrophobicContact CD2-CZ 3.94Å; F284-F512 HydrophobicContact CE2-CD1 4.18Å; F284-F512 AromaticContact CE2-CE1 3.51Å; F284-F512 HydrophobicContact CE2-CE1 3.51Å; F284-F512 HydrophobicContact CE2-CZ 4.45Å; F284-F512 HydrophobicContact CG-CE1 4.21Å; F284-F512 HydrophobicContact CZ-CE1 4.41Å; V287-F512 HydrophobicContact CB-CE1 4.24Å; V287-F512 HydrophobicContact CB-CE2 4.36Å; V287-F512 HydrophobicContact CB-CZ 4.04Å; V287-F512 HydrophobicContact CG1-CD1 4.06Å; V287-F512 HydrophobicContact CG1-CD2 4.01Å; V287-F512 HydrophobicContact CG1-CE1 4Å; V287-F512 HydrophobicContact CG1-CE2 4.01Å; V287-F512 HydrophobicContact CG1-CG 4.05Å; V287-F512 HydrophobicContact CG1-CZ 4Å; V287-F512 HydrophobicContact CG2-CE2 4.11Å; V287-F512 HydrophobicContact CG2-CZ 4.06Å; W291-F512 HydrophobicContact CH2-CB 4.33Å; W291-F512 HydrophobicContact CH2-CD1 4.03Å; W291-F512 HydrophobicContact CZ2-CB 3.78Å; W291-F512 AromaticContact CZ2-CD1 3.87Å; W291-F512 HydrophobicContact CZ2-CD1 3.87Å; W291-F512 HydrophobicContact CZ2-CG 4.08Å; F345-F512 HydrophobicContact CD1-CB 4.4Å; F345-F512 AromaticContact CD2-CD2 3.73Å; F345-F512 HydrophobicContact CD2-CD2 3.73Å; F345-F512 HydrophobicContact CD2-CE2 4.44Å; F345-F512 HydrophobicContact CE1-CB 4.01Å; F345-F512 HydrophobicContact CE2-CB 4.29Å; F345-F512 AromaticContact CE2-CD2 3.79Å; F345-F512 HydrophobicContact CE2-CD2 3.79Å; F345-F512 HydrophobicContact CG-CD2 4.24Å; F345-F512 HydrophobicContact CZ-CB 3.97Å; F345-F512 HydrophobicContact CZ-CD2 4.33Å; F508-F512 WeakPolarHBondContact O-CB 3.27Å; F508-F512 PolarHBondContact O-N 3.13Å; P509-F512 PolarHBondContact O-N 3.24Å; I510-F512 VanDerWaalsContact C-N 3.34Å; I510-F512 PolarHBondContact O-N 3.41Å; F512-F515 AromaticContact CD2-CD1 3.89Å; F512-F515 HydrophobicContact CD2-CD1 3.89Å; F512-F515 AromaticContact CE2-CD1 3.84Å; F512-F515 HydrophobicContact CE2-CD1 3.84Å; F512-F515 HydrophobicContact CE2-CE1 4.13Å; F512-F515 PolarHBondContact O-N 3.28Å; F512-N516 WeakPolarHBondContact CD1-ND2 3.43Å; F512-N516 VanDerWaalsContact CE1-ND2 3.31Å; F512-N516 WeakPolarHBondContact CE1-ND2 3.32Å; F512-N516 WeakPolarHBondContact CZ-ND2 3.35Å; F512-N516 PolarHBondContact O-N 3.27Å; F512-N516 PolarHBondContact O-ND2 3.07Å
513	F	95.1	Very high	93.5	Very high	142 Å²	142	61.8 Å²	61.8	62%	0.623	33%	0.327	S	S	*	.	H	α-helix	trans	-61.7	-48	172.8	176.7	-97.8	0	0	0	111.6	P509 I510 F515 N516 C517	P509-F513 WeakPolarHBondContact O-CB 3.44Å; P509-F513 PolarHBondContact O-N 3.4Å; I510-F513 PolarHBondContact O-N 3.38Å; F513-F515 VanDerWaalsContact C-N 3.32Å; F513-F515 PolarHBondContact O-N 3.4Å; F513-N516 PolarHBondContact O-N 3.1Å; F513-C517 PolarHBondContact O-N 2.88Å; F513-C517 PolarHBondContact O-SG 2.98Å; F513-C517 VanDerWaalsContact O-SG 3.4Å
514	F	95.5	Very high	93.1	Very high	147 Å²	147	62.8 Å²	62.8	65%	0.645	33%	0.332	S	S	*	.	H	α-helix	trans	-60	-44	176.8	-178.8	-98.9	0	0	0	111.6	I510 G511 N516 C517 V518	I510-F514 PolarHBondContact O-N 2.84Å; G511-F514 PolarHBondContact O-N 3.15Å; F514-N516 PolarHBondContact O-N 3.32Å; F514-C517 PolarHBondContact O-N 2.79Å; F514-V518 HydrophobicContact CD1-CG2 4.17Å; F514-V518 HydrophobicContact CE1-CG2 3.72Å; F514-V518 HydrophobicContact CE2-CG2 4.24Å; F514-V518 HydrophobicContact CZ-CG2 3.76Å; F514-V518 WeakPolarHBondContact O-CG2 3.47Å; F514-V518 PolarHBondContact O-N 2.98Å
515	F	95.5	Very high	91.6	Very high	24 Å²	24	70.1 Å²	70.1	11%	0.105	38%	0.376	C	S	.	.	H	α-helix	trans	-56.3	-48.3	173.6	163.7	-110.9	0	0	0	112.1	W338 I341 G511 F512 F513 C517 V518 Y519	W338-F515 HydrophobicContact CD2-CE1 4.35Å; W338-F515 HydrophobicContact CD2-CZ 4.43Å; W338-F515 AromaticContact CE3-CE1 3.63Å; W338-F515 HydrophobicContact CE3-CE1 3.63Å; W338-F515 AromaticContact CE3-CZ 3.69Å; W338-F515 HydrophobicContact CE3-CZ 3.69Å; W338-F515 AromaticContact CZ3-CE1 3.75Å; W338-F515 HydrophobicContact CZ3-CE1 3.75Å; W338-F515 HydrophobicContact CZ3-CZ 4.2Å; I341-F515 HydrophobicContact CB-CD2 4.38Å; I341-F515 HydrophobicContact CB-CE1 4.21Å; I341-F515 HydrophobicContact CB-CE2 4.01Å; I341-F515 HydrophobicContact CB-CZ 3.9Å; I341-F515 HydrophobicContact CD1-CD2 3.54Å; I341-F515 HydrophobicContact CD1-CE2 3.16Å; I341-F515 HydrophobicContact CD1-CZ 3.89Å; I341-F515 HydrophobicContact CG1-CD2 4.49Å; I341-F515 HydrophobicContact CG1-CE2 4.14Å; I341-F515 HydrophobicContact CG1-CZ 4.48Å; I341-F515 HydrophobicContact CG2-CD1 3.69Å; I341-F515 HydrophobicContact CG2-CD2 3.77Å; I341-F515 HydrophobicContact CG2-CE1 3.77Å; I341-F515 HydrophobicContact CG2-CE2 3.88Å; I341-F515 HydrophobicContact CG2-CG 3.68Å; I341-F515 HydrophobicContact CG2-CZ 3.86Å; G511-F515 PolarHBondContact O-N 3.01Å; F512-F515 AromaticContact CD2-CD1 3.89Å; F512-F515 HydrophobicContact CD2-CD1 3.89Å; F512-F515 AromaticContact CE2-CD1 3.84Å; F512-F515 HydrophobicContact CE2-CD1 3.84Å; F512-F515 HydrophobicContact CE2-CE1 4.13Å; F512-F515 PolarHBondContact O-N 3.28Å; F513-F515 VanDerWaalsContact C-N 3.32Å; F513-F515 PolarHBondContact O-N 3.4Å; F515-C517 VanDerWaalsContact C-N 3.35Å; F515-C517 PolarHBondContact O-N 3.1Å; F515-V518 PolarHBondContact O-N 2.96Å; F515-Y519 AromaticContact CE2-CD2 3.88Å; F515-Y519 HydrophobicContact CE2-CD2 3.88Å; F515-Y519 HydrophobicContact CE2-CG 4.19Å; F515-Y519 AromaticContact CZ-CD2 3.79Å; F515-Y519 HydrophobicContact CZ-CD2 3.79Å; F515-Y519 HydrophobicContact CZ-CG 4.01Å; F515-Y519 VanDerWaalsContact O-CB 3.25Å; F515-Y519 WeakPolarHBondContact O-CB 3.27Å; F515-Y519 PolarHBondContact O-N 2.97Å
516	N	95	Very high	91.5	Very high	22 Å²	22	69.4 Å²	69.4	12%	0.118	38%	0.379	C	S	.	.	H	α-helix	trans	-58.4	-47.1	178.4	-88.1	-92.7	0	0	0	111.5	W338 F512 F513 F514 V518 Y519 W520	W338-N516 WeakPolarHBondContact CH2-OD1 3.22Å; W338-N516 WeakPolarHBondContact CZ3-OD1 3.32Å; F512-N516 WeakPolarHBondContact CD1-ND2 3.43Å; F512-N516 VanDerWaalsContact CE1-ND2 3.31Å; F512-N516 WeakPolarHBondContact CE1-ND2 3.32Å; F512-N516 WeakPolarHBondContact CZ-ND2 3.35Å; F512-N516 PolarHBondContact O-N 3.27Å; F512-N516 PolarHBondContact O-ND2 3.07Å; F513-N516 PolarHBondContact O-N 3.1Å; F514-N516 PolarHBondContact O-N 3.32Å; N516-V518 PolarHBondContact O-N 2.86Å; N516-Y519 PolarHBondContact O-N 2.76Å; N516-W520 PolarHBondContact O-N 3.44Å
517	C	94.3	Very high	91.5	Very high	57 Å²	57	67.2 Å²	67.2	39%	0.385	37%	0.369	S	S	.	.	H	α-helix	trans	-56	-51	176.9	-68.3	0	0	0	0	111.2	F513 F514 F515 T521	F513-C517 PolarHBondContact O-N 2.88Å; F513-C517 PolarHBondContact O-SG 2.98Å; F513-C517 VanDerWaalsContact O-SG 3.4Å; F514-C517 PolarHBondContact O-N 2.79Å; F515-C517 VanDerWaalsContact C-N 3.35Å; F515-C517 PolarHBondContact O-N 3.1Å; C517-T521 WeakPolarHBondContact O-CB 3.26Å; C517-T521 VanDerWaalsContact O-CG2 3.23Å; C517-T521 WeakPolarHBondContact O-CG2 3.33Å; C517-T521 PolarHBondContact O-N 2.76Å; C517-T521 VanDerWaalsContact O-N 3.09Å; C517-T521 PolarHBondContact O-OG1 3.28Å
518	V	95	Very high	91.5	Very high	67 Å²	67	66.4 Å²	66.4	41%	0.406	36%	0.362	S	S	.	.	H	α-helix	trans	-61.9	-48.5	179.7	174.1	0	0	0	0	111.2	F514 F515 N516 W520 T521 A522	F514-V518 HydrophobicContact CD1-CG2 4.17Å; F514-V518 HydrophobicContact CE1-CG2 3.72Å; F514-V518 HydrophobicContact CE2-CG2 4.24Å; F514-V518 HydrophobicContact CZ-CG2 3.76Å; F514-V518 WeakPolarHBondContact O-CG2 3.47Å; F514-V518 PolarHBondContact O-N 2.98Å; F515-V518 PolarHBondContact O-N 2.96Å; N516-V518 PolarHBondContact O-N 2.86Å; V518-W520 PolarHBondContact O-N 3.19Å; V518-T521 WeakPolarHBondContact CA-OG1 3.15Å; V518-T521 PolarHBondContact O-N 3.23Å; V518-T521 PolarHBondContact O-OG1 3.48Å; V518-A522 VanDerWaalsContact O-CB 3.3Å; V518-A522 WeakPolarHBondContact O-CB 3.35Å; V518-A522 PolarHBondContact O-N 2.9Å
519	Y	95	Very high	91.3	Very high	3 Å²	3	68.5 Å²	68.5	1%	0.012	38%	0.375	C	S	.	.	H	α-helix	trans	-57.5	-53.7	-177.3	-177.5	-91.3	0	0	0	111.9	Y280 A334 W338 F515 N516 T521 A522 Y523	Y280-Y519 AromaticContact CE1-CE1 3.65Å; Y280-Y519 HydrophobicContact CE1-CE1 3.65Å; Y280-Y519 AromaticContact CE1-CZ 3.96Å; Y280-Y519 PolarHBondContact OH-OH 3.39Å; A334-Y519 VanDerWaalsContact O-CE2 3.31Å; A334-Y519 WeakPolarHBondContact O-CE2 3.42Å; A334-Y519 PolarHBondContact O-OH 3.42Å; W338-Y519 HydrophobicContact CB-CE2 3.76Å; W338-Y519 HydrophobicContact CD2-CE1 4.4Å; W338-Y519 AromaticContact CE3-CD1 3.56Å; W338-Y519 HydrophobicContact CE3-CD1 3.56Å; W338-Y519 HydrophobicContact CE3-CD2 4.12Å; W338-Y519 AromaticContact CE3-CE1 3.64Å; W338-Y519 HydrophobicContact CE3-CE1 3.64Å; W338-Y519 HydrophobicContact CE3-CE2 4.19Å; W338-Y519 AromaticContact CE3-CG 3.82Å; W338-Y519 HydrophobicContact CE3-CG 3.82Å; W338-Y519 AromaticContact CE3-CZ 3.96Å; W338-Y519 AromaticContact CZ3-CD1 3.87Å; W338-Y519 HydrophobicContact CZ3-CD1 3.87Å; W338-Y519 HydrophobicContact CZ3-CE1 4.26Å; W338-Y519 HydrophobicContact CZ3-CG 4.24Å; F515-Y519 AromaticContact CE2-CD2 3.88Å; F515-Y519 HydrophobicContact CE2-CD2 3.88Å; F515-Y519 HydrophobicContact CE2-CG 4.19Å; F515-Y519 AromaticContact CZ-CD2 3.79Å; F515-Y519 HydrophobicContact CZ-CD2 3.79Å; F515-Y519 HydrophobicContact CZ-CG 4.01Å; F515-Y519 VanDerWaalsContact O-CB 3.25Å; F515-Y519 WeakPolarHBondContact O-CB 3.27Å; F515-Y519 PolarHBondContact O-N 2.97Å; N516-Y519 PolarHBondContact O-N 2.76Å; Y519-T521 VanDerWaalsContact C-N 3.33Å; Y519-T521 PolarHBondContact O-N 2.77Å; Y519-A522 PolarHBondContact O-N 3.04Å; Y519-Y523 HydrophobicContact CD1-CD2 4.41Å; Y519-Y523 AromaticContact CD2-CD2 3.53Å; Y519-Y523 HydrophobicContact CD2-CD2 3.53Å; Y519-Y523 AromaticContact CD2-CE2 3.64Å; Y519-Y523 HydrophobicContact CD2-CE2 3.64Å; Y519-Y523 HydrophobicContact CE1-CD2 4.35Å; Y519-Y523 AromaticContact CE2-CD2 3.45Å; Y519-Y523 HydrophobicContact CE2-CD2 3.45Å; Y519-Y523 VanDerWaalsContact CE2-CD2 3.45Å; Y519-Y523 AromaticContact CE2-CE2 3.57Å; Y519-Y523 HydrophobicContact CE2-CE2 3.57Å; Y519-Y523 HydrophobicContact CE2-CG 4.41Å; Y519-Y523 HydrophobicContact CG-CD2 4.02Å; Y519-Y523 AromaticContact CZ-CD2 3.89Å; Y519-Y523 WeakPolarHBondContact O-CD2 3.37Å; Y519-Y523 PolarHBondContact O-N 2.94Å
520	W	93.5	Very high	91.1	Very high	67 Å²	67	70.5 Å²	70.5	25%	0.254	38%	0.384	S	S	.	.	H	α-helix	trans	-68.3	-33.4	-178.1	-68.9	110.4	0	0	0	111.9	L198 Y280 W338 N516 V518 A522 L524	L198-W520 HydrophobicContact CD1-CZ3 4.42Å; Y280-W520 AromaticContact CD1-CH2 3.92Å; Y280-W520 HydrophobicContact CD1-CH2 3.92Å; Y280-W520 AromaticContact CD1-CZ2 3.75Å; Y280-W520 HydrophobicContact CD1-CZ2 3.75Å; Y280-W520 HydrophobicContact CD2-CH2 4.32Å; Y280-W520 HydrophobicContact CE1-CH2 4.04Å; Y280-W520 HydrophobicContact CE1-CZ2 4.12Å; Y280-W520 HydrophobicContact CE2-CH2 4.4Å; Y280-W520 HydrophobicContact CG-CH2 4.07Å; Y280-W520 HydrophobicContact CG-CZ2 4.15Å; W338-W520 AromaticContact CZ3-NE1 3.91Å; N516-W520 PolarHBondContact O-N 3.44Å; V518-W520 PolarHBondContact O-N 3.19Å; W520-A522 VanDerWaalsContact C-N 3.35Å; W520-L524 HydrophobicContact CE3-CD1 3.69Å; W520-L524 HydrophobicContact CZ3-CD1 4.05Å; W520-L524 WeakPolarHBondContact O-CB 3.36Å; W520-L524 PolarHBondContact O-N 3.19Å; W520-L524 VanDerWaalsContact O-N 3.16Å
521	T	92.1	Very high	90.9	Very high	99 Å²	99	68.6 Å²	68.6	61%	0.607	38%	0.375	S	S	*	.	H	α-helix	trans	-69.9	-30.3	173.8	56.4	0	0	0	0	113.7	C517 V518 Y519 V525	C517-T521 WeakPolarHBondContact O-CB 3.26Å; C517-T521 VanDerWaalsContact O-CG2 3.23Å; C517-T521 WeakPolarHBondContact O-CG2 3.33Å; C517-T521 PolarHBondContact O-N 2.76Å; C517-T521 VanDerWaalsContact O-N 3.09Å; C517-T521 PolarHBondContact O-OG1 3.28Å; V518-T521 WeakPolarHBondContact CA-OG1 3.15Å; V518-T521 PolarHBondContact O-N 3.23Å; V518-T521 PolarHBondContact O-OG1 3.48Å; Y519-T521 VanDerWaalsContact C-N 3.33Å; Y519-T521 PolarHBondContact O-N 2.77Å; T521-V525 WeakPolarHBondContact O-CG2 3.33Å
522	A	91.8	Very high	90.6	Very high	57 Å²	57	71.5 Å²	71.5	47%	0.471	38%	0.382	S	S	.	.	H	α-helix	trans	-82.4	-36.9	-177.9	0	0	0	0	0	112.6	V518 Y519 W520	V518-A522 VanDerWaalsContact O-CB 3.3Å; V518-A522 WeakPolarHBondContact O-CB 3.35Å; V518-A522 PolarHBondContact O-N 2.9Å; Y519-A522 PolarHBondContact O-N 3.04Å; W520-A522 VanDerWaalsContact C-N 3.35Å
523	Y	90.3	Very high	90.3	Very high	52 Å²	52	76.8 Å²	76.8	20%	0.204	41%	0.41	C	S	.	.	H	α-helix	trans	-106.5	-12.7	-170.5	-68	-71.2	0	0	0	115.4	Y195 L198 A334 Y519	Y195-Y523 AromaticContact CD1-CD1 3.76Å; Y195-Y523 HydrophobicContact CD1-CD1 3.76Å; Y195-Y523 HydrophobicContact CD1-CE1 4.35Å; Y195-Y523 AromaticContact CE1-CD1 3.99Å; Y195-Y523 HydrophobicContact CE1-CD1 3.99Å; Y195-Y523 HydrophobicContact CE1-CE1 4.35Å; L198-Y523 WeakPolarHBondContact CD1-O 3.4Å; A334-Y523 HydrophobicContact CB-CD1 3.4Å; A334-Y523 HydrophobicContact CB-CD2 4.4Å; A334-Y523 HydrophobicContact CB-CE1 3.45Å; A334-Y523 VanDerWaalsContact CB-CE1 3.45Å; A334-Y523 HydrophobicContact CB-CE2 4.44Å; A334-Y523 HydrophobicContact CB-CG 3.91Å; Y519-Y523 HydrophobicContact CD1-CD2 4.41Å; Y519-Y523 AromaticContact CD2-CD2 3.53Å; Y519-Y523 HydrophobicContact CD2-CD2 3.53Å; Y519-Y523 AromaticContact CD2-CE2 3.64Å; Y519-Y523 HydrophobicContact CD2-CE2 3.64Å; Y519-Y523 HydrophobicContact CE1-CD2 4.35Å; Y519-Y523 AromaticContact CE2-CD2 3.45Å; Y519-Y523 HydrophobicContact CE2-CD2 3.45Å; Y519-Y523 VanDerWaalsContact CE2-CD2 3.45Å; Y519-Y523 AromaticContact CE2-CE2 3.57Å; Y519-Y523 HydrophobicContact CE2-CE2 3.57Å; Y519-Y523 HydrophobicContact CE2-CG 4.41Å; Y519-Y523 HydrophobicContact CG-CD2 4.02Å; Y519-Y523 AromaticContact CZ-CD2 3.89Å; Y519-Y523 WeakPolarHBondContact O-CD2 3.37Å; Y519-Y523 PolarHBondContact O-N 2.94Å
524	L	80.8	Confident	89.8	Confident	99 Å²	99	71.3 Å²	71.3	52%	0.518	39%	0.392	S	S	.	.			trans	-91.8	-8.8	-178.7	-163.6	134.5	0	0	0	113.8	W520	W520-L524 HydrophobicContact CE3-CD1 3.69Å; W520-L524 HydrophobicContact CZ3-CD1 4.05Å; W520-L524 WeakPolarHBondContact O-CB 3.36Å; W520-L524 PolarHBondContact O-N 3.19Å; W520-L524 VanDerWaalsContact O-N 3.16Å
525	V	59.3	Low	89.3	Confident	162 Å²	162	64.5 Å²	64.5	98%	0.982	37%	0.369	S	S	*	.			trans	-76.8	0	174.3	-177.8	0	0	0	0	109.4	T521	T521-V525 WeakPolarHBondContact O-CG2 3.33Å

Retrieved 525 of 525 residues in 308.6 ms (Link to these results)

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