A0A087X7G8_POEFO Loading...

Gamma-aminobutyric acid receptor subunit delta

AlphaFold DB , UniProt , Accession A0A087X7G8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 461 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	41.2	Very low	34.9	Very low	216 Å²	216	157.5 Å²	157.5	100%	1.064	86%	0.855	S	S	*	*				0	63.5	0	-54.7	-160.2	-51.4	0	0	109.3
2	E	29	Very low	34.6	Very low	177 Å²	177	152.7 Å²	152.7	83%	0.827	85%	0.852	S	S	*	*			cis	59.7	106.4	47.4	-68.4	162.2	129.7	0	0	110.7
3	V	34	Very low	34.6	Very low	132 Å²	132	151.1 Å²	151.1	80%	0.8	85%	0.848	S	S	*	*				80	91	78.3	169.2	0	0	0	0	110
4	Q	34.1	Very low	34.4	Very low	191 Å²	191	150.1 Å²	150.1	89%	0.893	84%	0.838	S	S	*	*			trans	-174.7	61.5	152.6	-110.4	173.8	-4.5	0	0	113.7
5	T	38.8	Very low	34.2	Very low	141 Å²	141	152.9 Å²	152.9	87%	0.865	84%	0.839	S	S	*	*	S	Bend	trans	-148	3.4	167.9	22.5	0	0	0	0	115.6
6	F	33.1	Very low	34	Very low	197 Å²	197	157.4 Å²	157.4	86%	0.864	85%	0.848	S	S	*	*	S	Bend	trans	-109.6	22.2	-172.6	-105.6	-78.4	0	0	0	115.3
7	L	33.3	Very low	34.1	Very low	167 Å²	167	153.1 Å²	153.1	87%	0.874	85%	0.849	S	S	*	*	S	Bend	trans	-130.3	20.9	-171.5	-94.5	170.1	0	0	0	116
8	L	34	Very low	34.1	Very low	176 Å²	176	148.2 Å²	148.2	92%	0.921	84%	0.84	S	S	*	*	S	Bend	trans	-127.4	6.9	179.9	-90.1	164.9	0	0	0	116.1
9	S	36.1	Very low	34	Very low	111 Å²	111	149.2 Å²	149.2	78%	0.776	84%	0.842	S	S	*	*	S	Bend	trans	-99.5	0.4	172.9	56.5	0	0	0	0	114.5
10	G	37.3	Very low	33.8	Very low	67 Å²	67	149.8 Å²	149.8	69%	0.691	84%	0.842	S	S	*	*	S	Bend	trans	-104.3	2.9	-169.9	0	0	0	0	0	117.1
11	L	33	Very low	33.7	Very low	158 Å²	158	151.5 Å²	151.5	83%	0.827	84%	0.84	S	S	*	*	S	Bend	trans	-131.8	10.4	-167.7	-105	161.2	0	0	0	115.7
12	A	31.3	Very low	33.1	Very low	99 Å²	99	147.1 Å²	147.1	82%	0.818	83%	0.831	S	S	*	*	S	Bend	trans	-96.2	18.5	178.3	0	0	0	0	0	114.2
13	V	34.8	Very low	33.1	Very low	132 Å²	132	148.9 Å²	148.9	80%	0.8	83%	0.83	S	S	*	*	S	Bend	trans	-105.4	-1.8	-170.2	178	0	0	0	0	113.5
14	L	32	Very low	33.1	Very low	137 Å²	137	146.3 Å²	146.3	72%	0.717	82%	0.823	S	S	*	*	S	Bend	trans	-120.7	-0.2	-165	-82.1	171.3	0	0	0	118.7
15	F	30.8	Very low	33	Very low	193 Å²	193	145.8 Å²	145.8	85%	0.846	82%	0.822	S	S	*	*	S	Bend	trans	-139.1	33.2	-173.7	-83.9	-72.6	0	0	0	117.5
16	F	30.8	Very low	33	Very low	224 Å²	224	145 Å²	145	98%	0.982	81%	0.813	S	S	*	*			trans	-134.1	55.1	159.3	-82.1	-78.2	0	0	0	110.9
17	G	36.9	Very low	34	Very low	84 Å²	84	136.7 Å²	136.7	87%	0.866	78%	0.778	S	S	*	*			trans	-111	100.7	169.9	0	0	0	0	0	110.1
18	G	33.9	Very low	34.9	Very low	66 Å²	66	131.7 Å²	131.7	68%	0.68	75%	0.753	S	S	*	*	S	Bend	trans	158.7	131.7	-179	0	0	0	0	0	110.6
19	D	31.4	Very low	35.9	Very low	166 Å²	166	124 Å²	124	89%	0.888	71%	0.712	S	S	*	*			trans	60.5	52	169.9	-57.4	-18.5	0	0	0	118.4
20	I	29.7	Very low	36.5	Very low	162 Å²	162	119.5 Å²	119.5	83%	0.831	68%	0.684	S	S	*	*	S	Bend	trans	-120.3	83.7	143.8	-57.5	-177.7	0	0	0	109	S22	I20-S22 PolarHBondContact O-N 3.35Å
21	F	31.8	Very low	37	Very low	185 Å²	185	121.9 Å²	121.9	81%	0.811	68%	0.68	S	S	*	*			trans	16.5	71.1	150.8	-133.1	-97.7	0	0	0	116.9	R23	F21-R23 HydrophobicContact CD1-CB 4.04Å; F21-R23 HydrophobicContact CE1-CB 4.33Å; F21-R23 HydrophobicContact CE1-CG 4.33Å; F21-R23 PolarHBondContact O-N 2.9Å
22	S	28.3	Very low	37.7	Very low	124 Å²	124	122.5 Å²	122.5	87%	0.867	67%	0.673	S	S	*	*			trans	-65.6	78.8	158	-66.7	0	0	0	0	108.8	I20 A24	I20-S22 PolarHBondContact O-N 3.35Å; S22-A24 VanDerWaalsContact C-N 3.28Å; S22-A24 PolarHBondContact O-N 3.06Å
23	R	29.8	Very low	38.7	Very low	214 Å²	214	123.2 Å²	123.2	81%	0.808	67%	0.667	S	S	*	*			trans	-63.8	97.4	164.7	-158.8	178.3	-168.3	-171.9	1.3	105.3	F21 M25	F21-R23 HydrophobicContact CD1-CB 4.04Å; F21-R23 HydrophobicContact CE1-CB 4.33Å; F21-R23 HydrophobicContact CE1-CG 4.33Å; F21-R23 PolarHBondContact O-N 2.9Å; R23-M25 PolarHBondContact O-N 3.34Å; R23-M25 VanDerWaalsContact O-N 3.09Å
24	A	33.7	Very low	39.1	Very low	79 Å²	79	119 Å²	119	65%	0.653	65%	0.65	S	S	*	*			trans	-51.9	121.7	174.3	0	0	0	0	0	107.4	S22 L26	S22-A24 VanDerWaalsContact C-N 3.28Å; S22-A24 PolarHBondContact O-N 3.06Å; A24-L26 PolarHBondContact O-N 3.19Å
25	M	32.5	Very low	39.9	Very low	179 Å²	179	115.8 Å²	115.8	88%	0.882	64%	0.636	S	S	*	*			trans	-65.8	93.4	167.8	-79.7	178.6	155.9	0	0	106.6	R23 S27	R23-M25 PolarHBondContact O-N 3.34Å; R23-M25 VanDerWaalsContact O-N 3.09Å; M25-S27 PolarHBondContact O-N 3.36Å
26	L	39	Very low	40.8	Very low	126 Å²	126	113.9 Å²	113.9	66%	0.66	64%	0.635	S	S	*	*			trans	-62.4	111.2	146.5	-93.6	80.9	0	0	0	104.9	A24	A24-L26 PolarHBondContact O-N 3.19Å
27	S	52.8	Low	41.9	Very low	21 Å²	21	107.9 Å²	107.9	15%	0.147	61%	0.612	C	S	.	*			trans	-54.1	131.6	155.7	40.3	0	0	0	0	108.2	M25 I29 G30 D31	M25-S27 PolarHBondContact O-N 3.36Å; S27-I29 WeakPolarHBondContact CB-O 3.48Å; S27-I29 CarbonylContact O-C 3.16Å; S27-I29 PolarHBondContact O-N 2.99Å; S27-I29 PolarHBondContact OG-O 3.5Å; S27-I29 VanDerWaalsContact OG-O 3.05Å; S27-G30 WeakPolarHBondContact O-CA 3.4Å; S27-G30 PolarHBondContact O-N 3.08Å; S27-D31 VanDerWaalsContact OG-CG 3.28Å; S27-D31 PolarHBondContact OG-N 3.38Å; S27-D31 PolarHBondContact OG-OD1 2.84Å
28	D	53	Low	42.5	Very low	63 Å²	63	110.1 Å²	110.1	34%	0.337	60%	0.6	S	S	.	*	S	Bend	trans	-54.7	-25.1	173.8	-66.2	-32.4	0	0	0	111.7	A68 S95 H196	D28-A68 HydrophobicContact CB-CB 3.88Å; D28-S95 WeakPolarHBondContact O-CB 3.43Å; D28-S95 PolarHBondContact O-OG 3.17Å; D28-H196 IonicContact OD2-CE1 3.23Å
29	I	55	Low	43.5	Very low	14 Å²	14	114 Å²	114	7%	0.072	60%	0.604	C	S	.	*	S	Bend	trans	-99.2	80.5	168.8	-60.5	171.8	0	0	0	107.2	S27 D31 A70 R93 L154 I204	S27-I29 WeakPolarHBondContact CB-O 3.48Å; S27-I29 CarbonylContact O-C 3.16Å; S27-I29 PolarHBondContact O-N 2.99Å; S27-I29 PolarHBondContact OG-O 3.5Å; S27-I29 VanDerWaalsContact OG-O 3.05Å; I29-D31 PolarHBondContact O-N 3.2Å; I29-A70 HydrophobicContact CD1-CB 3.16Å; I29-R93 HydrophobicContact CD1-CB 4.39Å; I29-L154 HydrophobicContact CG2-CD1 3.94Å; I29-L154 HydrophobicContact CG2-CD2 4.01Å; I29-I204 HydrophobicContact CD1-CD1 4.2Å
30	G	49.3	Very low	44.5	Very low	17 Å²	17	111 Å²	111	18%	0.175	60%	0.596	C	S	.	*			trans	-50.9	132.2	-165.6	0	0	0	0	0	115.3	S27	S27-G30 WeakPolarHBondContact O-CA 3.4Å; S27-G30 PolarHBondContact O-N 3.08Å
31	D	47.3	Very low	45.8	Very low	116 Å²	116	107.6 Å²	107.6	62%	0.62	57%	0.572	S	S	*	*			trans	-58.5	143.2	-178.1	-69.3	-11.3	0	0	0	113	S27 I29 V33	S27-D31 VanDerWaalsContact OG-CG 3.28Å; S27-D31 PolarHBondContact OG-N 3.38Å; S27-D31 PolarHBondContact OG-OD1 2.84Å; I29-D31 PolarHBondContact O-N 3.2Å; D31-V33 PolarHBondContact O-N 3.06Å
32	Y	47.2	Very low	47.1	Very low	171 Å²	171	104 Å²	104	67%	0.671	56%	0.561	S	S	*	*			trans	-77	92.5	-179.3	178.5	-108	0	0	0	111.9	G34 R146	Y32-G34 PolarHBondContact O-N 2.74Å; Y32-G34 VanDerWaalsContact O-N 3.12Å; Y32-R146 VanDerWaalsContact CD2-NH2 3.32Å
33	V	51.9	Low	48.7	Very low	115 Å²	115	99.2 Å²	99.2	70%	0.697	53%	0.527	S	S	*	.			trans	-82.4	81.4	169.5	-171.3	0	0	0	0	109.8	D31 T35	D31-V33 PolarHBondContact O-N 3.06Å; V33-T35 HydrophobicContact CG1-CG2 4.26Å; V33-T35 PolarHBondContact O-N 2.97Å
34	G	43.9	Very low	50.7	Low	43 Å²	43	93.2 Å²	93.2	44%	0.443	51%	0.511	S	S	.	.			trans	-63.9	127.5	172.6	0	0	0	0	0	111.3	Y32	Y32-G34 PolarHBondContact O-N 2.74Å; Y32-G34 VanDerWaalsContact O-N 3.12Å
35	T	49.2	Very low	52.8	Low	70 Å²	70	91.9 Å²	91.9	43%	0.429	49%	0.493	S	S	.	.			trans	-147.5	149.8	173.8	53.3	0	0	0	0	111	V33 I37 K108	V33-T35 HydrophobicContact CG1-CG2 4.26Å; V33-T35 PolarHBondContact O-N 2.97Å; T35-I37 WeakPolarHBondContact O-CG1 3.37Å; T35-K108 WeakPolarHBondContact OG1-CD 3.41Å; T35-K108 VanDerWaalsContact OG1-CE 3.25Å; T35-K108 WeakPolarHBondContact OG1-CE 3.19Å; T35-K108 PolarHBondContact OG1-NZ 3.23Å
36	D	49.1	Very low	55.1	Low	153 Å²	153	88.9 Å²	88.9	82%	0.818	48%	0.48	S	S	*	.			trans	-59.5	137.3	175.9	-54.5	-68.6	0	0	0	111.6	K108	D36-K108 PolarHBondContact O-NZ 3.49Å
37	I	53.5	Low	57.3	Low	97 Å²	97	87.4 Å²	87.4	50%	0.497	47%	0.473	S	S	.	.			trans	-119.8	105.9	-175.1	-48.2	-175.4	0	0	0	108.1	T35 W41	T35-I37 WeakPolarHBondContact O-CG1 3.37Å; I37-W41 HydrophobicContact CG2-CZ2 4.43Å
38	E	50.5	Low	58.8	Low	132 Å²	132	88 Å²	88	62%	0.617	47%	0.474	S	S	*	.			trans	-71.5	143.3	163.7	-50.4	-178	137.5	0	0	108.7	S40 W41	E38-S40 PolarHBondContact O-N 3.36Å; E38-S40 VanDerWaalsContact O-N 3.13Å; E38-W41 HydrophobicContact CB-CE3 4.29Å; E38-W41 HydrophobicContact CB-CH2 3.43Å; E38-W41 VanDerWaalsContact CB-CH2 3.43Å; E38-W41 HydrophobicContact CB-CZ2 3.96Å; E38-W41 HydrophobicContact CB-CZ3 3.61Å; E38-W41 HydrophobicContact CG-CH2 3.59Å; E38-W41 HydrophobicContact CG-CZ2 4.36Å; E38-W41 HydrophobicContact CG-CZ3 4.03Å; E38-W41 PolarHBondContact O-NE1 2.81Å; E38-W41 VanDerWaalsContact OE2-CZ3 3.3Å; E38-W41 WeakPolarHBondContact OE2-CZ3 3.37Å
39	I	55	Low	60.5	Low	147 Å²	147	86.5 Å²	86.5	75%	0.754	47%	0.466	S	S	*	.	G	3₁₀ helix	trans	-76	-6.2	-163.4	-64	165.4	0	0	0	112.8	W41 L42	I39-W41 VanDerWaalsContact C-N 3.33Å; I39-W41 PolarHBondContact O-N 3.49Å; I39-L42 HydrophobicContact CG2-CD1 4.5Å
40	S	52.8	Low	62.1	Low	103 Å²	103	93.8 Å²	93.8	72%	0.72	50%	0.497	S	S	*	.	G	3₁₀ helix	trans	-74.9	-9.7	-170.5	54.2	0	0	0	0	115.9	E38	E38-S40 PolarHBondContact O-N 3.36Å; E38-S40 VanDerWaalsContact O-N 3.13Å
41	W	55.3	Low	63.9	Low	90 Å²	90	96.9 Å²	96.9	34%	0.341	53%	0.528	S	S	.	.	G	3₁₀ helix	trans	-127.7	14.9	-171.7	58.1	64.6	0	0	0	115.3	I37 E38 I39 P43 T106	I37-W41 HydrophobicContact CG2-CZ2 4.43Å; E38-W41 HydrophobicContact CB-CE3 4.29Å; E38-W41 HydrophobicContact CB-CH2 3.43Å; E38-W41 VanDerWaalsContact CB-CH2 3.43Å; E38-W41 HydrophobicContact CB-CZ2 3.96Å; E38-W41 HydrophobicContact CB-CZ3 3.61Å; E38-W41 HydrophobicContact CG-CH2 3.59Å; E38-W41 HydrophobicContact CG-CZ2 4.36Å; E38-W41 HydrophobicContact CG-CZ3 4.03Å; E38-W41 PolarHBondContact O-NE1 2.81Å; E38-W41 VanDerWaalsContact OE2-CZ3 3.3Å; E38-W41 WeakPolarHBondContact OE2-CZ3 3.37Å; I39-W41 VanDerWaalsContact C-N 3.33Å; I39-W41 PolarHBondContact O-N 3.49Å; W41-P43 WeakPolarHBondContact O-CD 3.28Å; W41-P43 VanDerWaalsContact O-N 3.16Å; W41-T106 HydrophobicContact CB-CG2 4.32Å; W41-T106 HydrophobicContact CG-CG2 4.22Å
42	L	59.8	Low	66.1	Low	111 Å²	111	92.8 Å²	92.8	58%	0.581	51%	0.505	S	S	*	.			trans	-59.3	118.4	170.8	-81.8	161.6	0	0	0	108.9	I39	I39-L42 HydrophobicContact CG2-CD1 4.5Å
43	P	62	Low	68.2	Low	23 Å²	23	86.7 Å²	86.7	15%	0.149	49%	0.489	C	S	.	.			trans	-63.1	143.9	178.6	25.2	-31.7	0	0	0	109.4	W41 L45 L110	W41-P43 WeakPolarHBondContact O-CD 3.28Å; W41-P43 VanDerWaalsContact O-N 3.16Å; P43-L45 PolarHBondContact O-N 2.91Å; P43-L110 HydrophobicContact CG-CD1 3.64Å
44	N	73	Confident	70	Confident	87 Å²	87	87.7 Å²	87.7	47%	0.465	48%	0.48	S	S	.	.			trans	-65.9	101.5	177.1	-175	14.2	0	0	0	109.4	D46 D47 L48	N44-D46 PolarHBondContact O-N 2.9Å; N44-D46 PolarHBondContact OD1-N 3.1Å; N44-D47 HydrophobicContact CB-CB 4.17Å; N44-D47 VanDerWaalsContact ND2-CG 3.31Å; N44-D47 PolarHBondContact ND2-OD2 3.48Å; N44-D47 PolarHBondContact O-N 3.34Å; N44-L48 PolarHBondContact O-N 3.49Å; N44-L48 VanDerWaalsContact O-N 3.13Å
45	L	77.8	Confident	72.3	Confident	51 Å²	51	91.5 Å²	91.5	27%	0.267	49%	0.491	S	S	.	.	H	α-helix	trans	-63.1	-26.5	-174.5	-167.7	61	0	0	0	111.9	P43 L48 M49 L112 F116	P43-L45 PolarHBondContact O-N 2.91Å; L45-L48 HydrophobicContact CD1-CD2 4.17Å; L45-L48 PolarHBondContact O-N 3.07Å; L45-M49 WeakPolarHBondContact O-CB 3.33Å; L45-M49 VanDerWaalsContact O-CG 3.32Å; L45-M49 WeakPolarHBondContact O-CG 3.46Å; L45-M49 PolarHBondContact O-N 3.22Å; L45-L112 HydrophobicContact CD1-CD1 4.39Å; L45-L112 HydrophobicContact CD2-CD2 4.34Å; L45-F116 HydrophobicContact CD1-CE1 4.3Å; L45-F116 HydrophobicContact CD1-CE2 3.96Å; L45-F116 HydrophobicContact CD1-CZ 3.63Å; L45-F116 HydrophobicContact CD2-CD2 3.76Å; L45-F116 HydrophobicContact CD2-CE2 3.49Å; L45-F116 VanDerWaalsContact CD2-CE2 3.49Å; L45-F116 HydrophobicContact CD2-CG 4.48Å; L45-F116 HydrophobicContact CD2-CZ 4Å; L45-F116 HydrophobicContact CG-CD2 4.4Å; L45-F116 HydrophobicContact CG-CE2 3.62Å; L45-F116 HydrophobicContact CG-CZ 3.86Å
46	D	80.8	Confident	74.4	Confident	117 Å²	117	93.4 Å²	93.4	63%	0.626	49%	0.493	S	S	*	.	H	α-helix	trans	-72.8	-29.8	174.9	-66.9	-33.3	0	0	0	112.5	N44 K50	N44-D46 PolarHBondContact O-N 2.9Å; N44-D46 PolarHBondContact OD1-N 3.1Å; D46-K50 PolarHBondContact O-N 3.35Å
47	D	83.6	Confident	76.5	Confident	95 Å²	95	86.6 Å²	86.6	51%	0.508	46%	0.456	S	S	.	.	H	α-helix	trans	-74.3	-37.6	170.9	-77.8	-43	0	0	0	111.3	N44 M49 K50	N44-D47 HydrophobicContact CB-CB 4.17Å; N44-D47 VanDerWaalsContact ND2-CG 3.31Å; N44-D47 PolarHBondContact ND2-OD2 3.48Å; N44-D47 PolarHBondContact O-N 3.34Å; D47-M49 VanDerWaalsContact C-N 3.3Å; D47-M49 PolarHBondContact O-N 2.95Å; D47-K50 WeakPolarHBondContact O-CB 3.48Å; D47-K50 PolarHBondContact O-N 3.03Å
48	L	84.3	Confident	78.5	Confident	32 Å²	32	82.4 Å²	82.4	17%	0.168	44%	0.435	C	S	.	.	H	α-helix	trans	-64	-36.2	174.8	-171.9	64.5	0	0	0	112	N44 L45 K50 L101 S102 L147	N44-L48 PolarHBondContact O-N 3.49Å; N44-L48 VanDerWaalsContact O-N 3.13Å; L45-L48 HydrophobicContact CD1-CD2 4.17Å; L45-L48 PolarHBondContact O-N 3.07Å; L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.49Å; L48-L101 HydrophobicContact CG-CD2 4.27Å; L48-S102 WeakPolarHBondContact CD1-O 3.45Å; L48-L147 HydrophobicContact CD2-CD2 3.81Å
49	M	88.4	Confident	80.3	Confident	33 Å²	33	78.5 Å²	78.5	16%	0.163	43%	0.431	C	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	0.5	177.4	-70.4	-61.1	-67.9	0	0	114	L45 D47 G51 Y52 L101 F116 K119 L120	L45-M49 WeakPolarHBondContact O-CB 3.33Å; L45-M49 VanDerWaalsContact O-CG 3.32Å; L45-M49 WeakPolarHBondContact O-CG 3.46Å; L45-M49 PolarHBondContact O-N 3.22Å; D47-M49 VanDerWaalsContact C-N 3.3Å; D47-M49 PolarHBondContact O-N 2.95Å; M49-G51 PolarHBondContact O-N 3.4Å; M49-Y52 HydrophobicContact CE-CD1 3.59Å; M49-Y52 HydrophobicContact CE-CE1 4.34Å; M49-Y52 HydrophobicContact CE-CG 3.85Å; M49-Y52 WeakPolarHBondContact O-CB 3.36Å; M49-Y52 PolarHBondContact O-N 2.87Å; M49-Y52 HydrophobicContact SD-CD1 4.35Å; M49-Y52 HydrophobicContact SD-CG 4.12Å; M49-L101 HydrophobicContact SD-CD2 3.86Å; M49-F116 HydrophobicContact CE-CZ 4.37Å; M49-F116 HydrophobicContact CG-CE2 3.81Å; M49-F116 HydrophobicContact CG-CZ 3.63Å; M49-F116 HydrophobicContact SD-CE1 4.36Å; M49-F116 HydrophobicContact SD-CE2 4.14Å; M49-F116 HydrophobicContact SD-CZ 3.5Å; M49-F116 VanDerWaalsContact SD-CZ 3.5Å; M49-K119 HydrophobicContact CE-CB 3.87Å; M49-L120 HydrophobicContact CE-CD2 3.96Å; M49-L120 HydrophobicContact SD-CD2 3.85Å
50	K	89.3	Confident	82	Confident	167 Å²	167	76.7 Å²	76.7	73%	0.726	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	106.2	-173.4	-170	176.2	-175.1	172.1	0	111.7	D46 D47 L48	D46-K50 PolarHBondContact O-N 3.35Å; D47-K50 WeakPolarHBondContact O-CB 3.48Å; D47-K50 PolarHBondContact O-N 3.03Å; L48-K50 VanDerWaalsContact C-N 3.28Å; L48-K50 PolarHBondContact O-N 3.49Å
51	G	87.4	Confident	83.8	Confident	81 Å²	81	75.8 Å²	75.8	84%	0.835	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	6.5	-175.5	0	0	0	0	0	114.1	M49 A53	M49-G51 PolarHBondContact O-N 3.4Å; G51-A53 PolarHBondContact O-N 3.03Å
52	Y	92.8	Very high	85.6	Confident	31 Å²	31	73.3 Å²	73.3	12%	0.122	43%	0.431	C	S	.	.			trans	-67	123.9	174.3	-171.8	-88.7	0	0	0	111	M49 R54 D98 R100 L101 L120 W121	M49-Y52 HydrophobicContact CE-CD1 3.59Å; M49-Y52 HydrophobicContact CE-CE1 4.34Å; M49-Y52 HydrophobicContact CE-CG 3.85Å; M49-Y52 WeakPolarHBondContact O-CB 3.36Å; M49-Y52 PolarHBondContact O-N 2.87Å; M49-Y52 HydrophobicContact SD-CD1 4.35Å; M49-Y52 HydrophobicContact SD-CG 4.12Å; Y52-R54 HydrophobicContact CD1-CB 4.4Å; Y52-R54 HydrophobicContact CE1-CB 3.97Å; Y52-D98 WeakPolarHBondContact CE2-OD2 3.31Å; Y52-D98 PolarHBondContact OH-OD2 2.9Å; Y52-R100 HydrophobicContact CD2-CB 3.95Å; Y52-R100 HydrophobicContact CE2-CB 4Å; Y52-R100 PolarHBondContact OH-NH2 3.31Å; Y52-L101 HydrophobicContact CD2-CD2 3.63Å; Y52-L101 HydrophobicContact CD2-CG 4.2Å; Y52-L101 HydrophobicContact CE2-CD1 4.09Å; Y52-L101 HydrophobicContact CE2-CD2 3.72Å; Y52-L101 HydrophobicContact CE2-CG 3.79Å; Y52-L101 HydrophobicContact CG-CD2 4.45Å; Y52-L120 HydrophobicContact CE1-CD2 4.07Å; Y52-W121 PolarHBondContact OH-N 3.33Å; Y52-W121 VanDerWaalsContact OH-N 3.12Å
53	A	91.2	Very high	87.2	Confident	42 Å²	42	73 Å²	73	35%	0.347	44%	0.435	S	S	.	.			trans	-112.6	92.8	-178.6	0	0	0	0	0	110.8	G51 N55 F56 R100	G51-A53 PolarHBondContact O-N 3.03Å; A53-N55 PolarHBondContact O-N 3.48Å; A53-F56 HydrophobicContact CB-CD2 3.82Å; A53-F56 HydrophobicContact CB-CE2 4.31Å; A53-F56 PolarHBondContact O-N 3.02Å; A53-R100 PolarHBondContact O-NH1 3.22Å
54	R	91.4	Very high	88.8	Confident	136 Å²	136	74.3 Å²	74.3	51%	0.513	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.9	-176.6	76.8	175.1	-171.6	178	2.1	115.6	Y52 F56 D118 K119 W121	Y52-R54 HydrophobicContact CD1-CB 4.4Å; Y52-R54 HydrophobicContact CE1-CB 3.97Å; R54-F56 PolarHBondContact O-N 3.42Å; R54-D118 PolarHBondContact NH1-O 2.91Å; R54-K119 WeakPolarHBondContact CB-O 3.41Å; R54-W121 WeakPolarHBondContact O-CB 3.4Å
55	N	91.3	Very high	89.9	Confident	123 Å²	123	70.7 Å²	70.7	66%	0.658	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.2	-9.2	-177	-62.2	-0.2	0	0	0	112.9	A53	A53-N55 PolarHBondContact O-N 3.48Å
56	F	92.6	Very high	90.8	Very high	110 Å²	110	72.8 Å²	72.8	48%	0.482	44%	0.436	S	S	.	.	S	Bend	trans	-116.7	133.3	-179.9	-56.9	-68.6	0	0	0	110.6	A53 R54 I60 R100	A53-F56 HydrophobicContact CB-CD2 3.82Å; A53-F56 HydrophobicContact CB-CE2 4.31Å; A53-F56 PolarHBondContact O-N 3.02Å; R54-F56 PolarHBondContact O-N 3.42Å; F56-I60 HydrophobicContact CB-CD1 4.25Å; F56-I60 HydrophobicContact CB-CG2 4.47Å; F56-I60 HydrophobicContact CD1-CD1 3.64Å; F56-I60 HydrophobicContact CE1-CD1 4.45Å; F56-I60 HydrophobicContact CG-CD1 4.31Å; F56-R100 PolarHBondContact O-NH1 2.88Å; F56-R100 PolarHBondContact O-NH2 3.45Å
57	R	94.3	Very high	91.5	Very high	10 Å²	10	67.2 Å²	67.2	4%	0.038	41%	0.406	C	S	.	.			trans	-58.9	150.3	174.3	70.9	170.3	-178	93.4	-17.5	111.5	G59 I60 G62 P63 V65 W121 Y188 D192	R57-G59 PolarHBondContact NH1-O 2.86Å; R57-I60 HydrophobicContact CG-CB 4.28Å; R57-I60 PolarHBondContact O-N 3.47Å; R57-G62 PolarHBondContact NH2-O 2.91Å; R57-P63 PolarHBondContact NH1-O 3.39Å; R57-V65 HydrophobicContact CB-CG2 4.4Å; R57-W121 HydrophobicContact CB-CH2 4.5Å; R57-W121 HydrophobicContact CB-CZ2 3.72Å; R57-Y188 HydrophobicContact CB-CE1 4.35Å; R57-D192 WeakPolarHBondContact CD-O 3.11Å; R57-D192 IonicContact CZ-OD1 3.2Å; R57-D192 VanDerWaalsContact CZ-OD1 3.27Å; R57-D192 IonicContact NE-OD1 2.72Å; R57-D192 PolarHBondContact NE-OD1 3.09Å; R57-D192 IonicContact NH2-OD1 3.69Å; R57-D192 PolarHBondContact NH2-OD1 3.19Å
58	P	94.1	Very high	92.2	Very high	9 Å²	9	62.9 Å²	62.9	6%	0.058	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49.2	140.1	165.2	-23.9	31.2	0	0	0	111	I60 V65 D98 W121	P58-I60 VanDerWaalsContact C-N 3.31Å; P58-I60 PolarHBondContact O-N 3.33Å; P58-V65 HydrophobicContact CB-CG2 4.02Å; P58-V65 HydrophobicContact CG-CG2 4.31Å; P58-V65 VanDerWaalsContact O-CG2 3.26Å; P58-V65 WeakPolarHBondContact O-CG2 3.49Å; P58-D98 HydrophobicContact CB-CB 4.34Å; P58-D98 HydrophobicContact CG-CB 3.94Å; P58-W121 HydrophobicContact CG-CD2 4.45Å; P58-W121 HydrophobicContact CG-CE3 3.88Å; P58-W121 HydrophobicContact CG-CZ3 4.07Å
59	G	89.6	Confident	92.7	Very high	51 Å²	51	61.4 Å²	61.4	53%	0.526	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.8	29.3	176.9	0	0	0	0	0	115.8	R57 G61 G62	R57-G59 PolarHBondContact NH1-O 2.86Å; G59-G61 PolarHBondContact O-N 2.91Å; G59-G62 WeakPolarHBondContact O-CA 3.22Å; G59-G62 PolarHBondContact O-N 2.72Å
60	I	91.1	Very high	93.1	Very high	109 Å²	109	59.8 Å²	59.8	56%	0.559	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	129.1	178.8	-171.9	168.8	0	0	0	112.5	F56 R57 P58 G62	F56-I60 HydrophobicContact CB-CD1 4.25Å; F56-I60 HydrophobicContact CB-CG2 4.47Å; F56-I60 HydrophobicContact CD1-CD1 3.64Å; F56-I60 HydrophobicContact CE1-CD1 4.45Å; F56-I60 HydrophobicContact CG-CD1 4.31Å; R57-I60 HydrophobicContact CG-CB 4.28Å; R57-I60 PolarHBondContact O-N 3.47Å; P58-I60 VanDerWaalsContact C-N 3.31Å; P58-I60 PolarHBondContact O-N 3.33Å; I60-G62 VanDerWaalsContact C-N 3.25Å; I60-G62 PolarHBondContact O-N 3.13Å
61	G	89.1	Confident	93.4	Very high	84 Å²	84	51.9 Å²	51.9	87%	0.866	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-3	-173.3	0	0	0	0	0	114.9	G59	G59-G61 PolarHBondContact O-N 2.91Å
62	G	92.9	Very high	93.8	Very high	38 Å²	38	51 Å²	51	39%	0.392	31%	0.308	S	S	.	.	S	Bend	trans	-106.5	-157.1	170.1	0	0	0	0	0	112.4	R57 G59 I60	R57-G62 PolarHBondContact NH2-O 2.91Å; G59-G62 WeakPolarHBondContact O-CA 3.22Å; G59-G62 PolarHBondContact O-N 2.72Å; I60-G62 VanDerWaalsContact C-N 3.25Å; I60-G62 PolarHBondContact O-N 3.13Å
63	P	95.3	Very high	93.9	Very high	104 Å²	104	49.8 Å²	49.8	68%	0.675	30%	0.304	S	S	*	.	S	Bend	trans	-60.2	162.1	-178.8	27.6	-35.5	0	0	0	112.4	R57	R57-P63 PolarHBondContact NH1-O 3.39Å
64	P	95.3	Very high	94.1	Very high	51 Å²	51	49.7 Å²	49.7	33%	0.331	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-60.1	150	170.8	26.4	-34.7	0	0	0	110.9	D66 D192 V194	P64-D66 PolarHBondContact O-N 2.88Å; P64-D192 CarbonylContact C-O 3.38Å; P64-D192 WeakPolarHBondContact CA-O 3.49Å; P64-V194 HydrophobicContact CB-CG2 4.03Å; P64-V194 HydrophobicContact CG-CG2 3.92Å
65	V	95.8	Very high	94.2	Very high	10 Å²	10	44.6 Å²	44.6	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.8	124	172.6	-175.1	0	0	0	0	108.4	R57 P58 V67 W96 W121 D192 I193 V194	R57-V65 HydrophobicContact CB-CG2 4.4Å; P58-V65 HydrophobicContact CB-CG2 4.02Å; P58-V65 HydrophobicContact CG-CG2 4.31Å; P58-V65 VanDerWaalsContact O-CG2 3.26Å; P58-V65 WeakPolarHBondContact O-CG2 3.49Å; V65-V67 HydrophobicContact CG1-CG2 3.94Å; V65-W96 HydrophobicContact CG1-CB 4.13Å; V65-W121 HydrophobicContact CG1-CH2 4.44Å; V65-W121 HydrophobicContact CG1-CZ3 4.47Å; V65-D192 PolarHBondContact N-O 3.23Å; V65-I193 WeakPolarHBondContact O-CA 3.32Å; V65-V194 PolarHBondContact O-N 3.28Å
66	D	95.7	Very high	94.3	Very high	95 Å²	95	39.4 Å²	39.4	51%	0.508	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	127.5	173.7	-152.3	8.2	0	0	0	109.3	P64 H196	P64-D66 PolarHBondContact O-N 2.88Å; D66-H196 IonicContact OD1-CD2 3.04Å; D66-H196 PolarHBondContact OD1-CD2 3.46Å; D66-H196 IonicContact OD1-NE2 3.56Å
67	V	97.1	Very high	94.1	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	107.8	-175.3	-174.9	0	0	0	0	109.8	V65 M69 Q94 S95 W96 P123 I193 V194 Y195 H196	V65-V67 HydrophobicContact CG1-CG2 3.94Å; V67-M69 HydrophobicContact CG1-CG 4.5Å; V67-M69 HydrophobicContact CG1-SD 3.82Å; V67-Q94 HydrophobicContact CG1-CB 4.3Å; V67-S95 CarbonylContact C-O 3.6Å; V67-S95 WeakPolarHBondContact CA-O 3.49Å; V67-W96 HydrophobicContact CB-CB 4.43Å; V67-W96 HydrophobicContact CG1-CB 4.39Å; V67-W96 HydrophobicContact CG2-CB 3.85Å; V67-P123 HydrophobicContact CG1-CG 4.45Å; V67-I193 HydrophobicContact CG2-CD1 3.84Å; V67-I193 HydrophobicContact CG2-CG1 3.83Å; V67-V194 PolarHBondContact N-O 3.12Å; V67-Y195 HydrophobicContact CB-CD1 3.77Å; V67-Y195 HydrophobicContact CB-CE1 3.86Å; V67-Y195 HydrophobicContact CG1-CD1 4.08Å; V67-Y195 HydrophobicContact CG1-CE1 3.93Å; V67-Y195 HydrophobicContact CG2-CE1 4.33Å; V67-H196 PolarHBondContact O-N 3.02Å
68	A	96.9	Very high	93.8	Very high	5 Å²	5	43.1 Å²	43.1	4%	0.041	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	121.6	176.6	0	0	0	0	0	109.9	D28 Q94 S95 H196	D28-A68 HydrophobicContact CB-CB 3.88Å; A68-Q94 WeakPolarHBondContact O-CA 3.48Å; A68-S95 PolarHBondContact N-O 2.93Å; A68-S95 PolarHBondContact O-N 3.43Å; A68-H196 VanDerWaalsContact CA-NE2 3.33Å; A68-H196 WeakPolarHBondContact CA-NE2 3.49Å; A68-H196 WeakPolarHBondContact CB-CE1 3.39Å; A68-H196 VanDerWaalsContact CB-NE2 3.33Å; A68-H196 WeakPolarHBondContact CB-NE2 3.04Å; A68-H196 PolarHBondContact N-NE2 2.82Å
69	M	96.2	Very high	93.7	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	138.8	-174.5	-61.3	-67.7	-81.6	0	0	110.7	V67 L92 Q94 T125 L183 Y195 H196 S198 L238	V67-M69 HydrophobicContact CG1-CG 4.5Å; V67-M69 HydrophobicContact CG1-SD 3.82Å; M69-L92 HydrophobicContact CE-CD1 3.92Å; M69-Q94 HydrophobicContact CE-CG 3.9Å; M69-Q94 HydrophobicContact SD-CB 3.82Å; M69-Q94 HydrophobicContact SD-CG 3.57Å; M69-Q94 VanDerWaalsContact SD-CG 3.57Å; M69-T125 HydrophobicContact CE-CG2 3.63Å; M69-L183 HydrophobicContact CE-CD1 3.95Å; M69-Y195 HydrophobicContact CG-CD1 3.83Å; M69-Y195 HydrophobicContact CG-CG 4.35Å; M69-Y195 HydrophobicContact SD-CD1 4.06Å; M69-Y195 HydrophobicContact SD-CE1 4.19Å; M69-H196 WeakPolarHBondContact CB-O 3.44Å; M69-H196 PolarHBondContact N-O 3.38Å; M69-S198 PolarHBondContact O-N 2.96Å; M69-L238 HydrophobicContact CB-CD1 3.44Å; M69-L238 VanDerWaalsContact CB-CD1 3.44Å; M69-L238 HydrophobicContact CG-CD1 3.58Å
70	A	95.9	Very high	93.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	151.2	165.5	0	0	0	0	0	112.5	I29 R93 I204	I29-A70 HydrophobicContact CD1-CB 3.16Å; A70-R93 HydrophobicContact CB-CB 4.28Å; A70-R93 PolarHBondContact N-O 3.4Å; A70-R93 PolarHBondContact O-N 3.46Å; A70-I204 HydrophobicContact CB-CG2 4.46Å
71	I	95.8	Very high	93.8	Very high	1 Å²	1	37.6 Å²	37.6	1%	0.005	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	126.5	178.7	-62.5	177.9	0	0	0	107.6	V73 V90 L92 L181 L183 W197 Q201 H205 L240	I71-V73 HydrophobicContact CG2-CG2 4.11Å; I71-V90 HydrophobicContact CG2-CB 4.05Å; I71-V90 HydrophobicContact CG2-CG1 3.97Å; I71-L92 HydrophobicContact CG1-CD1 3.9Å; I71-L181 HydrophobicContact CD1-CD2 3.71Å; I71-L183 HydrophobicContact CD1-CD1 3.69Å; I71-L183 HydrophobicContact CD1-CG 4.43Å; I71-L183 HydrophobicContact CG1-CD1 4.28Å; I71-W197 HydrophobicContact CB-CZ3 4.44Å; I71-W197 HydrophobicContact CD1-CH2 3.66Å; I71-W197 HydrophobicContact CD1-CZ3 3.88Å; I71-W197 HydrophobicContact CG1-CH2 4.23Å; I71-W197 HydrophobicContact CG1-CZ3 3.92Å; I71-Q201 PolarHBondContact O-NE2 3.41Å; I71-Q201 PolarHBondContact O-OE1 3.04Å; I71-H205 VanDerWaalsContact O-CA 3.31Å; I71-H205 WeakPolarHBondContact O-CA 3.44Å; I71-L240 HydrophobicContact CG2-CD2 4.34Å
72	E	95.5	Very high	93.7	Very high	62 Å²	62	36 Å²	36	29%	0.29	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	116.1	164.3	173.2	176.9	-179.2	0	0	107.9	A74 V90 F91 R93 I204	E72-A74 PolarHBondContact O-N 2.93Å; E72-V90 CarbonylContact O-C 3.51Å; E72-V90 WeakPolarHBondContact O-CA 3.4Å; E72-F91 HydrophobicContact CB-CB 4.27Å; E72-F91 HydrophobicContact CB-CD2 4.46Å; E72-F91 HydrophobicContact CG-CD2 4.22Å; E72-F91 PolarHBondContact N-O 3.47Å; E72-F91 PolarHBondContact O-N 2.9Å; E72-R93 IonicContact OE2-CZ 2.98Å; E72-R93 IonicContact OE2-NH1 2.74Å; E72-R93 PolarHBondContact OE2-NH1 2.67Å; E72-R93 IonicContact OE2-NH2 2.92Å; E72-R93 PolarHBondContact OE2-NH2 3.32Å; E72-I204 HydrophobicContact CB-CG2 3.95Å; E72-I204 WeakPolarHBondContact CB-O 3.47Å; E72-I204 WeakPolarHBondContact CG-O 3.34Å
73	V	95.8	Very high	93.6	Very high	6 Å²	6	38.5 Å²	38.5	4%	0.036	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	115.4	178.8	-172.2	0	0	0	0	108.5	I71 I76 V90 H205 L207 L210 L240	I71-V73 HydrophobicContact CG2-CG2 4.11Å; V73-I76 HydrophobicContact CG1-CG1 4.12Å; V73-V90 HydrophobicContact CG1-CG1 4.46Å; V73-V90 HydrophobicContact CG2-CG1 4.28Å; V73-H205 PolarHBondContact N-O 3.01Å; V73-L207 HydrophobicContact CB-CD1 4.42Å; V73-L207 HydrophobicContact CB-CG 4.44Å; V73-L207 HydrophobicContact CG2-CD1 3.78Å; V73-L207 HydrophobicContact CG2-CG 4.13Å; V73-L210 HydrophobicContact CB-CD1 4.09Å; V73-L210 HydrophobicContact CG1-CD1 3.62Å; V73-L240 HydrophobicContact CG2-CD2 3.98Å
74	A	94.1	Very high	93.4	Very high	39 Å²	39	37 Å²	37	32%	0.322	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	-39.3	179.9	0	0	0	0	0	111.9	E72 T89 F91	E72-A74 PolarHBondContact O-N 2.93Å; A74-T89 HydrophobicContact CB-CG2 4.21Å; A74-T89 WeakPolarHBondContact CB-O 3.38Å; A74-T89 PolarHBondContact N-O 3.5Å; A74-F91 HydrophobicContact CB-CD2 4.16Å; A74-F91 HydrophobicContact CB-CE2 3.73Å
75	S	93.7	Very high	93.4	Very high	29 Å²	29	36 Å²	36	20%	0.203	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.8	157.4	175.5	60	0	0	0	0	111.9	D77 M88 T89	S75-D77 WeakPolarHBondContact CB-OD1 3.45Å; S75-D77 VanDerWaalsContact OG-CG 3.24Å; S75-D77 PolarHBondContact OG-OD1 3.27Å; S75-D77 PolarHBondContact OG-OD2 3.46Å; S75-M88 WeakPolarHBondContact O-CA 3.42Å; S75-T89 PolarHBondContact N-O 3.02Å; S75-T89 PolarHBondContact O-N 3.4Å; S75-T89 WeakPolarHBondContact OG-CB 3.49Å
76	I	94.4	Very high	93.4	Very high	14 Å²	14	35.5 Å²	35.5	7%	0.072	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	107.3	161.9	-56.3	171.4	0	0	0	105.2	V73 I79 Y86 T87 M88 L210 L212 I217 F242	V73-I76 HydrophobicContact CG1-CG1 4.12Å; I76-I79 HydrophobicContact CG2-CD1 4.22Å; I76-I79 HydrophobicContact CG2-CG1 4.08Å; I76-Y86 HydrophobicContact CG2-CD2 4.42Å; I76-T87 CarbonylContact C-O 3.58Å; I76-M88 HydrophobicContact CD1-CE 4.41Å; I76-M88 HydrophobicContact CG1-CB 4.12Å; I76-M88 HydrophobicContact CG1-CE 4.31Å; I76-L210 HydrophobicContact CD1-CD1 4.35Å; I76-L210 HydrophobicContact CG1-CD1 4.37Å; I76-L212 HydrophobicContact CB-CD2 3.88Å; I76-L212 WeakPolarHBondContact O-CD2 3.42Å; I76-I217 HydrophobicContact CD1-CD1 4.42Å; I76-F242 HydrophobicContact CD1-CD2 4.38Å; I76-F242 HydrophobicContact CD1-CE2 3.84Å; I76-F242 HydrophobicContact CD1-CZ 4.27Å
77	D	87.9	Confident	93.4	Very high	93 Å²	93	32 Å²	32	50%	0.497	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	-44.2	-159.1	-58.6	-54.6	0	0	0	112.5	S75 T87 T89	S75-D77 WeakPolarHBondContact CB-OD1 3.45Å; S75-D77 VanDerWaalsContact OG-CG 3.24Å; S75-D77 PolarHBondContact OG-OD1 3.27Å; S75-D77 PolarHBondContact OG-OD2 3.46Å; D77-T87 PolarHBondContact N-O 2.94Å; D77-T89 PolarHBondContact OD2-OG1 3.33Å
78	H	87.6	Confident	93.3	Very high	106 Å²	106	32 Å²	32	49%	0.491	18%	0.18	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	122.8	-174.7	-175.9	-93.2	0	0	0	110.3	Y86 T87	H78-Y86 CarbonylContact O-C 3.59Å; H78-Y86 VanDerWaalsContact O-CA 3.25Å; H78-Y86 WeakPolarHBondContact O-CA 3.4Å; H78-T87 PolarHBondContact O-N 3.48Å
79	I	92.9	Very high	93.3	Very high	21 Å²	21	32.1 Å²	32.1	11%	0.108	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	126	173.5	-62.8	161.8	0	0	0	106.5	I76 M167 F215 L244	I76-I79 HydrophobicContact CG2-CD1 4.22Å; I76-I79 HydrophobicContact CG2-CG1 4.08Å; I79-M167 HydrophobicContact CG2-CE 3.76Å; I79-F215 HydrophobicContact CB-CE2 4Å; I79-F215 HydrophobicContact CD1-CD2 3.45Å; I79-F215 VanDerWaalsContact CD1-CD2 3.45Å; I79-F215 HydrophobicContact CD1-CE2 3.77Å; I79-F215 HydrophobicContact CD1-CG 4.11Å; I79-F215 HydrophobicContact CG1-CE2 4.5Å; I79-F215 HydrophobicContact CG2-CE2 3.77Å; I79-F215 HydrophobicContact CG2-CZ 3.99Å; I79-L244 HydrophobicContact CD1-CD1 3.93Å
80	S	91.6	Very high	93.3	Very high	12 Å²	12	32.3 Å²	32.3	8%	0.084	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	105.2	-178.7	-169.9	0	0	0	0	110.8	A82 N83 M84 E85	S80-A82 PolarHBondContact O-N 3.08Å; S80-N83 PolarHBondContact O-N 3.06Å; S80-N83 PolarHBondContact OG-N 3.31Å; S80-M84 PolarHBondContact O-N 3.14Å; S80-E85 PolarHBondContact N-O 3.32Å; S80-E85 PolarHBondContact O-N 3Å
81	E	89.7	Confident	93.3	Very high	19 Å²	19	35.2 Å²	35.2	9%	0.089	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-30.9	169.1	-56	85.5	169.8	0	0	111.1	N83 M167 L169 R246 L302 P303	E81-N83 PolarHBondContact O-N 2.69Å; E81-M167 HydrophobicContact CG-SD 4.21Å; E81-L169 HydrophobicContact CB-CD1 4.09Å; E81-L169 HydrophobicContact CB-CD2 4.28Å; E81-L169 HydrophobicContact CG-CD2 4.04Å; E81-R246 IonicContact OE1-CZ 3.17Å; E81-R246 IonicContact OE1-NH1 2.71Å; E81-R246 PolarHBondContact OE1-NH1 3.35Å; E81-R246 IonicContact OE1-NH2 2.77Å; E81-R246 PolarHBondContact OE1-NH2 3.35Å; E81-L302 HydrophobicContact CB-CD2 4.23Å; E81-P303 VanDerWaalsContact O-CG 3.3Å; E81-P303 WeakPolarHBondContact O-CG 3.41Å
82	A	87.5	Confident	93.3	Very high	50 Å²	50	35.6 Å²	35.6	41%	0.413	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-37.6	-179.8	0	0	0	0	0	113.1	S80	S80-A82 PolarHBondContact O-N 3.08Å
83	N	90.1	Very high	93.4	Very high	91 Å²	91	35.1 Å²	35.1	49%	0.487	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.3	-5.2	-178.4	-66.7	-9.1	0	0	0	113.6	S80 E81 E85 K131	S80-N83 PolarHBondContact O-N 3.06Å; S80-N83 PolarHBondContact OG-N 3.31Å; E81-N83 PolarHBondContact O-N 2.69Å; N83-E85 HydrophobicContact CB-CG 3.71Å; N83-E85 VanDerWaalsContact CB-OE1 3.27Å; N83-E85 WeakPolarHBondContact CB-OE1 3.06Å; N83-E85 PolarHBondContact ND2-OE1 3.48Å; N83-K131 PolarHBondContact O-NZ 3.39Å
84	M	92	Very high	93.4	Very high	74 Å²	74	35.3 Å²	35.3	37%	0.365	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.3	57.4	-172.3	-69.2	162.9	153	0	0	111.1	S80 K131 C165 D166	S80-M84 PolarHBondContact O-N 3.14Å; M84-K131 PolarHBondContact O-NZ 2.9Å; M84-C165 CarbonylContact C-O 3.59Å; M84-C165 WeakPolarHBondContact CA-O 3.33Å; M84-C165 WeakPolarHBondContact CB-O 3.37Å; M84-C165 PolarHBondContact O-N 3.44Å; M84-C165 VanDerWaalsContact O-N 3.07Å; M84-D166 WeakPolarHBondContact CE-OD1 3.32Å
85	E	94.9	Very high	93.6	Very high	29 Å²	29	33.7 Å²	33.7	14%	0.136	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	161	-179.6	67.1	-158.2	-170.3	0	0	112.5	S80 N83 K131 T162 V163	S80-E85 PolarHBondContact N-O 3.32Å; S80-E85 PolarHBondContact O-N 3Å; N83-E85 HydrophobicContact CB-CG 3.71Å; N83-E85 VanDerWaalsContact CB-OE1 3.27Å; N83-E85 WeakPolarHBondContact CB-OE1 3.06Å; N83-E85 PolarHBondContact ND2-OE1 3.48Å; E85-K131 HydrophobicContact CB-CD 4.26Å; E85-K131 WeakPolarHBondContact OE2-CD 3.46Å; E85-K131 WeakPolarHBondContact OE2-CE 3.31Å; E85-K131 IonicContact OE2-NZ 3.38Å; E85-K131 PolarHBondContact OE2-NZ 3.37Å; E85-T162 HydrophobicContact CB-CG2 3.95Å; E85-T162 HydrophobicContact CG-CG2 3.83Å; E85-V163 CarbonylContact C-O 3.53Å; E85-V163 WeakPolarHBondContact CA-O 3.34Å; E85-V163 VanDerWaalsContact CB-O 3.31Å; E85-V163 WeakPolarHBondContact CB-O 3.31Å
86	Y	95.5	Very high	93.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	150.9	166	66.5	-92.2	0	0	0	110.1	I76 H78 M88 T162 V163 C165 C179 M180 F242	I76-Y86 HydrophobicContact CG2-CD2 4.42Å; H78-Y86 CarbonylContact O-C 3.59Å; H78-Y86 VanDerWaalsContact O-CA 3.25Å; H78-Y86 WeakPolarHBondContact O-CA 3.4Å; Y86-M88 HydrophobicContact CD2-CB 4.19Å; Y86-M88 HydrophobicContact CD2-CE 4.36Å; Y86-M88 HydrophobicContact CD2-CG 4.25Å; Y86-M88 HydrophobicContact CE2-CB 4.08Å; Y86-M88 HydrophobicContact CE2-CE 3.54Å; Y86-M88 HydrophobicContact CE2-CG 3.7Å; Y86-M88 HydrophobicContact CE2-SD 3.84Å; Y86-T162 CarbonylContact O-C 3.56Å; Y86-T162 WeakPolarHBondContact O-CA 3.44Å; Y86-V163 HydrophobicContact CD2-CB 4.46Å; Y86-V163 HydrophobicContact CE1-CB 3.98Å; Y86-V163 HydrophobicContact CE1-CG1 4.02Å; Y86-V163 HydrophobicContact CE2-CB 3.83Å; Y86-V163 HydrophobicContact CE2-CG1 4.44Å; Y86-V163 HydrophobicContact CE2-CG2 4.13Å; Y86-V163 PolarHBondContact N-O 3.43Å; Y86-V163 PolarHBondContact O-N 3.08Å; Y86-V163 WeakPolarHBondContact OH-CG1 3.29Å; Y86-C165 HydrophobicContact CD1-CB 3.67Å; Y86-C165 HydrophobicContact CE1-CB 3.83Å; Y86-C179 HydrophobicContact CD1-CB 4.01Å; Y86-C179 HydrophobicContact CE1-CB 3.66Å; Y86-M180 PolarHBondContact OH-O 3.24Å; Y86-F242 HydrophobicContact CD2-CZ 4.4Å; Y86-F242 HydrophobicContact CE1-CZ 4.05Å; Y86-F242 HydrophobicContact CE2-CE1 4.47Å; Y86-F242 AromaticContact CE2-CZ 3.95Å; Y86-F242 HydrophobicContact CE2-CZ 3.95Å; Y86-F242 AromaticContact CZ-CZ 3.73Å
87	T	96.4	Very high	93.7	Very high	20 Å²	20	35.7 Å²	35.7	12%	0.123	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	124.9	172.2	-56.4	0	0	0	0	108.8	I76 D77 H78 W134 T160 S161 T162	I76-T87 CarbonylContact C-O 3.58Å; D77-T87 PolarHBondContact N-O 2.94Å; H78-T87 PolarHBondContact O-N 3.48Å; T87-W134 HydrophobicContact CG2-CH2 4.42Å; T87-T160 HydrophobicContact CG2-CG2 3.53Å; T87-S161 WeakPolarHBondContact CA-O 3.41Å; T87-T162 PolarHBondContact OG1-OG1 2.88Å
88	M	95.6	Very high	94	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	148.2	173.2	64.4	168.4	30.4	0	0	111.5	S75 I76 Y86 V90 T160 S161 L181 F242	S75-M88 WeakPolarHBondContact O-CA 3.42Å; I76-M88 HydrophobicContact CD1-CE 4.41Å; I76-M88 HydrophobicContact CG1-CB 4.12Å; I76-M88 HydrophobicContact CG1-CE 4.31Å; Y86-M88 HydrophobicContact CD2-CB 4.19Å; Y86-M88 HydrophobicContact CD2-CE 4.36Å; Y86-M88 HydrophobicContact CD2-CG 4.25Å; Y86-M88 HydrophobicContact CE2-CB 4.08Å; Y86-M88 HydrophobicContact CE2-CE 3.54Å; Y86-M88 HydrophobicContact CE2-CG 3.7Å; Y86-M88 HydrophobicContact CE2-SD 3.84Å; M88-V90 HydrophobicContact CG-CG1 4.13Å; M88-V90 HydrophobicContact SD-CG1 3.67Å; M88-T160 WeakPolarHBondContact O-CA 3.32Å; M88-S161 PolarHBondContact N-O 2.91Å; M88-S161 PolarHBondContact O-N 3.08Å; M88-L181 HydrophobicContact SD-CB 4.28Å; M88-L181 HydrophobicContact SD-CD1 3.98Å; M88-L181 HydrophobicContact SD-CD2 3.79Å; M88-L181 HydrophobicContact SD-CG 4.24Å; M88-F242 HydrophobicContact CE-CE1 3.78Å; M88-F242 HydrophobicContact CE-CZ 3.86Å
89	T	96.1	Very high	94.2	Very high	6 Å²	6	31.6 Å²	31.6	4%	0.037	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	123.7	171.7	-59.2	0	0	0	0	108.9	A74 S75 D77 R158 I159 T160	A74-T89 HydrophobicContact CB-CG2 4.21Å; A74-T89 WeakPolarHBondContact CB-O 3.38Å; A74-T89 PolarHBondContact N-O 3.5Å; S75-T89 PolarHBondContact N-O 3.02Å; S75-T89 PolarHBondContact O-N 3.4Å; S75-T89 WeakPolarHBondContact OG-CB 3.49Å; D77-T89 PolarHBondContact OD2-OG1 3.33Å; T89-R158 HydrophobicContact CG2-CG 4.34Å; T89-I159 WeakPolarHBondContact CA-O 3.48Å; T89-T160 WeakPolarHBondContact CG2-OG1 3.28Å; T89-T160 PolarHBondContact OG1-OG1 3.32Å
90	V	96.3	Very high	94.2	Very high	5 Å²	5	34.6 Å²	34.6	3%	0.03	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	151.3	-175.7	-60.5	0	0	0	0	111.7	I71 E72 V73 M88 I159	I71-V90 HydrophobicContact CG2-CB 4.05Å; I71-V90 HydrophobicContact CG2-CG1 3.97Å; E72-V90 CarbonylContact O-C 3.51Å; E72-V90 WeakPolarHBondContact O-CA 3.4Å; V73-V90 HydrophobicContact CG1-CG1 4.46Å; V73-V90 HydrophobicContact CG2-CG1 4.28Å; M88-V90 HydrophobicContact CG-CG1 4.13Å; M88-V90 HydrophobicContact SD-CG1 3.67Å; V90-I159 HydrophobicContact CG2-CB 4.19Å; V90-I159 PolarHBondContact N-O 2.87Å; V90-I159 PolarHBondContact O-N 3.01Å
91	F	96.3	Very high	94.2	Very high	61 Å²	61	34.1 Å²	34.1	27%	0.268	17%	0.171	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	109.6	159.6	-58.7	-82.2	0	0	0	108.3	E72 A74 S157 R158	E72-F91 HydrophobicContact CB-CB 4.27Å; E72-F91 HydrophobicContact CB-CD2 4.46Å; E72-F91 HydrophobicContact CG-CD2 4.22Å; E72-F91 PolarHBondContact N-O 3.47Å; E72-F91 PolarHBondContact O-N 2.9Å; A74-F91 HydrophobicContact CB-CD2 4.16Å; A74-F91 HydrophobicContact CB-CE2 3.73Å; F91-S157 CarbonylContact C-O 3.56Å; F91-S157 WeakPolarHBondContact CA-O 3.44Å; F91-R158 HydrophobicContact CD1-CB 3.81Å; F91-R158 HydrophobicContact CD1-CG 3.89Å; F91-R158 HydrophobicContact CE1-CB 3.77Å; F91-R158 HydrophobicContact CE1-CG 3.59Å; F91-R158 HydrophobicContact CZ-CG 4.21Å
92	L	96.5	Very high	94.2	Very high	8 Å²	8	35.7 Å²	35.7	4%	0.042	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	114.7	175.8	179.1	61.1	0	0	0	109	M69 I71 Q94 T125 S156 S157 I159 L183	M69-L92 HydrophobicContact CE-CD1 3.92Å; I71-L92 HydrophobicContact CG1-CD1 3.9Å; L92-Q94 HydrophobicContact CG-CG 4.13Å; L92-T125 HydrophobicContact CD2-CG2 4.42Å; L92-S156 CarbonylContact O-C 3.57Å; L92-S156 WeakPolarHBondContact O-CA 3.39Å; L92-S157 PolarHBondContact N-O 3.19Å; L92-S157 PolarHBondContact O-N 3.01Å; L92-I159 HydrophobicContact CB-CD1 4.05Å; L92-I159 HydrophobicContact CD2-CD1 3.92Å; L92-L183 HydrophobicContact CD1-CD1 3.61Å
93	R	96.3	Very high	94.2	Very high	53 Å²	53	33.8 Å²	33.8	20%	0.2	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	134.9	174.9	-63.8	-174.7	178.4	97.3	2.8	109.8	I29 A70 E72 L154 Y155	I29-R93 HydrophobicContact CD1-CB 4.39Å; A70-R93 HydrophobicContact CB-CB 4.28Å; A70-R93 PolarHBondContact N-O 3.4Å; A70-R93 PolarHBondContact O-N 3.46Å; E72-R93 IonicContact OE2-CZ 2.98Å; E72-R93 IonicContact OE2-NH1 2.74Å; E72-R93 PolarHBondContact OE2-NH1 2.67Å; E72-R93 IonicContact OE2-NH2 2.92Å; E72-R93 PolarHBondContact OE2-NH2 3.32Å; R93-L154 HydrophobicContact CB-CD1 4.31Å; R93-Y155 CarbonylContact C-O 3.22Å; R93-Y155 WeakPolarHBondContact CA-O 3.35Å
94	Q	96.6	Very high	93.8	Very high	9 Å²	9	37 Å²	37	4%	0.042	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135	125.5	-180	-43.6	-168.8	44.2	0	0	107.1	V67 A68 M69 L92 W96 T125 Y155	V67-Q94 HydrophobicContact CG1-CB 4.3Å; A68-Q94 WeakPolarHBondContact O-CA 3.48Å; M69-Q94 HydrophobicContact CE-CG 3.9Å; M69-Q94 HydrophobicContact SD-CB 3.82Å; M69-Q94 HydrophobicContact SD-CG 3.57Å; M69-Q94 VanDerWaalsContact SD-CG 3.57Å; L92-Q94 HydrophobicContact CG-CG 4.13Å; Q94-W96 HydrophobicContact CB-CE3 4.42Å; Q94-W96 HydrophobicContact CB-CZ3 4.26Å; Q94-T125 PolarHBondContact OE1-OG1 3Å; Q94-Y155 PolarHBondContact N-O 2.88Å; Q94-Y155 PolarHBondContact O-N 2.94Å
95	S	96.6	Very high	93	Very high	6 Å²	6	40.6 Å²	40.6	4%	0.042	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.4	-179.3	-161.4	0	0	0	0	108.9	D28 V67 A68 I153	D28-S95 WeakPolarHBondContact O-CB 3.43Å; D28-S95 PolarHBondContact O-OG 3.17Å; V67-S95 CarbonylContact C-O 3.6Å; V67-S95 WeakPolarHBondContact CA-O 3.49Å; A68-S95 PolarHBondContact N-O 2.93Å; A68-S95 PolarHBondContact O-N 3.43Å; S95-I153 VanDerWaalsContact CA-O 3.3Å; S95-I153 WeakPolarHBondContact CA-O 3.43Å
96	W	96.1	Very high	92.1	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.015	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.2	167.2	177.6	72.9	93.2	0	0	0	111.3	V65 V67 Q94 W121 L122 P123 V152 I153	V65-W96 HydrophobicContact CG1-CB 4.13Å; V67-W96 HydrophobicContact CB-CB 4.43Å; V67-W96 HydrophobicContact CG1-CB 4.39Å; V67-W96 HydrophobicContact CG2-CB 3.85Å; Q94-W96 HydrophobicContact CB-CE3 4.42Å; Q94-W96 HydrophobicContact CB-CZ3 4.26Å; W96-W121 AromaticContact CD1-CZ3 3.93Å; W96-W121 HydrophobicContact CD2-CZ3 4.46Å; W96-W121 HydrophobicContact CG-CZ3 4.35Å; W96-W121 WeakPolarHBondContact CZ2-O 3.36Å; W96-W121 AromaticContact NE1-CE3 3.77Å; W96-W121 AromaticContact NE1-CZ3 3.77Å; W96-L122 HydrophobicContact CH2-CD2 3.62Å; W96-L122 HydrophobicContact CZ2-CD2 4.05Å; W96-P123 HydrophobicContact CE3-CG 4.34Å; W96-P123 HydrophobicContact CZ3-CG 4.3Å; W96-V152 CarbonylContact O-C 3.53Å; W96-V152 WeakPolarHBondContact O-CA 3.14Å; W96-I153 HydrophobicContact CD2-CB 4.27Å; W96-I153 HydrophobicContact CH2-CB 4.31Å; W96-I153 HydrophobicContact CH2-CG2 3.94Å; W96-I153 HydrophobicContact CZ2-CB 3.97Å; W96-I153 HydrophobicContact CZ2-CD1 3.74Å; W96-I153 HydrophobicContact CZ2-CG1 4.39Å; W96-I153 HydrophobicContact CZ2-CG2 3.9Å; W96-I153 HydrophobicContact CZ3-CG2 4.48Å; W96-I153 PolarHBondContact N-O 3.38Å; W96-I153 VanDerWaalsContact N-O 3.07Å; W96-I153 PolarHBondContact O-N 2.96Å
97	H	95.4	Very high	91.4	Very high	80 Å²	80	47.7 Å²	47.7	37%	0.37	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	129.8	-179.1	-173.2	-130.1	0	0	0	111.4	D99 N150 V152	H97-D99 IonicContact CE1-OD1 2.71Å; H97-D99 PolarHBondContact CE1-OD1 2.88Å; H97-D99 IonicContact NE2-OD1 3.18Å; H97-N150 PolarHBondContact CD2-O 3.37Å; H97-N150 PolarHBondContact NE2-O 3.09Å; H97-V152 HydrophobicContact CB-CG2 4.41Å
98	D	94.9	Very high	90.7	Very high	2 Å²	2	49.9 Å²	49.9	1%	0.011	25%	0.247	C	C	.	.			trans	-133.9	95.9	173.6	-169.1	-9.2	0	0	0	109.8	Y52 P58 R100 L101 G151 I153	Y52-D98 WeakPolarHBondContact CE2-OD2 3.31Å; Y52-D98 PolarHBondContact OH-OD2 2.9Å; P58-D98 HydrophobicContact CB-CB 4.34Å; P58-D98 HydrophobicContact CG-CB 3.94Å; D98-R100 PolarHBondContact O-N 3.25Å; D98-R100 VanDerWaalsContact OD1-CB 3.3Å; D98-R100 WeakPolarHBondContact OD1-CB 3.29Å; D98-R100 WeakPolarHBondContact OD1-CG 3.39Å; D98-R100 IonicContact OD1-CZ 3.54Å; D98-R100 PolarHBondContact OD1-N 2.92Å; D98-R100 IonicContact OD1-NE 2.77Å; D98-R100 PolarHBondContact OD1-NE 2.9Å; D98-R100 IonicContact OD1-NH2 3.46Å; D98-R100 PolarHBondContact OD1-NH2 3.48Å; D98-R100 IonicContact OD2-CZ 3.46Å; D98-R100 IonicContact OD2-NE 3.35Å; D98-R100 PolarHBondContact OD2-NE 3.37Å; D98-R100 IonicContact OD2-NH2 2.75Å; D98-R100 PolarHBondContact OD2-NH2 3.41Å; D98-L101 PolarHBondContact O-N 3.27Å; D98-G151 PolarHBondContact N-O 2.77Å; D98-I153 HydrophobicContact CB-CD1 3.99Å; D98-I153 HydrophobicContact CB-CG1 4.47Å
99	D	91.8	Very high	90.2	Very high	111 Å²	111	52.7 Å²	52.7	59%	0.594	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-48.7	-31.4	179.1	-73.6	-53.4	0	0	0	113.6	H97 L101 S102	H97-D99 IonicContact CE1-OD1 2.71Å; H97-D99 PolarHBondContact CE1-OD1 2.88Å; H97-D99 IonicContact NE2-OD1 3.18Å; D99-L101 PolarHBondContact O-N 3.01Å; D99-L101 VanDerWaalsContact O-N 3.16Å; D99-S102 WeakPolarHBondContact O-CB 3.44Å; D99-S102 PolarHBondContact O-N 3.44Å; D99-S102 VanDerWaalsContact O-N 3.14Å; D99-S102 PolarHBondContact O-OG 3.3Å
100	R	92.3	Very high	89.8	Confident	85 Å²	85	53.4 Å²	53.4	32%	0.321	27%	0.268	S	S	.	.	G	3₁₀ helix	trans	-63.5	-19.4	-178.1	-57.4	174.9	-67.7	-172.8	2.1	113	Y52 A53 F56 D98	Y52-R100 HydrophobicContact CD2-CB 3.95Å; Y52-R100 HydrophobicContact CE2-CB 4Å; Y52-R100 PolarHBondContact OH-NH2 3.31Å; A53-R100 PolarHBondContact O-NH1 3.22Å; F56-R100 PolarHBondContact O-NH1 2.88Å; F56-R100 PolarHBondContact O-NH2 3.45Å; D98-R100 PolarHBondContact O-N 3.25Å; D98-R100 VanDerWaalsContact OD1-CB 3.3Å; D98-R100 WeakPolarHBondContact OD1-CB 3.29Å; D98-R100 WeakPolarHBondContact OD1-CG 3.39Å; D98-R100 IonicContact OD1-CZ 3.54Å; D98-R100 PolarHBondContact OD1-N 2.92Å; D98-R100 IonicContact OD1-NE 2.77Å; D98-R100 PolarHBondContact OD1-NE 2.9Å; D98-R100 IonicContact OD1-NH2 3.46Å; D98-R100 PolarHBondContact OD1-NH2 3.48Å; D98-R100 IonicContact OD2-CZ 3.46Å; D98-R100 IonicContact OD2-NE 3.35Å; D98-R100 PolarHBondContact OD2-NE 3.37Å; D98-R100 IonicContact OD2-NH2 2.75Å; D98-R100 PolarHBondContact OD2-NH2 3.41Å
101	L	90.9	Very high	89.4	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-111	13.3	-179.8	-56.6	-179.7	0	0	0	112.9	L48 M49 Y52 D98 D99 L120 L147 I153	L48-L101 HydrophobicContact CG-CD2 4.27Å; M49-L101 HydrophobicContact SD-CD2 3.86Å; Y52-L101 HydrophobicContact CD2-CD2 3.63Å; Y52-L101 HydrophobicContact CD2-CG 4.2Å; Y52-L101 HydrophobicContact CE2-CD1 4.09Å; Y52-L101 HydrophobicContact CE2-CD2 3.72Å; Y52-L101 HydrophobicContact CE2-CG 3.79Å; Y52-L101 HydrophobicContact CG-CD2 4.45Å; D98-L101 PolarHBondContact O-N 3.27Å; D99-L101 PolarHBondContact O-N 3.01Å; D99-L101 VanDerWaalsContact O-N 3.16Å; L101-L120 HydrophobicContact CD1-CD1 4.39Å; L101-L120 HydrophobicContact CD1-CD2 3.64Å; L101-L120 HydrophobicContact CD2-CD2 4.43Å; L101-L147 HydrophobicContact CB-CD1 3.75Å; L101-L147 HydrophobicContact CB-CD2 4.17Å; L101-L147 HydrophobicContact CD1-CD1 4.26Å; L101-I153 HydrophobicContact CD1-CD1 3.59Å; L101-I153 HydrophobicContact CD1-CG1 4.47Å
102	S	90.1	Very high	88.9	Confident	53 Å²	53	55 Å²	55	37%	0.371	29%	0.294	S	S	.	.			trans	-65.8	144.4	171.1	60	0	0	0	0	111.6	L48 D99 P149	L48-S102 WeakPolarHBondContact CD1-O 3.45Å; D99-S102 WeakPolarHBondContact O-CB 3.44Å; D99-S102 PolarHBondContact O-N 3.44Å; D99-S102 VanDerWaalsContact O-N 3.14Å; D99-S102 PolarHBondContact O-OG 3.3Å; S102-P149 WeakPolarHBondContact CA-O 3.45Å
103	Y	86.5	Confident	88.6	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.035	31%	0.311	C	S	.	.			trans	-142.8	134.2	178.9	60.1	-91	0	0	0	112	T106 K108 L110 L147 Q148 P149	Y103-T106 WeakPolarHBondContact CE2-O 3.48Å; Y103-T106 WeakPolarHBondContact CE2-OG1 3.39Å; Y103-K108 PolarHBondContact OH-O 3.5Å; Y103-L110 HydrophobicContact CD1-CD1 4.25Å; Y103-L110 HydrophobicContact CE1-CD1 3.69Å; Y103-L110 HydrophobicContact CE1-CG 4.28Å; Y103-L110 HydrophobicContact CE2-CD1 4.03Å; Y103-L110 HydrophobicContact CE2-CG 4.32Å; Y103-L147 HydrophobicContact CD1-CD2 3.99Å; Y103-L147 HydrophobicContact CD1-CG 4.43Å; Y103-L147 HydrophobicContact CE1-CD2 3.79Å; Y103-L147 HydrophobicContact CE1-CG 3.87Å; Y103-L147 PolarHBondContact OH-O 3.16Å; Y103-Q148 WeakPolarHBondContact CE1-O 3.36Å; Y103-P149 HydrophobicContact CD2-CB 4.38Å; Y103-P149 HydrophobicContact CE2-CB 3.92Å; Y103-P149 HydrophobicContact CE2-CG 3.9Å; Y103-P149 VanDerWaalsContact CZ-CA 3.47Å; Y103-P149 PolarHBondContact N-O 3.19Å; Y103-P149 WeakPolarHBondContact OH-CD 3.47Å
104	N	82.4	Confident	88.2	Confident	158 Å²	158	56.3 Å²	56.3	85%	0.845	31%	0.306	S	S	*	.	S	Bend	trans	-99.4	5.6	-176.7	-67.8	-31	0	0	0	113.8
105	H	75.8	Confident	87.8	Confident	150 Å²	150	64 Å²	64	69%	0.694	34%	0.335	S	S	*	.	S	Bend	trans	-79.3	-28.3	-174.9	-65	-67.1	0	0	0	113.9
106	T	75.5	Confident	87.4	Confident	19 Å²	19	64.5 Å²	64.5	12%	0.117	34%	0.336	C	S	.	.			trans	-148.5	149.1	179.2	63.6	0	0	0	0	111	W41 Y103 K108 P149	W41-T106 HydrophobicContact CB-CG2 4.32Å; W41-T106 HydrophobicContact CG-CG2 4.22Å; Y103-T106 WeakPolarHBondContact CE2-O 3.48Å; Y103-T106 WeakPolarHBondContact CE2-OG1 3.39Å; T106-K108 PolarHBondContact O-N 2.93Å; T106-P149 WeakPolarHBondContact O-CB 3.34Å; T106-P149 VanDerWaalsContact O-CG 3.31Å; T106-P149 WeakPolarHBondContact O-CG 3.38Å
107	N	80.9	Confident	87.1	Confident	159 Å²	159	64.4 Å²	64.4	85%	0.85	34%	0.336	S	S	*	.	S	Bend	trans	-89.4	19.2	173.3	-66.6	-9	0	0	0	112.5
108	K	82.1	Confident	86.8	Confident	67 Å²	67	64.9 Å²	64.9	29%	0.291	34%	0.341	S	S	.	.	S	Bend	trans	-108	138.1	-175.4	-65.2	-171.5	177.3	-157.3	0	110.4	T35 D36 Y103 T106 L110	T35-K108 WeakPolarHBondContact OG1-CD 3.41Å; T35-K108 VanDerWaalsContact OG1-CE 3.25Å; T35-K108 WeakPolarHBondContact OG1-CE 3.19Å; T35-K108 PolarHBondContact OG1-NZ 3.23Å; D36-K108 PolarHBondContact O-NZ 3.49Å; Y103-K108 PolarHBondContact OH-O 3.5Å; T106-K108 PolarHBondContact O-N 2.93Å; K108-L110 PolarHBondContact O-N 3.38Å
109	T	85.8	Confident	86.6	Confident	60 Å²	60	70.1 Å²	70.1	37%	0.368	36%	0.363	S	S	.	.	P	Polyproline II helix	trans	-66.8	128	173.5	-52.2	0	0	0	0	110.9	R146 L147 Q148	T109-R146 HydrophobicContact CG2-CB 3.88Å; T109-R146 HydrophobicContact CG2-CG 4.48Å; T109-L147 CarbonylContact C-O 3.56Å; T109-L147 WeakPolarHBondContact CA-O 3.48Å; T109-L147 WeakPolarHBondContact CG2-O 3.28Å; T109-Q148 HydrophobicContact CG2-CG 4.09Å
110	L	86.4	Confident	86.7	Confident	22 Å²	22	65.3 Å²	65.3	12%	0.115	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	118	177.8	-62.1	170.8	0	0	0	110.1	P43 Y103 K108 L112 R146 L147	P43-L110 HydrophobicContact CG-CD1 3.64Å; Y103-L110 HydrophobicContact CD1-CD1 4.25Å; Y103-L110 HydrophobicContact CE1-CD1 3.69Å; Y103-L110 HydrophobicContact CE1-CG 4.28Å; Y103-L110 HydrophobicContact CE2-CD1 4.03Å; Y103-L110 HydrophobicContact CE2-CG 4.32Å; K108-L110 PolarHBondContact O-N 3.38Å; L110-L112 HydrophobicContact CB-CD2 4.18Å; L110-R146 CarbonylContact O-C 3.58Å; L110-R146 VanDerWaalsContact O-CA 3.3Å; L110-R146 WeakPolarHBondContact O-CA 3.37Å; L110-L147 PolarHBondContact N-O 3.17Å; L110-L147 PolarHBondContact O-N 2.95Å
111	G	87.2	Confident	86.8	Confident	64 Å²	64	61.6 Å²	61.6	66%	0.66	32%	0.324	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	119.1	164.5	0	0	0	0	0	109.6
112	L	87.7	Confident	87	Confident	36 Å²	36	64 Å²	64	19%	0.188	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	156.9	-178.1	-55	175.4	0	0	0	110.8	L45 L110 F116 I145 L147	L45-L112 HydrophobicContact CD1-CD1 4.39Å; L45-L112 HydrophobicContact CD2-CD2 4.34Å; L110-L112 HydrophobicContact CB-CD2 4.18Å; L112-F116 HydrophobicContact CB-CB 4.43Å; L112-F116 HydrophobicContact CB-CD1 4.35Å; L112-F116 HydrophobicContact CD1-CD1 3.5Å; L112-F116 VanDerWaalsContact CD1-CD1 3.5Å; L112-F116 HydrophobicContact CD1-CE1 3.55Å; L112-F116 HydrophobicContact CD1-CG 4.3Å; L112-F116 HydrophobicContact CD1-CZ 4.4Å; L112-I145 HydrophobicContact CB-CG2 3.94Å; L112-I145 PolarHBondContact N-O 3.41Å; L112-L147 HydrophobicContact CD1-CB 4.33Å
113	D	88.4	Confident	87.3	Confident	76 Å²	76	62 Å²	62	41%	0.406	32%	0.322	S	S	.	.			trans	-65.6	142.8	177.3	-174	-72.8	0	0	0	111.4	R115 F116	D113-R115 PolarHBondContact O-N 3.47Å; D113-R115 VanDerWaalsContact O-N 3.08Å; D113-R115 VanDerWaalsContact OD1-CB 3.32Å; D113-R115 WeakPolarHBondContact OD1-CB 3.25Å; D113-R115 WeakPolarHBondContact OD1-CG 3.18Å; D113-R115 IonicContact OD1-CZ 3.62Å; D113-R115 PolarHBondContact OD1-N 2.63Å; D113-R115 IonicContact OD1-NE 2.81Å; D113-R115 PolarHBondContact OD1-NE 3.03Å; D113-R115 IonicContact OD1-NH2 3.57Å; D113-R115 IonicContact OD2-CZ 3.52Å; D113-R115 IonicContact OD2-NE 3.49Å; D113-R115 PolarHBondContact OD2-NE 2.95Å; D113-R115 IonicContact OD2-NH2 2.71Å; D113-R115 PolarHBondContact OD2-NH2 2.89Å; D113-F116 VanDerWaalsContact O-CB 3.23Å; D113-F116 WeakPolarHBondContact O-CB 3.46Å; D113-F116 PolarHBondContact O-N 3.34Å
114	S	88.2	Confident	87.7	Confident	11 Å²	11	64 Å²	64	8%	0.077	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-48.7	-35.3	177.8	59.6	0	0	0	0	114.2	F116 V117 K143	S114-F116 PolarHBondContact O-N 3.35Å; S114-V117 WeakPolarHBondContact O-CB 3.48Å; S114-V117 WeakPolarHBondContact O-CG2 3.48Å; S114-V117 PolarHBondContact O-N 3.19Å; S114-V117 VanDerWaalsContact O-N 3.13Å; S114-K143 WeakPolarHBondContact CB-O 3.22Å
115	R	88.1	Confident	88.3	Confident	172 Å²	172	57.8 Å²	57.8	65%	0.649	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-67.9	-13.4	179.1	-64.5	168.3	-72	176.7	-4.3	113.8	D113 V117	D113-R115 PolarHBondContact O-N 3.47Å; D113-R115 VanDerWaalsContact O-N 3.08Å; D113-R115 VanDerWaalsContact OD1-CB 3.32Å; D113-R115 WeakPolarHBondContact OD1-CB 3.25Å; D113-R115 WeakPolarHBondContact OD1-CG 3.18Å; D113-R115 IonicContact OD1-CZ 3.62Å; D113-R115 PolarHBondContact OD1-N 2.63Å; D113-R115 IonicContact OD1-NE 2.81Å; D113-R115 PolarHBondContact OD1-NE 3.03Å; D113-R115 IonicContact OD1-NH2 3.57Å; D113-R115 IonicContact OD2-CZ 3.52Å; D113-R115 IonicContact OD2-NE 3.49Å; D113-R115 PolarHBondContact OD2-NE 2.95Å; D113-R115 IonicContact OD2-NH2 2.71Å; D113-R115 PolarHBondContact OD2-NH2 2.89Å; R115-V117 VanDerWaalsContact C-N 3.3Å
116	F	88.1	Confident	89.3	Confident	16 Å²	16	53.9 Å²	53.9	7%	0.07	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-73.8	-26	174.4	-167.9	-109.2	0	0	0	112.2	L45 M49 L112 D113 S114 D118 K119 L120	L45-F116 HydrophobicContact CD1-CE1 4.3Å; L45-F116 HydrophobicContact CD1-CE2 3.96Å; L45-F116 HydrophobicContact CD1-CZ 3.63Å; L45-F116 HydrophobicContact CD2-CD2 3.76Å; L45-F116 HydrophobicContact CD2-CE2 3.49Å; L45-F116 VanDerWaalsContact CD2-CE2 3.49Å; L45-F116 HydrophobicContact CD2-CG 4.48Å; L45-F116 HydrophobicContact CD2-CZ 4Å; L45-F116 HydrophobicContact CG-CD2 4.4Å; L45-F116 HydrophobicContact CG-CE2 3.62Å; L45-F116 HydrophobicContact CG-CZ 3.86Å; M49-F116 HydrophobicContact CE-CZ 4.37Å; M49-F116 HydrophobicContact CG-CE2 3.81Å; M49-F116 HydrophobicContact CG-CZ 3.63Å; M49-F116 HydrophobicContact SD-CE1 4.36Å; M49-F116 HydrophobicContact SD-CE2 4.14Å; M49-F116 HydrophobicContact SD-CZ 3.5Å; M49-F116 VanDerWaalsContact SD-CZ 3.5Å; L112-F116 HydrophobicContact CB-CB 4.43Å; L112-F116 HydrophobicContact CB-CD1 4.35Å; L112-F116 HydrophobicContact CD1-CD1 3.5Å; L112-F116 VanDerWaalsContact CD1-CD1 3.5Å; L112-F116 HydrophobicContact CD1-CE1 3.55Å; L112-F116 HydrophobicContact CD1-CG 4.3Å; L112-F116 HydrophobicContact CD1-CZ 4.4Å; D113-F116 VanDerWaalsContact O-CB 3.23Å; D113-F116 WeakPolarHBondContact O-CB 3.46Å; D113-F116 PolarHBondContact O-N 3.34Å; S114-F116 PolarHBondContact O-N 3.35Å; F116-D118 PolarHBondContact O-N 3.33Å; F116-K119 HydrophobicContact CD2-CD 4.23Å; F116-K119 HydrophobicContact CE2-CD 4.33Å; F116-K119 WeakPolarHBondContact O-CB 3.37Å; F116-K119 PolarHBondContact O-N 3.12Å; F116-L120 HydrophobicContact CD1-CD1 3.84Å; F116-L120 HydrophobicContact CD1-CD2 4.39Å; F116-L120 HydrophobicContact CD1-CG 4.08Å; F116-L120 HydrophobicContact CE1-CD1 3.81Å; F116-L120 HydrophobicContact CE1-CD2 3.73Å; F116-L120 HydrophobicContact CE1-CG 3.92Å; F116-L120 HydrophobicContact CZ-CD2 4.18Å
117	V	90.3	Very high	90.3	Very high	2 Å²	2	54.1 Å²	54.1	1%	0.012	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-54.4	-40.1	179.9	174	0	0	0	0	111.6	S114 R115 K119 L120 L122 K143 I145 Y155	S114-V117 WeakPolarHBondContact O-CB 3.48Å; S114-V117 WeakPolarHBondContact O-CG2 3.48Å; S114-V117 PolarHBondContact O-N 3.19Å; S114-V117 VanDerWaalsContact O-N 3.13Å; R115-V117 VanDerWaalsContact C-N 3.3Å; V117-K119 PolarHBondContact O-N 3.06Å; V117-K119 VanDerWaalsContact O-N 3.11Å; V117-L120 PolarHBondContact O-N 3.37Å; V117-L120 VanDerWaalsContact O-N 3.08Å; V117-L122 HydrophobicContact CG1-CD1 3.58Å; V117-L122 HydrophobicContact CG1-CD2 4.17Å; V117-L122 HydrophobicContact CG1-CG 4.4Å; V117-K143 HydrophobicContact CG1-CD 4.3Å; V117-K143 HydrophobicContact CG2-CB 4.44Å; V117-I145 HydrophobicContact CG2-CB 4.07Å; V117-I145 HydrophobicContact CG2-CD1 4.23Å; V117-I145 HydrophobicContact CG2-CG2 3.83Å; V117-Y155 HydrophobicContact CG1-CD2 4.43Å; V117-Y155 HydrophobicContact CG1-CE2 3.75Å; V117-Y155 HydrophobicContact CG2-CD2 4.27Å; V117-Y155 HydrophobicContact CG2-CE2 3.98Å
118	D	89.5	Confident	91	Very high	89 Å²	89	48.8 Å²	48.8	48%	0.476	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-64.4	-17.9	-179.6	-60.8	-23	0	0	0	113.8	R54 F116 K143	R54-D118 PolarHBondContact NH1-O 2.91Å; F116-D118 PolarHBondContact O-N 3.33Å; D118-K143 IonicContact OD1-NZ 2.67Å
119	K	91.1	Very high	91.7	Very high	112 Å²	112	47 Å²	47	49%	0.487	25%	0.249	S	C	.	.	G	3₁₀ helix	trans	-90	-11.1	177.9	-60.2	-175	179	-178.8	0	113.3	M49 R54 F116 V117	M49-K119 HydrophobicContact CE-CB 3.87Å; R54-K119 WeakPolarHBondContact CB-O 3.41Å; F116-K119 HydrophobicContact CD2-CD 4.23Å; F116-K119 HydrophobicContact CE2-CD 4.33Å; F116-K119 WeakPolarHBondContact O-CB 3.37Å; F116-K119 PolarHBondContact O-N 3.12Å; V117-K119 PolarHBondContact O-N 3.06Å; V117-K119 VanDerWaalsContact O-N 3.11Å
120	L	93.4	Very high	92.2	Very high	10 Å²	10	45.9 Å²	45.9	5%	0.052	25%	0.246	C	C	.	.	S	Bend	trans	-99	160.4	-173.8	-62.9	-176.4	0	0	0	112.6	M49 Y52 L101 F116 V117 I145	M49-L120 HydrophobicContact CE-CD2 3.96Å; M49-L120 HydrophobicContact SD-CD2 3.85Å; Y52-L120 HydrophobicContact CE1-CD2 4.07Å; L101-L120 HydrophobicContact CD1-CD1 4.39Å; L101-L120 HydrophobicContact CD1-CD2 3.64Å; L101-L120 HydrophobicContact CD2-CD2 4.43Å; F116-L120 HydrophobicContact CD1-CD1 3.84Å; F116-L120 HydrophobicContact CD1-CD2 4.39Å; F116-L120 HydrophobicContact CD1-CG 4.08Å; F116-L120 HydrophobicContact CE1-CD1 3.81Å; F116-L120 HydrophobicContact CE1-CD2 3.73Å; F116-L120 HydrophobicContact CE1-CG 3.92Å; F116-L120 HydrophobicContact CZ-CD2 4.18Å; V117-L120 PolarHBondContact O-N 3.37Å; V117-L120 VanDerWaalsContact O-N 3.08Å; L120-I145 HydrophobicContact CD1-CD1 3.29Å
121	W	95.3	Very high	92.6	Very high	8 Å²	8	50 Å²	50	3%	0.03	26%	0.263	C	S	.	.			trans	-72.9	139.7	160.1	178.6	86.6	0	0	0	108.7	Y52 R54 R57 P58 V65 W96 P123 Y188 I193	Y52-W121 PolarHBondContact OH-N 3.33Å; Y52-W121 VanDerWaalsContact OH-N 3.12Å; R54-W121 WeakPolarHBondContact O-CB 3.4Å; R57-W121 HydrophobicContact CB-CH2 4.5Å; R57-W121 HydrophobicContact CB-CZ2 3.72Å; P58-W121 HydrophobicContact CG-CD2 4.45Å; P58-W121 HydrophobicContact CG-CE3 3.88Å; P58-W121 HydrophobicContact CG-CZ3 4.07Å; V65-W121 HydrophobicContact CG1-CH2 4.44Å; V65-W121 HydrophobicContact CG1-CZ3 4.47Å; W96-W121 AromaticContact CD1-CZ3 3.93Å; W96-W121 HydrophobicContact CD2-CZ3 4.46Å; W96-W121 HydrophobicContact CG-CZ3 4.35Å; W96-W121 WeakPolarHBondContact CZ2-O 3.36Å; W96-W121 AromaticContact NE1-CE3 3.77Å; W96-W121 AromaticContact NE1-CZ3 3.77Å; W121-P123 HydrophobicContact CH2-CB 4.19Å; W121-Y188 HydrophobicContact CZ2-CD2 4.34Å; W121-Y188 AromaticContact CZ2-CE2 3.8Å; W121-Y188 HydrophobicContact CZ2-CE2 3.8Å; W121-Y188 AromaticContact NE1-CE2 3.88Å; W121-Y188 AromaticContact NE1-CZ 3.65Å; W121-Y188 PolarHBondContact NE1-OH 2.62Å; W121-I193 HydrophobicContact CH2-CD1 4.34Å
122	L	94.8	Very high	93	Very high	52 Å²	52	49.7 Å²	49.7	27%	0.272	25%	0.25	S	S	.	.			trans	-129.8	147.7	173.1	-58.6	173.3	0	0	0	108.8	W96 V117	W96-L122 HydrophobicContact CH2-CD2 3.62Å; W96-L122 HydrophobicContact CZ2-CD2 4.05Å; V117-L122 HydrophobicContact CG1-CD1 3.58Å; V117-L122 HydrophobicContact CG1-CD2 4.17Å; V117-L122 HydrophobicContact CG1-CG 4.4Å
123	P	95.6	Very high	93.4	Very high	10 Å²	10	50.6 Å²	50.6	7%	0.065	26%	0.264	C	S	.	.			trans	-60.3	138.8	164	28.4	-36.1	0	0	0	110.4	V67 W96 W121 T125 I193 Y195	V67-P123 HydrophobicContact CG1-CG 4.45Å; W96-P123 HydrophobicContact CE3-CG 4.34Å; W96-P123 HydrophobicContact CZ3-CG 4.3Å; W121-P123 HydrophobicContact CH2-CB 4.19Å; P123-T125 PolarHBondContact O-N 3.28Å; P123-T125 VanDerWaalsContact O-N 3.09Å; P123-I193 HydrophobicContact CB-CD1 3.75Å; P123-Y195 HydrophobicContact CB-CE1 4.4Å
124	D	94.6	Very high	93.8	Very high	52 Å²	52	52.9 Å²	52.9	28%	0.278	27%	0.267	S	S	.	.			trans	-87.6	43.7	-177.3	65.8	-10	0	0	0	112.4	F126 S185 Y186 G187 Y188	D124-F126 PolarHBondContact O-N 3.06Å; D124-S185 WeakPolarHBondContact OD1-CB 3.39Å; D124-S185 PolarHBondContact OD1-OG 3.33Å; D124-Y186 PolarHBondContact O-N 3.45Å; D124-Y186 PolarHBondContact OD1-N 3.27Å; D124-G187 WeakPolarHBondContact OD2-CA 3.26Å; D124-G187 PolarHBondContact OD2-N 3.09Å; D124-Y188 WeakPolarHBondContact OD1-CD2 3.41Å
125	T	96.2	Very high	94.1	Very high	27 Å²	27	57.5 Å²	57.5	17%	0.166	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	120.3	179.1	-50.9	0	0	0	0	110.9	M69 L92 Q94 P123 L183 E184 Y195	M69-T125 HydrophobicContact CE-CG2 3.63Å; L92-T125 HydrophobicContact CD2-CG2 4.42Å; Q94-T125 PolarHBondContact OE1-OG1 3Å; P123-T125 PolarHBondContact O-N 3.28Å; P123-T125 VanDerWaalsContact O-N 3.09Å; T125-L183 HydrophobicContact CG2-CB 4.11Å; T125-L183 HydrophobicContact CG2-CD1 4.49Å; T125-L183 HydrophobicContact CG2-CD2 4.29Å; T125-E184 WeakPolarHBondContact CA-O 3.43Å; T125-Y195 PolarHBondContact OG1-OH 3.48Å
126	F	95.5	Very high	94.4	Very high	68 Å²	68	51.1 Å²	51.1	30%	0.298	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	154.8	173.2	78.8	-73.5	0	0	0	111.4	D124 V128 L183 E184 Y186	D124-F126 PolarHBondContact O-N 3.06Å; F126-V128 HydrophobicContact CE2-CB 4.25Å; F126-V128 HydrophobicContact CE2-CG1 4.46Å; F126-V128 HydrophobicContact CE2-CG2 4Å; F126-V128 HydrophobicContact CZ-CG2 3.96Å; F126-L183 WeakPolarHBondContact O-CA 3.28Å; F126-E184 HydrophobicContact CD1-CB 4.46Å; F126-E184 WeakPolarHBondContact CD1-O 3.46Å; F126-E184 HydrophobicContact CE1-CB 3.84Å; F126-E184 HydrophobicContact CE1-CG 4.38Å; F126-E184 HydrophobicContact CZ-CB 4.28Å; F126-E184 PolarHBondContact N-O 3.12Å; F126-E184 PolarHBondContact O-N 3.19Å; F126-E184 VanDerWaalsContact O-N 3.12Å; F126-Y186 HydrophobicContact CD1-CD2 4.09Å; F126-Y186 HydrophobicContact CD1-CG 4.43Å; F126-Y186 AromaticContact CE1-CD2 3.98Å; F126-Y186 HydrophobicContact CE1-CD2 3.98Å; F126-Y186 HydrophobicContact CE2-CD2 4.42Å; F126-Y186 HydrophobicContact CG-CD2 4.39Å; F126-Y186 HydrophobicContact CZ-CD2 4.15Å
127	I	97.4	Very high	94.6	Very high	23 Å²	23	55.7 Å²	55.7	12%	0.118	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	111.8	174.1	-58.3	166.3	0	0	0	107.6	N129 A130 I159 V163 L181 D182 L183	I127-N129 VanDerWaalsContact C-N 3.34Å; I127-N129 PolarHBondContact O-N 3.11Å; I127-A130 HydrophobicContact CB-CB 3.77Å; I127-A130 HydrophobicContact CG2-CB 3.73Å; I127-A130 PolarHBondContact O-N 2.77Å; I127-I159 HydrophobicContact CD1-CG2 4.3Å; I127-V163 HydrophobicContact CG2-CG2 4.39Å; I127-L181 HydrophobicContact CD1-CD1 4.35Å; I127-L181 HydrophobicContact CG1-CD1 4.4Å; I127-L181 HydrophobicContact CG2-CD1 3.56Å; I127-D182 CarbonylContact C-O 3.44Å; I127-D182 VanDerWaalsContact CA-O 3.29Å; I127-D182 WeakPolarHBondContact CA-O 3.26Å; I127-L183 HydrophobicContact CB-CD2 4.44Å; I127-L183 HydrophobicContact CG1-CD2 3.65Å
128	V	95.5	Very high	94.7	Very high	48 Å²	48	61.1 Å²	61.1	29%	0.291	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-40.4	-168.9	-177.7	0	0	0	0	112.2	F126 D182 E184	F126-V128 HydrophobicContact CE2-CB 4.25Å; F126-V128 HydrophobicContact CE2-CG1 4.46Å; F126-V128 HydrophobicContact CE2-CG2 4Å; F126-V128 HydrophobicContact CZ-CG2 3.96Å; V128-D182 HydrophobicContact CB-CB 3.84Å; V128-D182 HydrophobicContact CG2-CB 4.02Å; V128-D182 PolarHBondContact N-O 3.32Å; V128-E184 HydrophobicContact CG2-CB 3.51Å
129	N	96.1	Very high	94.7	Very high	29 Å²	29	63.5 Å²	63.5	16%	0.155	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	16.4	-176.9	60.2	-26.3	0	0	0	113.7	I127 K131 V163 A164 M180 D182	I127-N129 VanDerWaalsContact C-N 3.34Å; I127-N129 PolarHBondContact O-N 3.11Å; N129-K131 PolarHBondContact O-N 2.95Å; N129-V163 HydrophobicContact CB-CG1 4.19Å; N129-V163 WeakPolarHBondContact ND2-CG1 3.49Å; N129-V163 WeakPolarHBondContact O-CA 3.28Å; N129-V163 WeakPolarHBondContact OD1-CG1 3.27Å; N129-A164 PolarHBondContact ND2-O 3.44Å; N129-A164 PolarHBondContact O-N 3.03Å; N129-M180 PolarHBondContact ND2-O 2.93Å; N129-D182 PolarHBondContact OD1-N 3.38Å
130	A	96.6	Very high	94.7	Very high	36 Å²	36	62.1 Å²	62.1	30%	0.298	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	128.2	172.3	0	0	0	0	0	111.5	I127 S161	I127-A130 HydrophobicContact CB-CB 3.77Å; I127-A130 HydrophobicContact CG2-CB 3.73Å; I127-A130 PolarHBondContact O-N 2.77Å; A130-S161 WeakPolarHBondContact CB-OG 3.35Å
131	K	95.8	Very high	94.6	Very high	110 Å²	110	65.1 Å²	65.1	48%	0.478	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	-34.5	164.2	-70.2	171.1	170	171.2	0	111	N83 M84 E85 N129 T162 A164	N83-K131 PolarHBondContact O-NZ 3.39Å; M84-K131 PolarHBondContact O-NZ 2.9Å; E85-K131 HydrophobicContact CB-CD 4.26Å; E85-K131 WeakPolarHBondContact OE2-CD 3.46Å; E85-K131 WeakPolarHBondContact OE2-CE 3.31Å; E85-K131 IonicContact OE2-NZ 3.38Å; E85-K131 PolarHBondContact OE2-NZ 3.37Å; N129-K131 PolarHBondContact O-N 2.95Å; K131-T162 PolarHBondContact N-O 3.46Å; K131-A164 HydrophobicContact CD-CB 4.47Å; K131-A164 HydrophobicContact CG-CB 4.41Å
132	S	95.7	Very high	94.4	Very high	56 Å²	56	67.6 Å²	67.6	39%	0.392	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.3	152.2	171	62.2	0	0	0	0	110.5	S161 T162	S132-S161 CarbonylContact O-C 3.58Å; S132-S161 VanDerWaalsContact O-CA 3.3Å; S132-S161 WeakPolarHBondContact O-CA 3.37Å; S132-S161 PolarHBondContact O-OG 3.07Å; S132-T162 PolarHBondContact N-O 3.27Å; S132-T162 PolarHBondContact O-N 3.11Å
133	A	96.2	Very high	94.3	Very high	56 Å²	56	66.7 Å²	66.7	46%	0.463	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.1	147.6	173.8	0	0	0	0	0	109.6	I159 T160	A133-I159 HydrophobicContact CB-CG2 4.37Å; A133-T160 WeakPolarHBondContact CA-O 3.16Å
134	W	95.6	Very high	94.2	Very high	124 Å²	124	69.5 Å²	69.5	47%	0.47	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	148.7	172.9	64.6	97.5	0	0	0	111.3	T87 I159 T160	T87-W134 HydrophobicContact CG2-CH2 4.42Å; W134-I159 WeakPolarHBondContact O-CA 3.4Å; W134-T160 HydrophobicContact CH2-CG2 3.43Å; W134-T160 VanDerWaalsContact CH2-CG2 3.43Å; W134-T160 HydrophobicContact CZ2-CG2 3.36Å; W134-T160 HydrophobicContact CZ3-CG2 4.13Å; W134-T160 PolarHBondContact N-O 3.18Å; W134-T160 PolarHBondContact O-N 3.5Å
135	F	95	Very high	94.1	Very high	108 Å²	108	67.1 Å²	67.1	47%	0.474	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	150.5	168	-62.3	-79.4	0	0	0	109.6	I159	F135-I159 HydrophobicContact CD1-CD1 4.46Å; F135-I159 HydrophobicContact CD1-CG1 3.82Å; F135-I159 HydrophobicContact CE1-CD1 3.8Å; F135-I159 HydrophobicContact CE1-CG1 3.67Å; F135-I159 HydrophobicContact CZ-CD1 4.47Å
136	H	94.8	Very high	93.9	Very high	38 Å²	38	68.9 Å²	68.9	18%	0.176	37%	0.366	C	S	.	.			trans	-85.4	132.1	173.6	-68.8	-119.9	0	0	0	109.9	N142 R158 T160	H136-N142 HydrophobicContact CB-CB 4.06Å; H136-N142 VanDerWaalsContact CB-ND2 3.26Å; H136-N142 WeakPolarHBondContact CB-ND2 3.4Å; H136-N142 WeakPolarHBondContact O-CB 3.46Å; H136-N142 PolarHBondContact O-N 3.12Å; H136-R158 HydrophobicContact CB-CB 4.41Å; H136-R158 HydrophobicContact CB-CG 4.48Å; H136-R158 PolarHBondContact CD2-O 3.3Å; H136-R158 PolarHBondContact N-O 3.46Å; H136-T160 PolarHBondContact CE1-OG1 2.99Å; H136-T160 PolarHBondContact NE2-OG1 3.07Å
137	D	92.1	Very high	93.7	Very high	111 Å²	111	65.9 Å²	65.9	59%	0.594	35%	0.353	S	S	*	.			trans	-123.7	1	-171.3	65.1	-22.8	0	0	0	114.8	T139 V140	D137-T139 CarbonylContact O-C 3.6Å; D137-V140 CarbonylContact C-O 3.46Å; D137-V140 VanDerWaalsContact C-O 3.22Å; D137-V140 CarbonylContact O-C 3.59Å; D137-V140 WeakPolarHBondContact O-CA 3.22Å; D137-V140 PolarHBondContact O-N 3.22Å; D137-V140 VanDerWaalsContact O-N 3.15Å
138	V	91.3	Very high	93.4	Very high	116 Å²	116	66 Å²	66	70%	0.703	35%	0.353	S	S	*	.	S	Bend	trans	-102.3	125	-179.7	-177.9	0	0	0	0	110.7
139	T	90.8	Very high	93.1	Very high	139 Å²	139	65 Å²	65	85%	0.853	35%	0.348	S	S	*	.	S	Bend	cis	-84.6	-9.5	-2.8	50.9	0	0	0	0	114.4	D137	D137-T139 CarbonylContact O-C 3.6Å
140	V	90.6	Very high	92.7	Very high	83 Å²	83	67.4 Å²	67.4	50%	0.503	36%	0.36	S	S	.	.	S	Bend	trans	-141.4	162.5	173.5	-179.2	0	0	0	0	106.3	D137 N142	D137-V140 CarbonylContact C-O 3.46Å; D137-V140 VanDerWaalsContact C-O 3.22Å; D137-V140 CarbonylContact O-C 3.59Å; D137-V140 WeakPolarHBondContact O-CA 3.22Å; D137-V140 PolarHBondContact O-N 3.22Å; D137-V140 VanDerWaalsContact O-N 3.15Å; V140-N142 PolarHBondContact O-N 2.82Å; V140-N142 VanDerWaalsContact O-N 3.15Å; V140-N142 PolarHBondContact O-OD1 2.86Å
141	E	90.3	Very high	92.4	Very high	74 Å²	74	65.7 Å²	65.7	35%	0.346	35%	0.346	S	S	.	.			trans	-49.2	120.5	170.5	-65.4	-166.2	125.4	0	0	112.2	K143	E141-K143 HydrophobicContact CB-CD 4.22Å; E141-K143 HydrophobicContact CB-CG 4.3Å; E141-K143 PolarHBondContact O-N 3.42Å; E141-K143 WeakPolarHBondContact OE1-CE 3.41Å; E141-K143 IonicContact OE1-NZ 3.18Å; E141-K143 PolarHBondContact OE1-NZ 2.87Å; E141-K143 WeakPolarHBondContact OE2-CE 3.41Å; E141-K143 IonicContact OE2-NZ 3.22Å; E141-K143 PolarHBondContact OE2-NZ 3.38Å
142	N	91.9	Very high	92.3	Very high	60 Å²	60	61.6 Å²	61.6	32%	0.321	33%	0.33	S	S	.	.			trans	-78.2	57.9	179.7	-71	-19.1	0	0	0	111	H136 V140 S157 R158	H136-N142 HydrophobicContact CB-CB 4.06Å; H136-N142 VanDerWaalsContact CB-ND2 3.26Å; H136-N142 WeakPolarHBondContact CB-ND2 3.4Å; H136-N142 WeakPolarHBondContact O-CB 3.46Å; H136-N142 PolarHBondContact O-N 3.12Å; V140-N142 PolarHBondContact O-N 2.82Å; V140-N142 VanDerWaalsContact O-N 3.15Å; V140-N142 PolarHBondContact O-OD1 2.86Å; N142-S157 WeakPolarHBondContact O-CA 3.48Å; N142-R158 HydrophobicContact CB-CB 3.9Å; N142-R158 PolarHBondContact O-N 3.27Å; N142-R158 VanDerWaalsContact O-N 3.08Å
143	K	93.4	Very high	92.3	Very high	32 Å²	32	58.9 Å²	58.9	14%	0.139	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	121.6	172.2	-61.8	171.8	-173.3	163.6	0	107.6	S114 V117 D118 E141 Y155 S156	S114-K143 WeakPolarHBondContact CB-O 3.22Å; V117-K143 HydrophobicContact CG1-CD 4.3Å; V117-K143 HydrophobicContact CG2-CB 4.44Å; D118-K143 IonicContact OD1-NZ 2.67Å; E141-K143 HydrophobicContact CB-CD 4.22Å; E141-K143 HydrophobicContact CB-CG 4.3Å; E141-K143 PolarHBondContact O-N 3.42Å; E141-K143 WeakPolarHBondContact OE1-CE 3.41Å; E141-K143 IonicContact OE1-NZ 3.18Å; E141-K143 PolarHBondContact OE1-NZ 2.87Å; E141-K143 WeakPolarHBondContact OE2-CE 3.41Å; E141-K143 IonicContact OE2-NZ 3.22Å; E141-K143 PolarHBondContact OE2-NZ 3.38Å; K143-Y155 HydrophobicContact CB-CE2 4.1Å; K143-Y155 HydrophobicContact CG-CE2 4.28Å; K143-S156 CarbonylContact C-O 3.57Å; K143-S156 WeakPolarHBondContact CA-O 3.27Å
144	L	91.9	Very high	92.2	Very high	69 Å²	69	56.7 Å²	56.7	36%	0.361	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135	171.4	169.2	149.6	0	0	0	108.4	R146 Y155 S156	L144-R146 HydrophobicContact CD2-CG 4.08Å; L144-Y155 CarbonylContact O-C 3.36Å; L144-Y155 WeakPolarHBondContact O-CA 3.39Å; L144-S156 PolarHBondContact N-O 3.34Å; L144-S156 PolarHBondContact O-N 2.84Å
145	I	92.8	Very high	92.2	Very high	3 Å²	3	51.4 Å²	51.4	2%	0.015	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	133.8	174	-178.7	159.4	0	0	0	110.5	L112 V117 L120 I153 L154	L112-I145 HydrophobicContact CB-CG2 3.94Å; L112-I145 PolarHBondContact N-O 3.41Å; V117-I145 HydrophobicContact CG2-CB 4.07Å; V117-I145 HydrophobicContact CG2-CD1 4.23Å; V117-I145 HydrophobicContact CG2-CG2 3.83Å; L120-I145 HydrophobicContact CD1-CD1 3.29Å; I145-I153 HydrophobicContact CD1-CG2 3.78Å; I145-I153 HydrophobicContact CG1-CG2 3.94Å; I145-L154 WeakPolarHBondContact CA-O 3.42Å
146	R	92	Very high	92.3	Very high	64 Å²	64	47 Å²	47	24%	0.242	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	128.5	177	-71.9	176.5	-179.8	169.6	-1.2	109.3	Y32 T109 L110 L144 I153 L154	Y32-R146 VanDerWaalsContact CD2-NH2 3.32Å; T109-R146 HydrophobicContact CG2-CB 3.88Å; T109-R146 HydrophobicContact CG2-CG 4.48Å; L110-R146 CarbonylContact O-C 3.58Å; L110-R146 VanDerWaalsContact O-CA 3.3Å; L110-R146 WeakPolarHBondContact O-CA 3.37Å; L144-R146 HydrophobicContact CD2-CG 4.08Å; R146-I153 WeakPolarHBondContact O-CA 3.36Å; R146-L154 HydrophobicContact CB-CB 4.33Å; R146-L154 PolarHBondContact N-O 3.49Å; R146-L154 PolarHBondContact O-N 3.02Å
147	L	91.3	Very high	92.3	Very high	4 Å²	4	45.3 Å²	45.3	2%	0.021	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	124.3	178.4	-176	70.6	0	0	0	109	L48 L101 Y103 T109 L110 L112 I153	L48-L147 HydrophobicContact CD2-CD2 3.81Å; L101-L147 HydrophobicContact CB-CD1 3.75Å; L101-L147 HydrophobicContact CB-CD2 4.17Å; L101-L147 HydrophobicContact CD1-CD1 4.26Å; Y103-L147 HydrophobicContact CD1-CD2 3.99Å; Y103-L147 HydrophobicContact CD1-CG 4.43Å; Y103-L147 HydrophobicContact CE1-CD2 3.79Å; Y103-L147 HydrophobicContact CE1-CG 3.87Å; Y103-L147 PolarHBondContact OH-O 3.16Å; T109-L147 CarbonylContact C-O 3.56Å; T109-L147 WeakPolarHBondContact CA-O 3.48Å; T109-L147 WeakPolarHBondContact CG2-O 3.28Å; L110-L147 PolarHBondContact N-O 3.17Å; L110-L147 PolarHBondContact O-N 2.95Å; L112-L147 HydrophobicContact CD1-CB 4.33Å; L147-I153 HydrophobicContact CD1-CD1 4.48Å; L147-I153 HydrophobicContact CD1-CG1 3.8Å
148	Q	91.6	Very high	92.5	Very high	27 Å²	27	43.9 Å²	43.9	13%	0.126	23%	0.233	C	C	.	.			trans	-89.6	155.4	175.5	-62.9	-174.2	53.8	0	0	110.8	Y103 T109 N150 G151 V152	Y103-Q148 WeakPolarHBondContact CE1-O 3.36Å; T109-Q148 HydrophobicContact CG2-CG 4.09Å; Q148-N150 WeakPolarHBondContact CB-OD1 3.46Å; Q148-N150 PolarHBondContact O-N 3.06Å; Q148-N150 VanDerWaalsContact O-N 3.16Å; Q148-G151 PolarHBondContact O-N 3.38Å; Q148-V152 HydrophobicContact CB-CB 4.16Å; Q148-V152 WeakPolarHBondContact CB-O 3.19Å; Q148-V152 HydrophobicContact CG-CB 4.33Å; Q148-V152 PolarHBondContact N-O 2.72Å
149	P	88.6	Confident	92.7	Very high	27 Å²	27	39 Å²	39	18%	0.175	20%	0.203	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.5	-32.9	-177.2	-24.8	33.3	0	0	0	114.5	S102 Y103 T106 G151	S102-P149 WeakPolarHBondContact CA-O 3.45Å; Y103-P149 HydrophobicContact CD2-CB 4.38Å; Y103-P149 HydrophobicContact CE2-CB 3.92Å; Y103-P149 HydrophobicContact CE2-CG 3.9Å; Y103-P149 VanDerWaalsContact CZ-CA 3.47Å; Y103-P149 PolarHBondContact N-O 3.19Å; Y103-P149 WeakPolarHBondContact OH-CD 3.47Å; T106-P149 WeakPolarHBondContact O-CB 3.34Å; T106-P149 VanDerWaalsContact O-CG 3.31Å; T106-P149 WeakPolarHBondContact O-CG 3.38Å; P149-G151 PolarHBondContact O-N 2.68Å
150	N	89.1	Confident	93	Very high	78 Å²	78	32.6 Å²	32.6	42%	0.417	16%	0.164	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-0.9	177.3	63.4	-7.5	0	0	0	114.3	H97 Q148 V152	H97-N150 PolarHBondContact CD2-O 3.37Å; H97-N150 PolarHBondContact NE2-O 3.09Å; Q148-N150 WeakPolarHBondContact CB-OD1 3.46Å; Q148-N150 PolarHBondContact O-N 3.06Å; Q148-N150 VanDerWaalsContact O-N 3.16Å; N150-V152 WeakPolarHBondContact OD1-CB 3.26Å; N150-V152 WeakPolarHBondContact OD1-CG2 3.37Å; N150-V152 PolarHBondContact OD1-N 2.88Å; N150-V152 VanDerWaalsContact OD1-N 3.1Å
151	G	90.7	Very high	93.3	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.14	C	C	.	.	S	Bend	trans	87.5	8.5	-176.3	0	0	0	0	0	114.7	D98 Q148 P149 I153	D98-G151 PolarHBondContact N-O 2.77Å; Q148-G151 PolarHBondContact O-N 3.38Å; P149-G151 PolarHBondContact O-N 2.68Å; G151-I153 PolarHBondContact O-N 2.88Å
152	V	93.8	Very high	93.7	Very high	24 Å²	24	25.9 Å²	25.9	15%	0.145	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	125.7	172	176.3	0	0	0	0	109.9	W96 H97 Q148 N150	W96-V152 CarbonylContact O-C 3.53Å; W96-V152 WeakPolarHBondContact O-CA 3.14Å; H97-V152 HydrophobicContact CB-CG2 4.41Å; Q148-V152 HydrophobicContact CB-CB 4.16Å; Q148-V152 WeakPolarHBondContact CB-O 3.19Å; Q148-V152 HydrophobicContact CG-CB 4.33Å; Q148-V152 PolarHBondContact N-O 2.72Å; N150-V152 WeakPolarHBondContact OD1-CB 3.26Å; N150-V152 WeakPolarHBondContact OD1-CG2 3.37Å; N150-V152 PolarHBondContact OD1-N 2.88Å; N150-V152 VanDerWaalsContact OD1-N 3.1Å
153	I	94.4	Very high	93.9	Very high	0 Å²	0	23 Å²	23	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.9	178.3	-45.1	-174.5	0	0	0	108.5	S95 W96 D98 L101 I145 R146 L147 G151	S95-I153 VanDerWaalsContact CA-O 3.3Å; S95-I153 WeakPolarHBondContact CA-O 3.43Å; W96-I153 HydrophobicContact CD2-CB 4.27Å; W96-I153 HydrophobicContact CH2-CB 4.31Å; W96-I153 HydrophobicContact CH2-CG2 3.94Å; W96-I153 HydrophobicContact CZ2-CB 3.97Å; W96-I153 HydrophobicContact CZ2-CD1 3.74Å; W96-I153 HydrophobicContact CZ2-CG1 4.39Å; W96-I153 HydrophobicContact CZ2-CG2 3.9Å; W96-I153 HydrophobicContact CZ3-CG2 4.48Å; W96-I153 PolarHBondContact N-O 3.38Å; W96-I153 VanDerWaalsContact N-O 3.07Å; W96-I153 PolarHBondContact O-N 2.96Å; D98-I153 HydrophobicContact CB-CD1 3.99Å; D98-I153 HydrophobicContact CB-CG1 4.47Å; L101-I153 HydrophobicContact CD1-CD1 3.59Å; L101-I153 HydrophobicContact CD1-CG1 4.47Å; I145-I153 HydrophobicContact CD1-CG2 3.78Å; I145-I153 HydrophobicContact CG1-CG2 3.94Å; R146-I153 WeakPolarHBondContact O-CA 3.36Å; L147-I153 HydrophobicContact CD1-CD1 4.48Å; L147-I153 HydrophobicContact CD1-CG1 3.8Å; G151-I153 PolarHBondContact O-N 2.88Å
154	L	94.9	Very high	94.1	Very high	9 Å²	9	23.3 Å²	23.3	5%	0.047	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	112.8	164.7	172.8	62.5	0	0	0	109	I29 R93 I145 R146	I29-L154 HydrophobicContact CG2-CD1 3.94Å; I29-L154 HydrophobicContact CG2-CD2 4.01Å; R93-L154 HydrophobicContact CB-CD1 4.31Å; I145-L154 WeakPolarHBondContact CA-O 3.42Å; R146-L154 HydrophobicContact CB-CB 4.33Å; R146-L154 PolarHBondContact N-O 3.49Å; R146-L154 PolarHBondContact O-N 3.02Å
155	Y	95.8	Very high	94.2	Very high	14 Å²	14	20.3 Å²	20.3	6%	0.055	11%	0.106	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	135.3	169.9	179.1	-120.6	0	0	0	109.8	R93 Q94 V117 K143 L144	R93-Y155 CarbonylContact C-O 3.22Å; R93-Y155 WeakPolarHBondContact CA-O 3.35Å; Q94-Y155 PolarHBondContact N-O 2.88Å; Q94-Y155 PolarHBondContact O-N 2.94Å; V117-Y155 HydrophobicContact CG1-CD2 4.43Å; V117-Y155 HydrophobicContact CG1-CE2 3.75Å; V117-Y155 HydrophobicContact CG2-CD2 4.27Å; V117-Y155 HydrophobicContact CG2-CE2 3.98Å; K143-Y155 HydrophobicContact CB-CE2 4.1Å; K143-Y155 HydrophobicContact CG-CE2 4.28Å; L144-Y155 CarbonylContact O-C 3.36Å; L144-Y155 WeakPolarHBondContact O-CA 3.39Å
156	S	95.4	Very high	94.2	Very high	15 Å²	15	26.5 Å²	26.5	11%	0.105	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	130.3	176.2	-178.7	0	0	0	0	109.2	L92 K143 L144	L92-S156 CarbonylContact O-C 3.57Å; L92-S156 WeakPolarHBondContact O-CA 3.39Å; K143-S156 CarbonylContact C-O 3.57Å; K143-S156 WeakPolarHBondContact CA-O 3.27Å; L144-S156 PolarHBondContact N-O 3.34Å; L144-S156 PolarHBondContact O-N 2.84Å
157	S	95.4	Very high	94.2	Very high	2 Å²	2	23.9 Å²	23.9	1%	0.014	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	141	-179.9	58.8	0	0	0	0	111.2	F91 L92 N142	F91-S157 CarbonylContact C-O 3.56Å; F91-S157 WeakPolarHBondContact CA-O 3.44Å; L92-S157 PolarHBondContact N-O 3.19Å; L92-S157 PolarHBondContact O-N 3.01Å; N142-S157 WeakPolarHBondContact O-CA 3.48Å
158	R	96.1	Very high	94.2	Very high	81 Å²	81	28.2 Å²	28.2	31%	0.306	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	118.8	171	-168.3	-175.5	-177.1	-169.5	0.3	109.7	T89 F91 H136 N142	T89-R158 HydrophobicContact CG2-CG 4.34Å; F91-R158 HydrophobicContact CD1-CB 3.81Å; F91-R158 HydrophobicContact CD1-CG 3.89Å; F91-R158 HydrophobicContact CE1-CB 3.77Å; F91-R158 HydrophobicContact CE1-CG 3.59Å; F91-R158 HydrophobicContact CZ-CG 4.21Å; H136-R158 HydrophobicContact CB-CB 4.41Å; H136-R158 HydrophobicContact CB-CG 4.48Å; H136-R158 PolarHBondContact CD2-O 3.3Å; H136-R158 PolarHBondContact N-O 3.46Å; N142-R158 HydrophobicContact CB-CB 3.9Å; N142-R158 PolarHBondContact O-N 3.27Å; N142-R158 VanDerWaalsContact O-N 3.08Å
159	I	96.4	Very high	94.1	Very high	13 Å²	13	27.5 Å²	27.5	7%	0.067	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	133.8	-176.7	-53	176.8	0	0	0	108.1	T89 V90 L92 I127 A133 W134 F135	T89-I159 WeakPolarHBondContact CA-O 3.48Å; V90-I159 HydrophobicContact CG2-CB 4.19Å; V90-I159 PolarHBondContact N-O 2.87Å; V90-I159 PolarHBondContact O-N 3.01Å; L92-I159 HydrophobicContact CB-CD1 4.05Å; L92-I159 HydrophobicContact CD2-CD1 3.92Å; I127-I159 HydrophobicContact CD1-CG2 4.3Å; A133-I159 HydrophobicContact CB-CG2 4.37Å; W134-I159 WeakPolarHBondContact O-CA 3.4Å; F135-I159 HydrophobicContact CD1-CD1 4.46Å; F135-I159 HydrophobicContact CD1-CG1 3.82Å; F135-I159 HydrophobicContact CE1-CD1 3.8Å; F135-I159 HydrophobicContact CE1-CG1 3.67Å; F135-I159 HydrophobicContact CZ-CD1 4.47Å
160	T	97.3	Very high	94.2	Very high	5 Å²	5	29 Å²	29	3%	0.031	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	133.7	157.7	-60.3	0	0	0	0	108.2	T87 M88 T89 A133 W134 H136	T87-T160 HydrophobicContact CG2-CG2 3.53Å; M88-T160 WeakPolarHBondContact O-CA 3.32Å; T89-T160 WeakPolarHBondContact CG2-OG1 3.28Å; T89-T160 PolarHBondContact OG1-OG1 3.32Å; A133-T160 WeakPolarHBondContact CA-O 3.16Å; W134-T160 HydrophobicContact CH2-CG2 3.43Å; W134-T160 VanDerWaalsContact CH2-CG2 3.43Å; W134-T160 HydrophobicContact CZ2-CG2 3.36Å; W134-T160 HydrophobicContact CZ3-CG2 4.13Å; W134-T160 PolarHBondContact N-O 3.18Å; W134-T160 PolarHBondContact O-N 3.5Å; H136-T160 PolarHBondContact CE1-OG1 2.99Å; H136-T160 PolarHBondContact NE2-OG1 3.07Å
161	S	96.9	Very high	94.3	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.014	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	137.5	178.4	-176.4	0	0	0	0	111	T87 M88 A130 S132	T87-S161 WeakPolarHBondContact CA-O 3.41Å; M88-S161 PolarHBondContact N-O 2.91Å; M88-S161 PolarHBondContact O-N 3.08Å; A130-S161 WeakPolarHBondContact CB-OG 3.35Å; S132-S161 CarbonylContact O-C 3.58Å; S132-S161 VanDerWaalsContact O-CA 3.3Å; S132-S161 WeakPolarHBondContact O-CA 3.37Å; S132-S161 PolarHBondContact O-OG 3.07Å
162	T	97.4	Very high	94.3	Very high	15 Å²	15	29.6 Å²	29.6	9%	0.092	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	115.5	165.2	-59.5	0	0	0	0	108.2	E85 Y86 T87 K131 S132	E85-T162 HydrophobicContact CB-CG2 3.95Å; E85-T162 HydrophobicContact CG-CG2 3.83Å; Y86-T162 CarbonylContact O-C 3.56Å; Y86-T162 WeakPolarHBondContact O-CA 3.44Å; T87-T162 PolarHBondContact OG1-OG1 2.88Å; K131-T162 PolarHBondContact N-O 3.46Å; S132-T162 PolarHBondContact N-O 3.27Å; S132-T162 PolarHBondContact O-N 3.11Å
163	V	97.3	Very high	94.3	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	135.4	-167.2	-177.3	0	0	0	0	109.1	E85 Y86 I127 N129 L181	E85-V163 CarbonylContact C-O 3.53Å; E85-V163 WeakPolarHBondContact CA-O 3.34Å; E85-V163 VanDerWaalsContact CB-O 3.31Å; E85-V163 WeakPolarHBondContact CB-O 3.31Å; Y86-V163 HydrophobicContact CD2-CB 4.46Å; Y86-V163 HydrophobicContact CE1-CB 3.98Å; Y86-V163 HydrophobicContact CE1-CG1 4.02Å; Y86-V163 HydrophobicContact CE2-CB 3.83Å; Y86-V163 HydrophobicContact CE2-CG1 4.44Å; Y86-V163 HydrophobicContact CE2-CG2 4.13Å; Y86-V163 PolarHBondContact N-O 3.43Å; Y86-V163 PolarHBondContact O-N 3.08Å; Y86-V163 WeakPolarHBondContact OH-CG1 3.29Å; I127-V163 HydrophobicContact CG2-CG2 4.39Å; N129-V163 HydrophobicContact CB-CG1 4.19Å; N129-V163 WeakPolarHBondContact ND2-CG1 3.49Å; N129-V163 WeakPolarHBondContact O-CA 3.28Å; N129-V163 WeakPolarHBondContact OD1-CG1 3.27Å; V163-L181 HydrophobicContact CG2-CD1 3.83Å
164	A	96.6	Very high	94.2	Very high	37 Å²	37	29.9 Å²	29.9	31%	0.306	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	130.5	176.2	0	0	0	0	0	110.8	N129 K131	N129-A164 PolarHBondContact ND2-O 3.44Å; N129-A164 PolarHBondContact O-N 3.03Å; K131-A164 HydrophobicContact CD-CB 4.47Å; K131-A164 HydrophobicContact CG-CB 4.41Å
165	C	95.2	Very high	94	Very high	6 Å²	6	29.6 Å²	29.6	4%	0.041	16%	0.156	C	C	.	.			trans	-137.4	113.8	172	179.2	0	0	0	0	107.9	M84 Y86 M167 C179	M84-C165 CarbonylContact C-O 3.59Å; M84-C165 WeakPolarHBondContact CA-O 3.33Å; M84-C165 WeakPolarHBondContact CB-O 3.37Å; M84-C165 PolarHBondContact O-N 3.44Å; M84-C165 VanDerWaalsContact O-N 3.07Å; Y86-C165 HydrophobicContact CD1-CB 3.67Å; Y86-C165 HydrophobicContact CE1-CB 3.83Å; C165-M167 HydrophobicContact CB-CE 4.19Å; C165-C179 HydrophobicContact CB-CB 3.95Å; C165-C179 WeakPolarHBondContact CB-SG 3.31Å; C165-C179 WeakPolarHBondContact SG-CA 3.39Å; C165-C179 WeakPolarHBondContact SG-CB 3.32Å; C165-C179 CovalentContact SG-SG 2.05Å; C165-C179 PolarHBondContact SG-SG 3.5Å
166	D	92.1	Very high	93.9	Very high	134 Å²	134	34.8 Å²	34.8	72%	0.717	18%	0.18	S	C	*	.			trans	-77.1	121	175.5	-166.8	7.2	0	0	0	108.7	M84	M84-D166 WeakPolarHBondContact CE-OD1 3.32Å
167	M	91.5	Very high	93.9	Very high	8 Å²	8	34.4 Å²	34.4	4%	0.039	18%	0.177	C	C	.	.			trans	-112.7	125.8	-168.9	-65.2	175.9	-163.5	0	0	110.6	I79 E81 C165 L169 Q177	I79-M167 HydrophobicContact CG2-CE 3.76Å; E81-M167 HydrophobicContact CG-SD 4.21Å; C165-M167 HydrophobicContact CB-CE 4.19Å; M167-L169 HydrophobicContact CB-CD2 4.14Å; M167-L169 HydrophobicContact CB-CG 4.39Å; M167-L169 PolarHBondContact O-N 3.02Å; M167-L169 VanDerWaalsContact O-N 3.11Å; M167-Q177 VanDerWaalsContact CA-OE1 3.26Å; M167-Q177 HydrophobicContact CB-CG 4.44Å; M167-Q177 HydrophobicContact CG-CG 4.34Å
168	D	91.3	Very high	93.9	Very high	96 Å²	96	38.3 Å²	38.3	51%	0.513	20%	0.195	S	C	.	.			trans	-79.7	95.3	171.9	-175.6	0.1	0	0	0	110.1	T170 Q177	D168-T170 VanDerWaalsContact C-N 3.28Å; D168-T170 VanDerWaalsContact CG-OG1 3.27Å; D168-T170 PolarHBondContact O-N 3.4Å; D168-T170 WeakPolarHBondContact OD1-CB 3.42Å; D168-T170 WeakPolarHBondContact OD1-CG2 3.46Å; D168-T170 PolarHBondContact OD1-N 2.96Å; D168-T170 PolarHBondContact OD1-OG1 3.26Å; D168-T170 PolarHBondContact OD2-OG1 3.44Å; D168-Q177 PolarHBondContact O-NE2 3.41Å
169	L	90.8	Very high	93.9	Very high	11 Å²	11	34.4 Å²	34.4	6%	0.058	18%	0.18	C	C	.	.			trans	-81.7	3.3	178.7	-57.5	177	0	0	0	113.4	E81 M167 K171 Y172 P303 K309	E81-L169 HydrophobicContact CB-CD1 4.09Å; E81-L169 HydrophobicContact CB-CD2 4.28Å; E81-L169 HydrophobicContact CG-CD2 4.04Å; M167-L169 HydrophobicContact CB-CD2 4.14Å; M167-L169 HydrophobicContact CB-CG 4.39Å; M167-L169 PolarHBondContact O-N 3.02Å; M167-L169 VanDerWaalsContact O-N 3.11Å; L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 2.94Å; L169-Y172 HydrophobicContact CD2-CD2 4.32Å; L169-Y172 WeakPolarHBondContact O-CB 3.42Å; L169-Y172 PolarHBondContact O-N 3.31Å; L169-P303 HydrophobicContact CD1-CG 3.93Å; L169-K309 HydrophobicContact CB-CG 4.44Å; L169-K309 WeakPolarHBondContact O-CG 3.42Å
170	T	90.1	Very high	93.9	Very high	58 Å²	58	36.8 Å²	36.8	36%	0.356	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.1	-41.9	-175.7	54.5	0	0	0	0	113.3	D168 Y172 A307 K309 A310	D168-T170 VanDerWaalsContact C-N 3.28Å; D168-T170 VanDerWaalsContact CG-OG1 3.27Å; D168-T170 PolarHBondContact O-N 3.4Å; D168-T170 WeakPolarHBondContact OD1-CB 3.42Å; D168-T170 WeakPolarHBondContact OD1-CG2 3.46Å; D168-T170 PolarHBondContact OD1-N 2.96Å; D168-T170 PolarHBondContact OD1-OG1 3.26Å; D168-T170 PolarHBondContact OD2-OG1 3.44Å; T170-Y172 VanDerWaalsContact C-N 3.32Å; T170-Y172 PolarHBondContact O-N 3.29Å; T170-A307 HydrophobicContact CG2-CB 4.49Å; T170-K309 CarbonylContact O-C 3.54Å; T170-A310 PolarHBondContact O-N 2.94Å
171	K	91.6	Very high	93.8	Very high	83 Å²	83	36.6 Å²	36.6	36%	0.361	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	3.4	175.5	-71.2	-160.7	179.7	-169.9	0	114.8	L169 M174 D175 M461	L169-K171 VanDerWaalsContact C-N 3.32Å; L169-K171 PolarHBondContact O-N 2.94Å; K171-M174 CarbonylContact O-C 3.57Å; K171-M174 WeakPolarHBondContact O-CA 3.31Å; K171-M174 PolarHBondContact O-N 3.46Å; K171-D175 HydrophobicContact CB-CB 4.39Å; K171-M461 PolarHBondContact NZ-OXT 3.13Å
172	Y	91.2	Very high	93.8	Very high	9 Å²	9	36.8 Å²	36.8	4%	0.035	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.9	131	-174.2	179	-84.6	0	0	0	113.8	L169 T170 Y251 L302 K309 L311	L169-Y172 HydrophobicContact CD2-CD2 4.32Å; L169-Y172 WeakPolarHBondContact O-CB 3.42Å; L169-Y172 PolarHBondContact O-N 3.31Å; T170-Y172 VanDerWaalsContact C-N 3.32Å; T170-Y172 PolarHBondContact O-N 3.29Å; Y172-Y251 HydrophobicContact CE1-CE1 4.45Å; Y172-Y251 AromaticContact CZ-CE1 3.86Å; Y172-Y251 WeakPolarHBondContact OH-CE1 3.32Å; Y172-L302 HydrophobicContact CD1-CD1 4.04Å; Y172-L302 HydrophobicContact CD2-CD2 4.49Å; Y172-L302 HydrophobicContact CE1-CD1 3.62Å; Y172-L302 HydrophobicContact CE1-CD2 4.43Å; Y172-L302 HydrophobicContact CE2-CD2 3.88Å; Y172-K309 HydrophobicContact CD1-CD 4.39Å; Y172-K309 HydrophobicContact CG-CD 4.49Å; Y172-L311 HydrophobicContact CD1-CB 4.35Å; Y172-L311 HydrophobicContact CD1-CD2 4.32Å; Y172-L311 HydrophobicContact CE1-CD2 3.98Å; Y172-L311 PolarHBondContact O-N 2.89Å; Y172-L311 VanDerWaalsContact O-N 3.13Å
173	P	92.1	Very high	93.8	Very high	1 Å²	1	36.2 Å²	36.2	1%	0.006	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	cis	-101.7	29.6	7.7	41.2	-35.6	0	0	0	113.3	D175 Y251 Y256	P173-D175 VanDerWaalsContact CA-OD1 3.3Å; P173-D175 WeakPolarHBondContact CA-OD1 3.48Å; P173-Y251 HydrophobicContact CB-CD1 4.15Å; P173-Y251 HydrophobicContact CB-CD2 3.63Å; P173-Y251 HydrophobicContact CB-CE1 4.49Å; P173-Y251 HydrophobicContact CB-CE2 4Å; P173-Y251 HydrophobicContact CB-CG 3.69Å; P173-Y251 HydrophobicContact CG-CD1 4.42Å; P173-Y251 HydrophobicContact CG-CD2 4.1Å; P173-Y251 HydrophobicContact CG-CG 3.8Å; P173-Y256 WeakPolarHBondContact CD-OH 3.21Å; P173-Y256 HydrophobicContact CG-CE2 4.13Å
174	M	91.9	Very high	93.8	Very high	28 Å²	28	36.6 Å²	36.6	14%	0.138	19%	0.19	C	C	.	.	S	Bend	trans	-108.1	32.6	177.6	-65.4	173.7	-92.6	0	0	110.3	K171 Y256 Y455 W456 T460	K171-M174 CarbonylContact O-C 3.57Å; K171-M174 WeakPolarHBondContact O-CA 3.31Å; K171-M174 PolarHBondContact O-N 3.46Å; M174-Y256 WeakPolarHBondContact CE-OH 3.37Å; M174-Y455 HydrophobicContact CE-CE1 4.03Å; M174-W456 HydrophobicContact CE-CE3 4.34Å; M174-W456 HydrophobicContact CE-CH2 4.45Å; M174-W456 HydrophobicContact CE-CZ3 3.9Å; M174-W456 HydrophobicContact SD-CE3 3.87Å; M174-W456 HydrophobicContact SD-CH2 4.46Å; M174-W456 HydrophobicContact SD-CZ3 3.47Å; M174-W456 WeakPolarHBondContact SD-CZ3 3.4Å; M174-T460 HydrophobicContact SD-CG2 3.46Å; M174-T460 WeakPolarHBondContact SD-CG2 3.34Å
175	D	92.3	Very high	93.7	Very high	4 Å²	4	34.9 Å²	34.9	2%	0.021	18%	0.176	C	C	.	.			trans	-91.4	149.1	-175.6	54	-54.1	0	0	0	113	K171 P173 Q177 R246	K171-D175 HydrophobicContact CB-CB 4.39Å; P173-D175 VanDerWaalsContact CA-OD1 3.3Å; P173-D175 WeakPolarHBondContact CA-OD1 3.48Å; D175-Q177 PolarHBondContact OD2-NE2 2.93Å; D175-R246 PolarHBondContact O-N 2.81Å; D175-R246 WeakPolarHBondContact OD1-CD 3.37Å; D175-R246 IonicContact OD1-CZ 3.4Å; D175-R246 IonicContact OD1-NE 3.76Å; D175-R246 PolarHBondContact OD1-NE 3.11Å; D175-R246 IonicContact OD1-NH2 3.74Å; D175-R246 IonicContact OD2-CZ 3.94Å; D175-R246 IonicContact OD2-NE 3.81Å; D175-R246 PolarHBondContact OD2-NE 3.41Å; D175-R246 VanDerWaalsContact OD2-NE 3.15Å; D175-R246 IonicContact OD2-NH2 3.72Å; D175-R246 PolarHBondContact OD2-NH2 2.91Å
176	E	93.6	Very high	93.6	Very high	122 Å²	122	43.1 Å²	43.1	57%	0.57	21%	0.207	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-119.7	133.3	167.3	-68.8	-177.8	165.6	0	0	107.2	L244 R245	E176-L244 WeakPolarHBondContact CA-O 3.32Å; E176-R245 HydrophobicContact CG-CB 4Å; E176-R245 HydrophobicContact CG-CG 3.83Å; E176-R245 VanDerWaalsContact OE1-CD 3.28Å; E176-R245 WeakPolarHBondContact OE1-CD 3.38Å
177	Q	94.7	Very high	93.5	Very high	7 Å²	7	39.2 Å²	39.2	3%	0.033	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	132.2	-175	-54.7	-60.9	-20.2	0	0	109.5	M167 D168 D175 Q243 L244	M167-Q177 VanDerWaalsContact CA-OE1 3.26Å; M167-Q177 HydrophobicContact CB-CG 4.44Å; M167-Q177 HydrophobicContact CG-CG 4.34Å; D168-Q177 PolarHBondContact O-NE2 3.41Å; D175-Q177 PolarHBondContact OD2-NE2 2.93Å; Q177-Q243 CarbonylContact O-C 3.56Å; Q177-Q243 WeakPolarHBondContact O-CA 3.07Å; Q177-L244 HydrophobicContact CB-CB 4.48Å; Q177-L244 PolarHBondContact N-O 2.97Å; Q177-L244 PolarHBondContact O-N 3.3Å
178	E	95.3	Very high	93.6	Very high	84 Å²	84	41.3 Å²	41.3	39%	0.393	21%	0.206	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.5	167.2	-175.8	171.1	-161.3	0	0	108.9	R221 R241	E178-R221 VanDerWaalsContact CD-NH2 3.34Å; E178-R221 IonicContact OE1-CZ 2.67Å; E178-R221 VanDerWaalsContact OE1-CZ 3.22Å; E178-R221 IonicContact OE1-NE 3.87Å; E178-R221 PolarHBondContact OE1-NE 2.68Å; E178-R221 IonicContact OE1-NH2 2.63Å; E178-R221 PolarHBondContact OE1-NH2 3.23Å; E178-R221 IonicContact OE2-NH2 3.34Å; E178-R221 PolarHBondContact OE2-NH2 2.94Å; E178-R241 HydrophobicContact CG-CB 4.37Å; E178-R241 VanDerWaalsContact OE1-CB 3.29Å; E178-R241 WeakPolarHBondContact OE1-CB 3.43Å; E178-R241 WeakPolarHBondContact OE1-CD 3.46Å
179	C	96.1	Very high	93.8	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	151.8	172.2	-70	0	0	0	0	110.5	Y86 C165 R241 F242	Y86-C179 HydrophobicContact CD1-CB 4.01Å; Y86-C179 HydrophobicContact CE1-CB 3.66Å; C165-C179 HydrophobicContact CB-CB 3.95Å; C165-C179 WeakPolarHBondContact CB-SG 3.31Å; C165-C179 WeakPolarHBondContact SG-CA 3.39Å; C165-C179 WeakPolarHBondContact SG-CB 3.32Å; C165-C179 CovalentContact SG-SG 2.05Å; C165-C179 PolarHBondContact SG-SG 3.5Å; C179-R241 CarbonylContact O-C 3.57Å; C179-R241 WeakPolarHBondContact O-CA 3.45Å; C179-F242 HydrophobicContact CB-CE1 4.08Å; C179-F242 HydrophobicContact CB-CE2 3.93Å; C179-F242 HydrophobicContact CB-CZ 3.67Å; C179-F242 PolarHBondContact N-O 3.47Å; C179-F242 WeakPolarHBondContact O-CD1 3.48Å; C179-F242 PolarHBondContact O-N 3.3Å
180	M	96.1	Very high	93.9	Very high	62 Å²	62	38.6 Å²	38.6	31%	0.305	20%	0.196	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.6	-175.7	59.7	-159.6	-83.5	0	0	111.7	Y86 N129 D182 L240 R241	Y86-M180 PolarHBondContact OH-O 3.24Å; N129-M180 PolarHBondContact ND2-O 2.93Å; M180-D182 WeakPolarHBondContact CE-OD1 3.44Å; M180-D182 VanDerWaalsContact CE-OD2 3.26Å; M180-D182 WeakPolarHBondContact CE-OD2 3.25Å; M180-L240 CarbonylContact C-O 3.6Å; M180-L240 VanDerWaalsContact CA-O 3.29Å; M180-L240 WeakPolarHBondContact CA-O 3.33Å; M180-R241 HydrophobicContact CB-CG 3.95Å
181	L	96.9	Very high	94	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.01	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	111.9	167.1	177.5	77.7	0	0	0	107.7	I71 M88 I127 V163 S239 L240	I71-L181 HydrophobicContact CD1-CD2 3.71Å; M88-L181 HydrophobicContact SD-CB 4.28Å; M88-L181 HydrophobicContact SD-CD1 3.98Å; M88-L181 HydrophobicContact SD-CD2 3.79Å; M88-L181 HydrophobicContact SD-CG 4.24Å; I127-L181 HydrophobicContact CD1-CD1 4.35Å; I127-L181 HydrophobicContact CG1-CD1 4.4Å; I127-L181 HydrophobicContact CG2-CD1 3.56Å; V163-L181 HydrophobicContact CG2-CD1 3.83Å; L181-S239 WeakPolarHBondContact O-CA 3.48Å; L181-L240 HydrophobicContact CB-CB 4.39Å; L181-L240 PolarHBondContact N-O 3.23Å; L181-L240 PolarHBondContact O-N 3.01Å
182	D	96.8	Very high	94.1	Very high	6 Å²	6	41.7 Å²	41.7	3%	0.032	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	126.4	-178.8	-79.8	0.3	0	0	0	111	I127 V128 N129 M180 R237 S239	I127-D182 CarbonylContact C-O 3.44Å; I127-D182 VanDerWaalsContact CA-O 3.29Å; I127-D182 WeakPolarHBondContact CA-O 3.26Å; V128-D182 HydrophobicContact CB-CB 3.84Å; V128-D182 HydrophobicContact CG2-CB 4.02Å; V128-D182 PolarHBondContact N-O 3.32Å; N129-D182 PolarHBondContact OD1-N 3.38Å; M180-D182 WeakPolarHBondContact CE-OD1 3.44Å; M180-D182 VanDerWaalsContact CE-OD2 3.26Å; M180-D182 WeakPolarHBondContact CE-OD2 3.25Å; D182-R237 HydrophobicContact CB-CG 4.4Å; D182-R237 WeakPolarHBondContact OD2-CD 3.49Å; D182-R237 IonicContact OD2-CZ 3.31Å; D182-R237 IonicContact OD2-NE 2.9Å; D182-R237 IonicContact OD2-NH1 3.88Å; D182-R237 PolarHBondContact OD2-NH1 2.87Å; D182-S239 VanDerWaalsContact OD1-CB 3.3Å; D182-S239 WeakPolarHBondContact OD1-CB 3.39Å; D182-S239 PolarHBondContact OD1-OG 3.13Å
183	L	97.3	Very high	94.3	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.5	172.3	-60.3	-177.9	0	0	0	110.4	M69 I71 L92 T125 F126 I127 R237 L238	M69-L183 HydrophobicContact CE-CD1 3.95Å; I71-L183 HydrophobicContact CD1-CD1 3.69Å; I71-L183 HydrophobicContact CD1-CG 4.43Å; I71-L183 HydrophobicContact CG1-CD1 4.28Å; L92-L183 HydrophobicContact CD1-CD1 3.61Å; T125-L183 HydrophobicContact CG2-CB 4.11Å; T125-L183 HydrophobicContact CG2-CD1 4.49Å; T125-L183 HydrophobicContact CG2-CD2 4.29Å; F126-L183 WeakPolarHBondContact O-CA 3.28Å; I127-L183 HydrophobicContact CB-CD2 4.44Å; I127-L183 HydrophobicContact CG1-CD2 3.65Å; L183-R237 WeakPolarHBondContact O-CA 3.31Å; L183-L238 HydrophobicContact CB-CB 4.44Å; L183-L238 PolarHBondContact N-O 2.85Å; L183-L238 PolarHBondContact O-N 3.45Å
184	E	96	Very high	94.5	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.037	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	164.3	179.8	-162.4	172.9	136.3	0	0	110.3	T125 F126 V128 F229 F235 R237	T125-E184 WeakPolarHBondContact CA-O 3.43Å; F126-E184 HydrophobicContact CD1-CB 4.46Å; F126-E184 WeakPolarHBondContact CD1-O 3.46Å; F126-E184 HydrophobicContact CE1-CB 3.84Å; F126-E184 HydrophobicContact CE1-CG 4.38Å; F126-E184 HydrophobicContact CZ-CB 4.28Å; F126-E184 PolarHBondContact N-O 3.12Å; F126-E184 PolarHBondContact O-N 3.19Å; F126-E184 VanDerWaalsContact O-N 3.12Å; V128-E184 HydrophobicContact CG2-CB 3.51Å; E184-F229 WeakPolarHBondContact OE1-CE2 3.36Å; E184-F235 HydrophobicContact CG-CB 4.02Å; E184-F235 WeakPolarHBondContact OE1-CB 3.4Å; E184-R237 IonicContact OE2-CZ 2.88Å; E184-R237 IonicContact OE2-NE 3.02Å; E184-R237 PolarHBondContact OE2-NE 2.68Å; E184-R237 IonicContact OE2-NH2 2.72Å; E184-R237 PolarHBondContact OE2-NH2 3.25Å
185	S	95.1	Very high	94.7	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.007	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	138.1	172.1	168.7	0	0	0	0	108.7	D124 Y188 F235	D124-S185 WeakPolarHBondContact OD1-CB 3.39Å; D124-S185 PolarHBondContact OD1-OG 3.33Å; S185-Y188 WeakPolarHBondContact CB-O 3.32Å; S185-Y188 WeakPolarHBondContact OG-CA 3.48Å; S185-Y188 WeakPolarHBondContact OG-CB 3.18Å; S185-Y188 PolarHBondContact OG-N 3.38Å; S185-Y188 PolarHBondContact OG-O 3.4Å; S185-F235 WeakPolarHBondContact O-CD1 3.49Å
186	Y	92.1	Very high	94.8	Very high	179 Å²	179	44.9 Å²	44.9	70%	0.702	23%	0.227	S	C	*	.	S	Bend	trans	-80.1	-41.5	-176.8	-170.8	-98.7	0	0	0	112.9	D124 F126	D124-Y186 PolarHBondContact O-N 3.45Å; D124-Y186 PolarHBondContact OD1-N 3.27Å; F126-Y186 HydrophobicContact CD1-CD2 4.09Å; F126-Y186 HydrophobicContact CD1-CG 4.43Å; F126-Y186 AromaticContact CE1-CD2 3.98Å; F126-Y186 HydrophobicContact CE1-CD2 3.98Å; F126-Y186 HydrophobicContact CE2-CD2 4.42Å; F126-Y186 HydrophobicContact CG-CD2 4.39Å; F126-Y186 HydrophobicContact CZ-CD2 4.15Å
187	G	91.8	Very high	95	Very high	51 Å²	51	40.5 Å²	40.5	53%	0.526	21%	0.205	S	C	.	.	S	Bend	trans	-117.2	-20.5	-173.6	0	0	0	0	0	115.5	D124	D124-G187 WeakPolarHBondContact OD2-CA 3.26Å; D124-G187 PolarHBondContact OD2-N 3.09Å
188	Y	93.5	Very high	95	Very high	52 Å²	52	40.4 Å²	40.4	20%	0.204	21%	0.205	C	C	.	.			trans	-96.9	121.4	-179.3	-60.1	-67.6	0	0	0	111.3	R57 W121 D124 S185 D192 F235	R57-Y188 HydrophobicContact CB-CE1 4.35Å; W121-Y188 HydrophobicContact CZ2-CD2 4.34Å; W121-Y188 AromaticContact CZ2-CE2 3.8Å; W121-Y188 HydrophobicContact CZ2-CE2 3.8Å; W121-Y188 AromaticContact NE1-CE2 3.88Å; W121-Y188 AromaticContact NE1-CZ 3.65Å; W121-Y188 PolarHBondContact NE1-OH 2.62Å; D124-Y188 WeakPolarHBondContact OD1-CD2 3.41Å; S185-Y188 WeakPolarHBondContact CB-O 3.32Å; S185-Y188 WeakPolarHBondContact OG-CA 3.48Å; S185-Y188 WeakPolarHBondContact OG-CB 3.18Å; S185-Y188 PolarHBondContact OG-N 3.38Å; S185-Y188 PolarHBondContact OG-O 3.4Å; Y188-D192 HydrophobicContact CD1-CB 3.79Å; Y188-D192 HydrophobicContact CG-CB 4.23Å; Y188-F235 VanDerWaalsContact O-CD1 3.26Å; Y188-F235 WeakPolarHBondContact O-CD1 3.13Å; Y188-F235 VanDerWaalsContact O-CE1 3.27Å; Y188-F235 WeakPolarHBondContact O-CE1 3.22Å
189	S	94	Very high	94.8	Very high	19 Å²	19	43.2 Å²	43.2	13%	0.133	22%	0.223	C	C	.	.			trans	-76	175.2	174.2	78.7	0	0	0	0	111.6	E191 D192 I193 R234	S189-E191 PolarHBondContact O-N 3.17Å; S189-E191 PolarHBondContact OG-N 3.31Å; S189-D192 PolarHBondContact O-N 3.24Å; S189-I193 PolarHBondContact O-N 3.1Å; S189-R234 CarbonylContact C-O 3.57Å; S189-R234 WeakPolarHBondContact CA-O 3.47Å; S189-R234 WeakPolarHBondContact CB-O 3.39Å
190	S	93.6	Very high	94.4	Very high	32 Å²	32	44.2 Å²	44.2	22%	0.224	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-11.8	173.1	66.7	0	0	0	0	114.8	I193 R234	S190-I193 WeakPolarHBondContact CA-O 3.5Å; S190-R234 PolarHBondContact N-O 3.06Å; S190-R234 WeakPolarHBondContact OG-CB 3.46Å
191	E	92.4	Very high	94.2	Very high	153 Å²	153	41.5 Å²	41.5	72%	0.715	22%	0.216	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-18.6	173.5	-59.1	-177.9	-177.5	0	0	112.2	S189	S189-E191 PolarHBondContact O-N 3.17Å; S189-E191 PolarHBondContact OG-N 3.31Å
192	D	93.8	Very high	93.7	Very high	53 Å²	53	48.8 Å²	48.8	28%	0.283	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-32	-177.2	-74.6	-52.9	0	0	0	113.9	R57 P64 V65 Y188 S189	R57-D192 WeakPolarHBondContact CD-O 3.11Å; R57-D192 IonicContact CZ-OD1 3.2Å; R57-D192 VanDerWaalsContact CZ-OD1 3.27Å; R57-D192 IonicContact NE-OD1 2.72Å; R57-D192 PolarHBondContact NE-OD1 3.09Å; R57-D192 IonicContact NH2-OD1 3.69Å; R57-D192 PolarHBondContact NH2-OD1 3.19Å; P64-D192 CarbonylContact C-O 3.38Å; P64-D192 WeakPolarHBondContact CA-O 3.49Å; V65-D192 PolarHBondContact N-O 3.23Å; Y188-D192 HydrophobicContact CD1-CB 3.79Å; Y188-D192 HydrophobicContact CG-CB 4.23Å; S189-D192 PolarHBondContact O-N 3.24Å
193	I	95	Very high	93.2	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.005	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	143.7	-179.5	-159.6	163.3	0	0	0	111.3	V65 V67 W121 P123 S189 S190 Y195	V65-I193 WeakPolarHBondContact O-CA 3.32Å; V67-I193 HydrophobicContact CG2-CD1 3.84Å; V67-I193 HydrophobicContact CG2-CG1 3.83Å; W121-I193 HydrophobicContact CH2-CD1 4.34Å; P123-I193 HydrophobicContact CB-CD1 3.75Å; S189-I193 PolarHBondContact O-N 3.1Å; S190-I193 WeakPolarHBondContact CA-O 3.5Å; I193-Y195 HydrophobicContact CD1-CE1 3.64Å; I193-Y195 WeakPolarHBondContact CD1-OH 3.39Å; I193-Y195 HydrophobicContact CG1-CE1 4.08Å
194	V	95.3	Very high	92.6	Very high	54 Å²	54	57.5 Å²	57.5	33%	0.327	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	129.6	169.6	174.6	0	0	0	0	108.2	P64 V65 V67	P64-V194 HydrophobicContact CB-CG2 4.03Å; P64-V194 HydrophobicContact CG-CG2 3.92Å; V65-V194 PolarHBondContact O-N 3.28Å; V67-V194 PolarHBondContact N-O 3.12Å
195	Y	96.3	Very high	92.2	Very high	3 Å²	3	57.7 Å²	57.7	1%	0.012	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.1	170.5	-68.6	-45.4	0	0	0	110.4	V67 M69 P123 T125 I193 P236	V67-Y195 HydrophobicContact CB-CD1 3.77Å; V67-Y195 HydrophobicContact CB-CE1 3.86Å; V67-Y195 HydrophobicContact CG1-CD1 4.08Å; V67-Y195 HydrophobicContact CG1-CE1 3.93Å; V67-Y195 HydrophobicContact CG2-CE1 4.33Å; M69-Y195 HydrophobicContact CG-CD1 3.83Å; M69-Y195 HydrophobicContact CG-CG 4.35Å; M69-Y195 HydrophobicContact SD-CD1 4.06Å; M69-Y195 HydrophobicContact SD-CE1 4.19Å; P123-Y195 HydrophobicContact CB-CE1 4.4Å; T125-Y195 PolarHBondContact OG1-OH 3.48Å; I193-Y195 HydrophobicContact CD1-CE1 3.64Å; I193-Y195 WeakPolarHBondContact CD1-OH 3.39Å; I193-Y195 HydrophobicContact CG1-CE1 4.08Å; Y195-P236 HydrophobicContact CD2-CG 4.12Å
196	H	95.9	Very high	91.8	Very high	50 Å²	50	58.4 Å²	58.4	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	157.1	168.1	69.6	102.6	0	0	0	110.2	D28 D66 V67 A68 M69	D28-H196 IonicContact OD2-CE1 3.23Å; D66-H196 IonicContact OD1-CD2 3.04Å; D66-H196 PolarHBondContact OD1-CD2 3.46Å; D66-H196 IonicContact OD1-NE2 3.56Å; V67-H196 PolarHBondContact O-N 3.02Å; A68-H196 VanDerWaalsContact CA-NE2 3.33Å; A68-H196 WeakPolarHBondContact CA-NE2 3.49Å; A68-H196 WeakPolarHBondContact CB-CE1 3.39Å; A68-H196 VanDerWaalsContact CB-NE2 3.33Å; A68-H196 WeakPolarHBondContact CB-NE2 3.04Å; A68-H196 PolarHBondContact N-NE2 2.82Å; M69-H196 WeakPolarHBondContact CB-O 3.44Å; M69-H196 PolarHBondContact N-O 3.38Å
197	W	96.3	Very high	91.6	Very high	31 Å²	31	50.2 Å²	50.2	12%	0.117	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	138.4	167.1	-66.2	106.4	0	0	0	109.3	I71 Q201 F222 V223 L238 L240	I71-W197 HydrophobicContact CB-CZ3 4.44Å; I71-W197 HydrophobicContact CD1-CH2 3.66Å; I71-W197 HydrophobicContact CD1-CZ3 3.88Å; I71-W197 HydrophobicContact CG1-CH2 4.23Å; I71-W197 HydrophobicContact CG1-CZ3 3.92Å; W197-Q201 HydrophobicContact CD2-CG 4.49Å; W197-Q201 HydrophobicContact CE3-CG 3.88Å; W197-Q201 HydrophobicContact CZ3-CG 4.45Å; W197-F222 HydrophobicContact CD2-CB 4.01Å; W197-F222 HydrophobicContact CD2-CD1 4.04Å; W197-F222 HydrophobicContact CD2-CG 4.37Å; W197-F222 AromaticContact CE2-CD1 3.95Å; W197-F222 AromaticContact CE3-CD1 3.99Å; W197-F222 HydrophobicContact CE3-CD1 3.99Å; W197-F222 HydrophobicContact CG-CB 4.06Å; W197-F222 AromaticContact CH2-CD1 3.77Å; W197-F222 HydrophobicContact CH2-CD1 3.77Å; W197-F222 HydrophobicContact CH2-CE1 4.35Å; W197-F222 HydrophobicContact CZ2-CB 4.36Å; W197-F222 AromaticContact CZ2-CD1 3.81Å; W197-F222 HydrophobicContact CZ2-CD1 3.81Å; W197-F222 AromaticContact CZ3-CD1 3.85Å; W197-F222 HydrophobicContact CZ3-CD1 3.85Å; W197-F222 HydrophobicContact CZ3-CE1 4.31Å; W197-V223 PolarHBondContact NE1-O 3.4Å; W197-L238 HydrophobicContact CD2-CD1 4.1Å; W197-L238 HydrophobicContact CE3-CD1 4.38Å; W197-L238 HydrophobicContact CG-CD1 4.5Å; W197-L238 HydrophobicContact CH2-CB 4.25Å; W197-L238 HydrophobicContact CZ2-CB 3.62Å; W197-L238 HydrophobicContact CZ2-CD1 4.43Å; W197-L240 HydrophobicContact CH2-CB 4.32Å
198	S	95.1	Very high	91.3	Very high	4 Å²	4	53.4 Å²	53.4	3%	0.028	27%	0.267	C	S	.	.			trans	-65.1	143.9	172.4	-179.3	0	0	0	0	111.1	M69 S200 Q201	M69-S198 PolarHBondContact O-N 2.96Å; S198-S200 PolarHBondContact O-N 2.68Å; S198-S200 PolarHBondContact OG-N 3.27Å; S198-S200 PolarHBondContact OG-OG 3.02Å; S198-S200 VanDerWaalsContact OG-OG 3.13Å; S198-Q201 WeakPolarHBondContact O-CB 3.32Å; S198-Q201 PolarHBondContact O-N 3.36Å
199	D	90.5	Very high	90.9	Very high	143 Å²	143	60 Å²	60	77%	0.765	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-29	173	-78.3	-9.8	0	0	0	113.2
200	S	89.3	Confident	90.7	Very high	21 Å²	21	60.7 Å²	60.7	15%	0.147	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-3.8	178.4	61.4	0	0	0	0	114.5	S198 W202 H203 I204	S198-S200 PolarHBondContact O-N 2.68Å; S198-S200 PolarHBondContact OG-N 3.27Å; S198-S200 PolarHBondContact OG-OG 3.02Å; S198-S200 VanDerWaalsContact OG-OG 3.13Å; S200-W202 PolarHBondContact O-N 2.73Å; S200-W202 VanDerWaalsContact O-N 3.16Å; S200-H203 PolarHBondContact O-N 2.95Å; S200-I204 WeakPolarHBondContact O-CG1 3.39Å; S200-I204 PolarHBondContact O-N 3.4Å; S200-I204 VanDerWaalsContact OG-CD1 3.24Å; S200-I204 WeakPolarHBondContact OG-CD1 3.35Å
201	Q	91.4	Very high	90.2	Very high	5 Å²	5	68.6 Å²	68.6	2%	0.023	33%	0.332	C	S	.	.	H	α-helix	trans	-53.8	-40.2	-176.4	176.6	53.4	32.9	0	0	112.8	I71 W197 S198 H203 I204 H205 F222	I71-Q201 PolarHBondContact O-NE2 3.41Å; I71-Q201 PolarHBondContact O-OE1 3.04Å; W197-Q201 HydrophobicContact CD2-CG 4.49Å; W197-Q201 HydrophobicContact CE3-CG 3.88Å; W197-Q201 HydrophobicContact CZ3-CG 4.45Å; S198-Q201 WeakPolarHBondContact O-CB 3.32Å; S198-Q201 PolarHBondContact O-N 3.36Å; Q201-H203 PolarHBondContact O-N 3.39Å; Q201-H203 VanDerWaalsContact O-N 3.12Å; Q201-I204 PolarHBondContact O-N 2.76Å; Q201-I204 VanDerWaalsContact O-N 3.13Å; Q201-H205 PolarHBondContact O-N 3.17Å; Q201-H205 VanDerWaalsContact O-N 3.07Å; Q201-F222 HydrophobicContact CG-CD1 3.82Å; Q201-F222 HydrophobicContact CG-CD2 4.02Å; Q201-F222 HydrophobicContact CG-CE1 3.87Å; Q201-F222 HydrophobicContact CG-CE2 4.08Å; Q201-F222 HydrophobicContact CG-CG 3.92Å; Q201-F222 HydrophobicContact CG-CZ 4.03Å
202	W	86.7	Confident	90	Very high	155 Å²	155	62.8 Å²	62.8	59%	0.587	31%	0.305	S	S	*	.	H	α-helix	trans	-62.5	-18.5	179.8	-165.3	-100	0	0	0	114.1	S200 H205 Y220 F222	S200-W202 PolarHBondContact O-N 2.73Å; S200-W202 VanDerWaalsContact O-N 3.16Å; W202-H205 PolarHBondContact O-CD2 2.96Å; W202-Y220 HydrophobicContact CE3-CE2 4.3Å; W202-Y220 HydrophobicContact CH2-CD2 4.33Å; W202-Y220 AromaticContact CH2-CE2 3.66Å; W202-Y220 HydrophobicContact CH2-CE2 3.66Å; W202-Y220 HydrophobicContact CZ2-CE2 4.31Å; W202-Y220 HydrophobicContact CZ3-CD2 4.13Å; W202-Y220 AromaticContact CZ3-CE2 3.66Å; W202-Y220 HydrophobicContact CZ3-CE2 3.66Å; W202-F222 HydrophobicContact CE3-CD2 4.27Å; W202-F222 HydrophobicContact CE3-CE2 4.3Å; W202-F222 HydrophobicContact CZ3-CD2 4.41Å; W202-F222 HydrophobicContact CZ3-CE2 4.44Å
203	H	86.1	Confident	89.6	Confident	156 Å²	156	65.7 Å²	65.7	72%	0.722	33%	0.33	S	S	*	.	H	α-helix	trans	-102.6	-18.3	177.4	-58.7	89.8	0	0	0	113	S200 Q201	S200-H203 PolarHBondContact O-N 2.95Å; Q201-H203 PolarHBondContact O-N 3.39Å; Q201-H203 VanDerWaalsContact O-N 3.12Å
204	I	85.2	Confident	89.2	Confident	37 Å²	37	69.8 Å²	69.8	19%	0.19	35%	0.349	C	S	.	.	H	α-helix	trans	-97.9	-26.1	-171.7	-70.3	175.8	0	0	0	112.5	I29 A70 E72 S200 Q201 G206	I29-I204 HydrophobicContact CD1-CD1 4.2Å; A70-I204 HydrophobicContact CB-CG2 4.46Å; E72-I204 HydrophobicContact CB-CG2 3.95Å; E72-I204 WeakPolarHBondContact CB-O 3.47Å; E72-I204 WeakPolarHBondContact CG-O 3.34Å; S200-I204 WeakPolarHBondContact O-CG1 3.39Å; S200-I204 PolarHBondContact O-N 3.4Å; S200-I204 VanDerWaalsContact OG-CD1 3.24Å; S200-I204 WeakPolarHBondContact OG-CD1 3.35Å; Q201-I204 PolarHBondContact O-N 2.76Å; Q201-I204 VanDerWaalsContact O-N 3.13Å; I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 3.37Å
205	H	86.5	Confident	89.1	Confident	12 Å²	12	67.3 Å²	67.3	6%	0.056	33%	0.334	C	S	.	.			trans	-43.2	-40.1	-173.9	71.5	111.5	0	0	0	116.9	I71 V73 Q201 W202 L207 D208 Y220 F222	I71-H205 VanDerWaalsContact O-CA 3.31Å; I71-H205 WeakPolarHBondContact O-CA 3.44Å; V73-H205 PolarHBondContact N-O 3.01Å; Q201-H205 PolarHBondContact O-N 3.17Å; Q201-H205 VanDerWaalsContact O-N 3.07Å; W202-H205 PolarHBondContact O-CD2 2.96Å; H205-L207 VanDerWaalsContact C-N 3.26Å; H205-L207 HydrophobicContact CB-CD1 3.72Å; H205-L207 PolarHBondContact ND1-N 2.95Å; H205-L207 PolarHBondContact O-N 3.39Å; H205-D208 IonicContact CE1-OD1 2.81Å; H205-D208 PolarHBondContact CE1-OD1 3.41Å; H205-D208 IonicContact CE1-OD2 3.97Å; H205-D208 IonicContact NE2-OD2 2.67Å; H205-Y220 AromaticContact CE1-CE2 3.93Å; H205-Y220 AromaticContact CE1-CZ 3.45Å; H205-Y220 VanDerWaalsContact CE1-CZ 3.45Å; H205-Y220 PolarHBondContact CE1-OH 2.65Å; H205-Y220 AromaticContact ND1-CE2 3.56Å; H205-Y220 AromaticContact ND1-CZ 3.47Å; H205-F222 HydrophobicContact CB-CE2 4.14Å; H205-F222 HydrophobicContact CB-CZ 3.65Å
206	G	87.1	Confident	88.9	Confident	16 Å²	16	69.8 Å²	69.8	17%	0.165	35%	0.349	C	S	.	.			trans	78.7	-9.9	175.8	0	0	0	0	0	116.4	I204 D208 K209	I204-G206 VanDerWaalsContact C-N 3.29Å; I204-G206 PolarHBondContact O-N 3.37Å; G206-D208 VanDerWaalsContact C-N 3.29Å; G206-D208 PolarHBondContact O-N 3.28Å; G206-K209 PolarHBondContact O-N 3.02Å
207	L	88.1	Confident	88.8	Confident	7 Å²	7	68.9 Å²	68.9	4%	0.037	35%	0.346	C	S	.	.	G	3₁₀ helix	trans	-59.5	-33.9	-174.1	-72.4	91.1	0	0	0	113.8	V73 H205 K209 L210 I217 Y220 L240 F242	V73-L207 HydrophobicContact CB-CD1 4.42Å; V73-L207 HydrophobicContact CB-CG 4.44Å; V73-L207 HydrophobicContact CG2-CD1 3.78Å; V73-L207 HydrophobicContact CG2-CG 4.13Å; H205-L207 VanDerWaalsContact C-N 3.26Å; H205-L207 HydrophobicContact CB-CD1 3.72Å; H205-L207 PolarHBondContact ND1-N 2.95Å; H205-L207 PolarHBondContact O-N 3.39Å; L207-K209 PolarHBondContact O-N 2.99Å; L207-K209 VanDerWaalsContact O-N 3.08Å; L207-L210 HydrophobicContact CB-CD1 4.48Å; L207-L210 HydrophobicContact CG-CD1 4.4Å; L207-L210 WeakPolarHBondContact O-CB 3.32Å; L207-L210 PolarHBondContact O-N 3.02Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L207-I217 HydrophobicContact CB-CD1 4.39Å; L207-I217 HydrophobicContact CD2-CD1 4.32Å; L207-I217 HydrophobicContact CD2-CG2 4.38Å; L207-Y220 HydrophobicContact CB-CD1 4.07Å; L207-Y220 HydrophobicContact CB-CE1 4.13Å; L207-Y220 HydrophobicContact CD2-CD1 4.08Å; L207-Y220 HydrophobicContact CD2-CG 4.04Å; L207-L240 HydrophobicContact CD2-CD1 4.49Å; L207-F242 HydrophobicContact CD2-CB 4.08Å
208	D	85.9	Confident	88.6	Confident	118 Å²	118	70.2 Å²	70.2	63%	0.631	36%	0.357	S	S	*	.	G	3₁₀ helix	trans	-63.4	-16.6	-177.8	-66.9	-3.4	0	0	0	113.8	H205 G206 Y220	H205-D208 IonicContact CE1-OD1 2.81Å; H205-D208 PolarHBondContact CE1-OD1 3.41Å; H205-D208 IonicContact CE1-OD2 3.97Å; H205-D208 IonicContact NE2-OD2 2.67Å; G206-D208 VanDerWaalsContact C-N 3.29Å; G206-D208 PolarHBondContact O-N 3.28Å; D208-Y220 VanDerWaalsContact OD1-CE1 3.24Å; D208-Y220 WeakPolarHBondContact OD1-CE1 3.31Å; D208-Y220 PolarHBondContact OD1-OH 3.09Å
209	K	84.8	Confident	88.6	Confident	189 Å²	189	73.8 Å²	73.8	82%	0.822	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-99.9	0.3	-178.8	-61.6	173.5	-174.7	166.1	0	113	G206 L207	G206-K209 PolarHBondContact O-N 3.02Å; L207-K209 PolarHBondContact O-N 2.99Å; L207-K209 VanDerWaalsContact O-N 3.08Å
210	L	88.6	Confident	88.8	Confident	35 Å²	35	68.3 Å²	68.3	18%	0.183	35%	0.345	C	S	.	.			trans	-86.8	113.7	-174	-62.8	178.8	0	0	0	111.6	V73 I76 L207 I217	V73-L210 HydrophobicContact CB-CD1 4.09Å; V73-L210 HydrophobicContact CG1-CD1 3.62Å; I76-L210 HydrophobicContact CD1-CD1 4.35Å; I76-L210 HydrophobicContact CG1-CD1 4.37Å; L207-L210 HydrophobicContact CB-CD1 4.48Å; L207-L210 HydrophobicContact CG-CD1 4.4Å; L207-L210 WeakPolarHBondContact O-CB 3.32Å; L207-L210 PolarHBondContact O-N 3.02Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L210-I217 HydrophobicContact CB-CD1 4.08Å; L210-I217 HydrophobicContact CD1-CD1 4Å
211	E	84.6	Confident	89	Confident	198 Å²	198	72.4 Å²	72.4	93%	0.925	36%	0.357	S	S	*	.			trans	-92.7	113.2	169.3	-65.2	-170.5	167.1	0	0	110.3
212	L	88.6	Confident	89.2	Confident	30 Å²	30	74.2 Å²	74.2	16%	0.157	37%	0.365	C	S	.	.			trans	-101.4	139.4	175.8	-54.4	178.6	0	0	0	110.1	I76 F215 I217 L244	I76-L212 HydrophobicContact CB-CD2 3.88Å; I76-L212 WeakPolarHBondContact O-CD2 3.42Å; L212-F215 HydrophobicContact CB-CB 4.41Å; L212-F215 HydrophobicContact CD1-CB 4.17Å; L212-I217 HydrophobicContact CD1-CD1 4.3Å; L212-I217 HydrophobicContact CD1-CG1 4.04Å; L212-L244 HydrophobicContact CD1-CD2 3.86Å
213	S	83.8	Confident	89.7	Confident	114 Å²	114	68.4 Å²	68.4	80%	0.797	35%	0.347	S	S	*	.	S	Bend	trans	-71.4	-39	-175.7	58.2	0	0	0	0	113.7
214	Q	88	Confident	90.1	Very high	87 Å²	87	64.6 Å²	64.6	41%	0.407	34%	0.335	S	S	.	.	S	Bend	trans	-107.1	-15.2	-173.9	-68.3	179.7	-9.6	0	0	114.4	N247	Q214-N247 WeakPolarHBondContact O-CB 3.31Å; Q214-N247 PolarHBondContact O-N 2.85Å
215	F	92.2	Very high	90.5	Very high	3 Å²	3	66 Å²	66	1%	0.013	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	173.3	-172.6	-66.1	-91.4	0	0	0	111	I79 L212 L244 R245 R246 N247	I79-F215 HydrophobicContact CB-CE2 4Å; I79-F215 HydrophobicContact CD1-CD2 3.45Å; I79-F215 VanDerWaalsContact CD1-CD2 3.45Å; I79-F215 HydrophobicContact CD1-CE2 3.77Å; I79-F215 HydrophobicContact CD1-CG 4.11Å; I79-F215 HydrophobicContact CG1-CE2 4.5Å; I79-F215 HydrophobicContact CG2-CE2 3.77Å; I79-F215 HydrophobicContact CG2-CZ 3.99Å; L212-F215 HydrophobicContact CB-CB 4.41Å; L212-F215 HydrophobicContact CD1-CB 4.17Å; F215-L244 HydrophobicContact CB-CB 4.44Å; F215-L244 HydrophobicContact CB-CD2 4.41Å; F215-L244 HydrophobicContact CD1-CB 3.92Å; F215-L244 HydrophobicContact CG-CB 4.42Å; F215-R245 CarbonylContact C-O 3.6Å; F215-R245 VanDerWaalsContact CA-O 3.28Å; F215-R245 WeakPolarHBondContact CA-O 3.43Å; F215-R246 HydrophobicContact CD1-CB 4.19Å; F215-R246 HydrophobicContact CE1-CB 4.1Å; F215-R246 HydrophobicContact CE1-CG 4.31Å; F215-R246 VanDerWaalsContact CZ-NH1 3.32Å; F215-N247 PolarHBondContact O-ND2 2.86Å
216	T	92.6	Very high	90.8	Very high	54 Å²	54	69.9 Å²	69.9	33%	0.331	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	132.3	168.4	-57.6	0	0	0	0	107.4	T218 R245 N247	T216-T218 PolarHBondContact O-N 2.96Å; T216-R245 PolarHBondContact N-O 2.89Å; T216-R245 PolarHBondContact O-N 2.99Å; T216-N247 PolarHBondContact OG1-OD1 3.01Å
217	I	93.4	Very high	91.1	Very high	32 Å²	32	71.7 Å²	71.7	16%	0.164	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.1	174.3	-60	161	0	0	0	107.1	I76 L207 L210 L212 Y220 Q243 L244	I76-I217 HydrophobicContact CD1-CD1 4.42Å; L207-I217 HydrophobicContact CB-CD1 4.39Å; L207-I217 HydrophobicContact CD2-CD1 4.32Å; L207-I217 HydrophobicContact CD2-CG2 4.38Å; L210-I217 HydrophobicContact CB-CD1 4.08Å; L210-I217 HydrophobicContact CD1-CD1 4Å; L212-I217 HydrophobicContact CD1-CD1 4.3Å; L212-I217 HydrophobicContact CD1-CG1 4.04Å; I217-Y220 HydrophobicContact CG2-CD1 4.22Å; I217-Q243 CarbonylContact C-O 3.54Å; I217-Q243 VanDerWaalsContact CA-O 3.31Å; I217-Q243 WeakPolarHBondContact CA-O 3.36Å; I217-L244 HydrophobicContact CG1-CD2 3.87Å
218	T	92.6	Very high	91.3	Very high	58 Å²	58	76.4 Å²	76.4	36%	0.356	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	-36.2	-178.4	45.9	0	0	0	0	113.1	T216 Q243 R245	T216-T218 PolarHBondContact O-N 2.96Å; T218-Q243 PolarHBondContact N-O 3.49Å; T218-Q243 WeakPolarHBondContact OG1-CB 3.34Å; T218-Q243 PolarHBondContact OG1-O 3.47Å; T218-R245 HydrophobicContact CG2-CB 3.63Å
219	D	93.8	Very high	91.5	Very high	79 Å²	79	74.9 Å²	74.9	42%	0.422	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	156.7	-178.9	-173.9	30.7	0	0	0	110	F242 Q243	D219-F242 WeakPolarHBondContact O-CA 3.39Å; D219-Q243 HydrophobicContact CB-CB 4.4Å; D219-Q243 HydrophobicContact CB-CG 4.4Å; D219-Q243 PolarHBondContact O-N 3.4Å
220	Y	94.6	Very high	91.3	Very high	29 Å²	29	76.4 Å²	76.4	11%	0.114	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	145.1	172.5	55.3	-94.8	0	0	0	111.9	W202 H205 L207 D208 I217 F222 R241	W202-Y220 HydrophobicContact CE3-CE2 4.3Å; W202-Y220 HydrophobicContact CH2-CD2 4.33Å; W202-Y220 AromaticContact CH2-CE2 3.66Å; W202-Y220 HydrophobicContact CH2-CE2 3.66Å; W202-Y220 HydrophobicContact CZ2-CE2 4.31Å; W202-Y220 HydrophobicContact CZ3-CD2 4.13Å; W202-Y220 AromaticContact CZ3-CE2 3.66Å; W202-Y220 HydrophobicContact CZ3-CE2 3.66Å; H205-Y220 AromaticContact CE1-CE2 3.93Å; H205-Y220 AromaticContact CE1-CZ 3.45Å; H205-Y220 VanDerWaalsContact CE1-CZ 3.45Å; H205-Y220 PolarHBondContact CE1-OH 2.65Å; H205-Y220 AromaticContact ND1-CE2 3.56Å; H205-Y220 AromaticContact ND1-CZ 3.47Å; L207-Y220 HydrophobicContact CB-CD1 4.07Å; L207-Y220 HydrophobicContact CB-CE1 4.13Å; L207-Y220 HydrophobicContact CD2-CD1 4.08Å; L207-Y220 HydrophobicContact CD2-CG 4.04Å; D208-Y220 VanDerWaalsContact OD1-CE1 3.24Å; D208-Y220 WeakPolarHBondContact OD1-CE1 3.31Å; D208-Y220 PolarHBondContact OD1-OH 3.09Å; I217-Y220 HydrophobicContact CG2-CD1 4.22Å; Y220-F222 AromaticContact CD2-CE2 3.89Å; Y220-F222 HydrophobicContact CD2-CE2 3.89Å; Y220-F222 HydrophobicContact CD2-CZ 4.37Å; Y220-F222 HydrophobicContact CE2-CE2 4.21Å; Y220-R241 CarbonylContact C-O 3.19Å; Y220-R241 VanDerWaalsContact CA-O 3.29Å; Y220-R241 WeakPolarHBondContact CA-O 3.37Å
221	R	95.1	Very high	91.1	Very high	107 Å²	107	80.9 Å²	80.9	40%	0.404	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	137.9	-177.4	58.2	-175.8	178.9	160.3	-3.4	111.7	E178 V223 R241	E178-R221 VanDerWaalsContact CD-NH2 3.34Å; E178-R221 IonicContact OE1-CZ 2.67Å; E178-R221 VanDerWaalsContact OE1-CZ 3.22Å; E178-R221 IonicContact OE1-NE 3.87Å; E178-R221 PolarHBondContact OE1-NE 2.68Å; E178-R221 IonicContact OE1-NH2 2.63Å; E178-R221 PolarHBondContact OE1-NH2 3.23Å; E178-R221 IonicContact OE2-NH2 3.34Å; E178-R221 PolarHBondContact OE2-NH2 2.94Å; R221-V223 HydrophobicContact CB-CG2 4.43Å; R221-V223 HydrophobicContact CG-CG2 4.04Å; R221-R241 HydrophobicContact CG-CB 3.8Å; R221-R241 HydrophobicContact CG-CG 4.47Å; R221-R241 PolarHBondContact N-O 2.97Å; R221-R241 PolarHBondContact O-N 2.79Å
222	F	95.8	Very high	91.1	Very high	42 Å²	42	74.4 Å²	74.4	18%	0.184	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	118.2	171.6	-61.6	-76.7	0	0	0	108	W197 Q201 W202 H205 Y220 L240	W197-F222 HydrophobicContact CD2-CB 4.01Å; W197-F222 HydrophobicContact CD2-CD1 4.04Å; W197-F222 HydrophobicContact CD2-CG 4.37Å; W197-F222 AromaticContact CE2-CD1 3.95Å; W197-F222 AromaticContact CE3-CD1 3.99Å; W197-F222 HydrophobicContact CE3-CD1 3.99Å; W197-F222 HydrophobicContact CG-CB 4.06Å; W197-F222 AromaticContact CH2-CD1 3.77Å; W197-F222 HydrophobicContact CH2-CD1 3.77Å; W197-F222 HydrophobicContact CH2-CE1 4.35Å; W197-F222 HydrophobicContact CZ2-CB 4.36Å; W197-F222 AromaticContact CZ2-CD1 3.81Å; W197-F222 HydrophobicContact CZ2-CD1 3.81Å; W197-F222 AromaticContact CZ3-CD1 3.85Å; W197-F222 HydrophobicContact CZ3-CD1 3.85Å; W197-F222 HydrophobicContact CZ3-CE1 4.31Å; Q201-F222 HydrophobicContact CG-CD1 3.82Å; Q201-F222 HydrophobicContact CG-CD2 4.02Å; Q201-F222 HydrophobicContact CG-CE1 3.87Å; Q201-F222 HydrophobicContact CG-CE2 4.08Å; Q201-F222 HydrophobicContact CG-CG 3.92Å; Q201-F222 HydrophobicContact CG-CZ 4.03Å; W202-F222 HydrophobicContact CE3-CD2 4.27Å; W202-F222 HydrophobicContact CE3-CE2 4.3Å; W202-F222 HydrophobicContact CZ3-CD2 4.41Å; W202-F222 HydrophobicContact CZ3-CE2 4.44Å; H205-F222 HydrophobicContact CB-CE2 4.14Å; H205-F222 HydrophobicContact CB-CZ 3.65Å; Y220-F222 AromaticContact CD2-CE2 3.89Å; Y220-F222 HydrophobicContact CD2-CE2 3.89Å; Y220-F222 HydrophobicContact CD2-CZ 4.37Å; Y220-F222 HydrophobicContact CE2-CE2 4.21Å; F222-L240 HydrophobicContact CD1-CB 4.31Å; F222-L240 HydrophobicContact CD1-CD1 4.26Å; F222-L240 HydrophobicContact CE1-CB 4.13Å; F222-L240 HydrophobicContact CE1-CD1 3.64Å; F222-L240 HydrophobicContact CE1-CD2 4.33Å; F222-L240 HydrophobicContact CE1-CG 4.22Å; F222-L240 HydrophobicContact CZ-CD1 3.93Å
223	V	95.6	Very high	91.1	Very high	33 Å²	33	74.7 Å²	74.7	20%	0.2	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	144.7	-175.8	-165.9	0	0	0	0	109.1	W197 R221 E225 L238 S239	W197-V223 PolarHBondContact NE1-O 3.4Å; R221-V223 HydrophobicContact CB-CG2 4.43Å; R221-V223 HydrophobicContact CG-CG2 4.04Å; V223-E225 HydrophobicContact CG1-CG 3.73Å; V223-L238 WeakPolarHBondContact O-CA 3.46Å; V223-S239 PolarHBondContact N-O 3.42Å; V223-S239 PolarHBondContact O-N 3.47Å
224	T	95.4	Very high	91.6	Very high	77 Å²	77	76.3 Å²	76.3	47%	0.472	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	122.7	169.5	-59.8	0	0	0	0	107.7	R237 L238	T224-R237 WeakPolarHBondContact CA-O 3.37Å; T224-L238 HydrophobicContact CG2-CD2 3.77Å; T224-L238 WeakPolarHBondContact OG1-CD2 3.48Å
225	E	93.8	Very high	91.9	Very high	67 Å²	67	72.9 Å²	72.9	31%	0.313	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	153.2	-177.9	-59.9	-171	160.2	0	0	109.8	V223 R237 R241	V223-E225 HydrophobicContact CG1-CG 3.73Å; E225-R237 PolarHBondContact N-O 3.47Å; E225-R237 PolarHBondContact O-N 3.21Å; E225-R241 IonicContact OE1-CZ 3.93Å; E225-R241 IonicContact OE1-NH1 3.72Å; E225-R241 PolarHBondContact OE1-NH1 3.04Å; E225-R241 IonicContact OE1-NH2 2.73Å; E225-R241 PolarHBondContact OE1-NH2 3.03Å; E225-R241 IonicContact OE2-NH2 2.88Å; E225-R241 PolarHBondContact OE2-NH2 3.3Å
226	M	93.1	Very high	91.9	Very high	93 Å²	93	72.9 Å²	72.9	46%	0.458	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	105	180	-174.4	61.9	63.8	0	0	109.8	N228 R234 F235 P236	M226-N228 PolarHBondContact O-ND2 2.91Å; M226-R234 HydrophobicContact CG-CB 4.45Å; M226-R234 HydrophobicContact SD-CB 3.94Å; M226-F235 VanDerWaalsContact SD-C 3.6Å; M226-P236 HydrophobicContact CE-CB 4.13Å
227	M	92.9	Very high	92	Very high	53 Å²	53	71.6 Å²	71.6	26%	0.261	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.3	-178.4	-61.6	-56.5	-74.2	0	0	110.3	F229 R234 F235 R237	M227-F229 HydrophobicContact CB-CD2 4.21Å; M227-F229 HydrophobicContact CB-CE2 3.52Å; M227-F229 HydrophobicContact CB-CZ 4.08Å; M227-F229 HydrophobicContact CG-CE2 4.45Å; M227-R234 CarbonylContact O-C 3.5Å; M227-R234 VanDerWaalsContact O-CA 3.29Å; M227-R234 WeakPolarHBondContact O-CA 3.39Å; M227-F235 PolarHBondContact N-O 3.45Å; M227-F235 PolarHBondContact O-N 3.5Å; M227-R237 HydrophobicContact CG-CB 3.89Å
228	N	92.5	Very high	92.2	Very high	107 Å²	107	70.1 Å²	70.1	57%	0.572	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.2	97	-178.7	-72.2	-86.7	0	0	0	110.1	M226 R234	M226-N228 PolarHBondContact O-ND2 2.91Å; N228-R234 WeakPolarHBondContact OD1-CD 3.3Å; N228-R234 VanDerWaalsContact OD1-CG 3.31Å; N228-R234 WeakPolarHBondContact OD1-CG 3.46Å; N228-R234 PolarHBondContact OD1-NE 3.49Å
229	F	89.1	Confident	92.4	Very high	86 Å²	86	67.3 Å²	67.3	38%	0.377	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	116.8	176.7	-63.1	-82.4	0	0	0	110.5	E184 M227 S231 A232 G233 F235	E184-F229 WeakPolarHBondContact OE1-CE2 3.36Å; M227-F229 HydrophobicContact CB-CD2 4.21Å; M227-F229 HydrophobicContact CB-CE2 3.52Å; M227-F229 HydrophobicContact CB-CZ 4.08Å; M227-F229 HydrophobicContact CG-CE2 4.45Å; F229-S231 PolarHBondContact O-N 3.24Å; F229-A232 HydrophobicContact CB-CB 4.12Å; F229-A232 PolarHBondContact O-N 3Å; F229-A232 VanDerWaalsContact O-N 3.12Å; F229-G233 PolarHBondContact N-O 2.88Å; F229-G233 PolarHBondContact O-N 3.27Å; F229-F235 AromaticContact CD2-CD2 3.77Å; F229-F235 HydrophobicContact CD2-CD2 3.77Å; F229-F235 HydrophobicContact CD2-CE2 4.42Å; F229-F235 HydrophobicContact CD2-CG 4.45Å; F229-F235 HydrophobicContact CE2-CB 4.41Å; F229-F235 HydrophobicContact CE2-CD2 4.33Å
230	K	82.3	Confident	92.6	Very high	220 Å²	220	63.6 Å²	63.6	96%	0.957	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-25.7	-176.4	-65.8	-175.8	179.3	179.8	0	114.8
231	S	83.6	Confident	92.6	Very high	130 Å²	130	63.8 Å²	63.8	91%	0.909	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-17.6	-176.6	-48.2	0	0	0	0	114.6	F229	F229-S231 PolarHBondContact O-N 3.24Å
232	A	83.7	Confident	92.6	Very high	62 Å²	62	58.8 Å²	58.8	51%	0.512	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	-16.7	-168.9	0	0	0	0	0	114	F229 F235	F229-A232 HydrophobicContact CB-CB 4.12Å; F229-A232 PolarHBondContact O-N 3Å; F229-A232 VanDerWaalsContact O-N 3.12Å; A232-F235 HydrophobicContact CB-CE2 3.77Å; A232-F235 HydrophobicContact CB-CZ 4.18Å; A232-F235 WeakPolarHBondContact O-CE2 3.43Å
233	G	90.1	Very high	92.6	Very high	35 Å²	35	59.9 Å²	59.9	36%	0.361	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	107.3	-150	-178.9	0	0	0	0	0	113.1	F229	F229-G233 PolarHBondContact N-O 2.88Å; F229-G233 PolarHBondContact O-N 3.27Å
234	R	94	Very high	92.5	Very high	148 Å²	148	58.4 Å²	58.4	56%	0.558	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	137.2	-177.8	-62.4	-167.9	172.6	146.5	3.1	110.6	S189 S190 M226 M227 N228	S189-R234 CarbonylContact C-O 3.57Å; S189-R234 WeakPolarHBondContact CA-O 3.47Å; S189-R234 WeakPolarHBondContact CB-O 3.39Å; S190-R234 PolarHBondContact N-O 3.06Å; S190-R234 WeakPolarHBondContact OG-CB 3.46Å; M226-R234 HydrophobicContact CG-CB 4.45Å; M226-R234 HydrophobicContact SD-CB 3.94Å; M227-R234 CarbonylContact O-C 3.5Å; M227-R234 VanDerWaalsContact O-CA 3.29Å; M227-R234 WeakPolarHBondContact O-CA 3.39Å; N228-R234 WeakPolarHBondContact OD1-CD 3.3Å; N228-R234 VanDerWaalsContact OD1-CG 3.31Å; N228-R234 WeakPolarHBondContact OD1-CG 3.46Å; N228-R234 PolarHBondContact OD1-NE 3.49Å
235	F	94.3	Very high	92.5	Very high	15 Å²	15	60.4 Å²	60.4	7%	0.066	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	127.9	-177.4	-70.5	-101.3	0	0	0	110	E184 S185 Y188 M226 M227 F229 A232 R237	E184-F235 HydrophobicContact CG-CB 4.02Å; E184-F235 WeakPolarHBondContact OE1-CB 3.4Å; S185-F235 WeakPolarHBondContact O-CD1 3.49Å; Y188-F235 VanDerWaalsContact O-CD1 3.26Å; Y188-F235 WeakPolarHBondContact O-CD1 3.13Å; Y188-F235 VanDerWaalsContact O-CE1 3.27Å; Y188-F235 WeakPolarHBondContact O-CE1 3.22Å; M226-F235 VanDerWaalsContact SD-C 3.6Å; M227-F235 PolarHBondContact N-O 3.45Å; M227-F235 PolarHBondContact O-N 3.5Å; F229-F235 AromaticContact CD2-CD2 3.77Å; F229-F235 HydrophobicContact CD2-CD2 3.77Å; F229-F235 HydrophobicContact CD2-CE2 4.42Å; F229-F235 HydrophobicContact CD2-CG 4.45Å; F229-F235 HydrophobicContact CE2-CB 4.41Å; F229-F235 HydrophobicContact CE2-CD2 4.33Å; A232-F235 HydrophobicContact CB-CE2 3.77Å; A232-F235 HydrophobicContact CB-CZ 4.18Å; A232-F235 WeakPolarHBondContact O-CE2 3.43Å; F235-R237 PolarHBondContact O-N 2.76Å
236	P	91.8	Very high	92.4	Very high	3 Å²	3	57.6 Å²	57.6	2%	0.019	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	125.7	173.4	30.6	-32.2	0	0	0	109.4	Y195 M226	Y195-P236 HydrophobicContact CD2-CG 4.12Å; M226-P236 HydrophobicContact CE-CB 4.13Å
237	R	95.8	Very high	92.3	Very high	28 Å²	28	56.1 Å²	56.1	11%	0.106	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	134.1	175	179.7	178.4	-68.5	-166	9.5	109.8	D182 L183 E184 T224 E225 M227 F235	D182-R237 HydrophobicContact CB-CG 4.4Å; D182-R237 WeakPolarHBondContact OD2-CD 3.49Å; D182-R237 IonicContact OD2-CZ 3.31Å; D182-R237 IonicContact OD2-NE 2.9Å; D182-R237 IonicContact OD2-NH1 3.88Å; D182-R237 PolarHBondContact OD2-NH1 2.87Å; L183-R237 WeakPolarHBondContact O-CA 3.31Å; E184-R237 IonicContact OE2-CZ 2.88Å; E184-R237 IonicContact OE2-NE 3.02Å; E184-R237 PolarHBondContact OE2-NE 2.68Å; E184-R237 IonicContact OE2-NH2 2.72Å; E184-R237 PolarHBondContact OE2-NH2 3.25Å; T224-R237 WeakPolarHBondContact CA-O 3.37Å; E225-R237 PolarHBondContact N-O 3.47Å; E225-R237 PolarHBondContact O-N 3.21Å; M227-R237 HydrophobicContact CG-CB 3.89Å; F235-R237 PolarHBondContact O-N 2.76Å
238	L	97.1	Very high	92.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	127.8	169.1	-61.9	-171.1	0	0	0	109.6	M69 L183 W197 V223 T224	M69-L238 HydrophobicContact CB-CD1 3.44Å; M69-L238 VanDerWaalsContact CB-CD1 3.44Å; M69-L238 HydrophobicContact CG-CD1 3.58Å; L183-L238 HydrophobicContact CB-CB 4.44Å; L183-L238 PolarHBondContact N-O 2.85Å; L183-L238 PolarHBondContact O-N 3.45Å; W197-L238 HydrophobicContact CD2-CD1 4.1Å; W197-L238 HydrophobicContact CE3-CD1 4.38Å; W197-L238 HydrophobicContact CG-CD1 4.5Å; W197-L238 HydrophobicContact CH2-CB 4.25Å; W197-L238 HydrophobicContact CZ2-CB 3.62Å; W197-L238 HydrophobicContact CZ2-CD1 4.43Å; V223-L238 WeakPolarHBondContact O-CA 3.46Å; T224-L238 HydrophobicContact CG2-CD2 3.77Å; T224-L238 WeakPolarHBondContact OG1-CD2 3.48Å
239	S	96.8	Very high	92	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	119	178.9	-61.6	0	0	0	0	110.5	L181 D182 V223	L181-S239 WeakPolarHBondContact O-CA 3.48Å; D182-S239 VanDerWaalsContact OD1-CB 3.3Å; D182-S239 WeakPolarHBondContact OD1-CB 3.39Å; D182-S239 PolarHBondContact OD1-OG 3.13Å; V223-S239 PolarHBondContact N-O 3.42Å; V223-S239 PolarHBondContact O-N 3.47Å
240	L	96.5	Very high	92	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	111.1	159.4	159.1	56.6	0	0	0	106.9	I71 V73 M180 L181 W197 L207 F222 F242	I71-L240 HydrophobicContact CG2-CD2 4.34Å; V73-L240 HydrophobicContact CG2-CD2 3.98Å; M180-L240 CarbonylContact C-O 3.6Å; M180-L240 VanDerWaalsContact CA-O 3.29Å; M180-L240 WeakPolarHBondContact CA-O 3.33Å; L181-L240 HydrophobicContact CB-CB 4.39Å; L181-L240 PolarHBondContact N-O 3.23Å; L181-L240 PolarHBondContact O-N 3.01Å; W197-L240 HydrophobicContact CH2-CB 4.32Å; L207-L240 HydrophobicContact CD2-CD1 4.49Å; F222-L240 HydrophobicContact CD1-CB 4.31Å; F222-L240 HydrophobicContact CD1-CD1 4.26Å; F222-L240 HydrophobicContact CE1-CB 4.13Å; F222-L240 HydrophobicContact CE1-CD1 3.64Å; F222-L240 HydrophobicContact CE1-CD2 4.33Å; F222-L240 HydrophobicContact CE1-CG 4.22Å; F222-L240 HydrophobicContact CZ-CD1 3.93Å; L240-F242 HydrophobicContact CD1-CD1 4.47Å; L240-F242 HydrophobicContact CG-CD1 4.24Å
241	R	96.2	Very high	92.4	Very high	34 Å²	34	47.1 Å²	47.1	13%	0.128	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	136.8	172.8	-48.6	-172.7	171.7	146.5	5.5	109.6	E178 C179 M180 Y220 R221 E225	E178-R241 HydrophobicContact CG-CB 4.37Å; E178-R241 VanDerWaalsContact OE1-CB 3.29Å; E178-R241 WeakPolarHBondContact OE1-CB 3.43Å; E178-R241 WeakPolarHBondContact OE1-CD 3.46Å; C179-R241 CarbonylContact O-C 3.57Å; C179-R241 WeakPolarHBondContact O-CA 3.45Å; M180-R241 HydrophobicContact CB-CG 3.95Å; Y220-R241 CarbonylContact C-O 3.19Å; Y220-R241 VanDerWaalsContact CA-O 3.29Å; Y220-R241 WeakPolarHBondContact CA-O 3.37Å; R221-R241 HydrophobicContact CG-CB 3.8Å; R221-R241 HydrophobicContact CG-CG 4.47Å; R221-R241 PolarHBondContact N-O 2.97Å; R221-R241 PolarHBondContact O-N 2.79Å; E225-R241 IonicContact OE1-CZ 3.93Å; E225-R241 IonicContact OE1-NH1 3.72Å; E225-R241 PolarHBondContact OE1-NH1 3.04Å; E225-R241 IonicContact OE1-NH2 2.73Å; E225-R241 PolarHBondContact OE1-NH2 3.03Å; E225-R241 IonicContact OE2-NH2 2.88Å; E225-R241 PolarHBondContact OE2-NH2 3.3Å
242	F	94.8	Very high	92.8	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.009	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	140.2	-178.7	58.3	-80.6	0	0	0	110.6	I76 Y86 M88 C179 L207 D219 L240 L244	I76-F242 HydrophobicContact CD1-CD2 4.38Å; I76-F242 HydrophobicContact CD1-CE2 3.84Å; I76-F242 HydrophobicContact CD1-CZ 4.27Å; Y86-F242 HydrophobicContact CD2-CZ 4.4Å; Y86-F242 HydrophobicContact CE1-CZ 4.05Å; Y86-F242 HydrophobicContact CE2-CE1 4.47Å; Y86-F242 AromaticContact CE2-CZ 3.95Å; Y86-F242 HydrophobicContact CE2-CZ 3.95Å; Y86-F242 AromaticContact CZ-CZ 3.73Å; M88-F242 HydrophobicContact CE-CE1 3.78Å; M88-F242 HydrophobicContact CE-CZ 3.86Å; C179-F242 HydrophobicContact CB-CE1 4.08Å; C179-F242 HydrophobicContact CB-CE2 3.93Å; C179-F242 HydrophobicContact CB-CZ 3.67Å; C179-F242 PolarHBondContact N-O 3.47Å; C179-F242 WeakPolarHBondContact O-CD1 3.48Å; C179-F242 PolarHBondContact O-N 3.3Å; L207-F242 HydrophobicContact CD2-CB 4.08Å; D219-F242 WeakPolarHBondContact O-CA 3.39Å; L240-F242 HydrophobicContact CD1-CD1 4.47Å; L240-F242 HydrophobicContact CG-CD1 4.24Å; F242-L244 HydrophobicContact CD2-CD1 4.46Å; F242-L244 HydrophobicContact CD2-CD2 3.87Å; F242-L244 HydrophobicContact CD2-CG 3.94Å; F242-L244 HydrophobicContact CE2-CD1 3.96Å; F242-L244 HydrophobicContact CE2-CD2 3.97Å; F242-L244 HydrophobicContact CE2-CG 3.94Å
243	Q	95.3	Very high	93.2	Very high	65 Å²	65	46 Å²	46	30%	0.304	23%	0.225	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	128	-179.5	-67.3	-178.8	1.7	0	0	110.2	Q177 I217 T218 D219	Q177-Q243 CarbonylContact O-C 3.56Å; Q177-Q243 WeakPolarHBondContact O-CA 3.07Å; I217-Q243 CarbonylContact C-O 3.54Å; I217-Q243 VanDerWaalsContact CA-O 3.31Å; I217-Q243 WeakPolarHBondContact CA-O 3.36Å; T218-Q243 PolarHBondContact N-O 3.49Å; T218-Q243 WeakPolarHBondContact OG1-CB 3.34Å; T218-Q243 PolarHBondContact OG1-O 3.47Å; D219-Q243 HydrophobicContact CB-CB 4.4Å; D219-Q243 HydrophobicContact CB-CG 4.4Å; D219-Q243 PolarHBondContact O-N 3.4Å
244	L	94.4	Very high	93.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	115.8	177.7	-63.1	176	0	0	0	109.5	I79 E176 Q177 L212 F215 I217 F242	I79-L244 HydrophobicContact CD1-CD1 3.93Å; E176-L244 WeakPolarHBondContact CA-O 3.32Å; Q177-L244 HydrophobicContact CB-CB 4.48Å; Q177-L244 PolarHBondContact N-O 2.97Å; Q177-L244 PolarHBondContact O-N 3.3Å; L212-L244 HydrophobicContact CD1-CD2 3.86Å; F215-L244 HydrophobicContact CB-CB 4.44Å; F215-L244 HydrophobicContact CB-CD2 4.41Å; F215-L244 HydrophobicContact CD1-CB 3.92Å; F215-L244 HydrophobicContact CG-CB 4.42Å; I217-L244 HydrophobicContact CG1-CD2 3.87Å; F242-L244 HydrophobicContact CD2-CD1 4.46Å; F242-L244 HydrophobicContact CD2-CD2 3.87Å; F242-L244 HydrophobicContact CD2-CG 3.94Å; F242-L244 HydrophobicContact CE2-CD1 3.96Å; F242-L244 HydrophobicContact CE2-CD2 3.97Å; F242-L244 HydrophobicContact CE2-CG 3.94Å
245	R	93.6	Very high	93.1	Very high	119 Å²	119	44 Å²	44	45%	0.449	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	132.3	170.3	-176	179	68.6	-173.7	-3.6	110.6	E176 F215 T216 T218	E176-R245 HydrophobicContact CG-CB 4Å; E176-R245 HydrophobicContact CG-CG 3.83Å; E176-R245 VanDerWaalsContact OE1-CD 3.28Å; E176-R245 WeakPolarHBondContact OE1-CD 3.38Å; F215-R245 CarbonylContact C-O 3.6Å; F215-R245 VanDerWaalsContact CA-O 3.28Å; F215-R245 WeakPolarHBondContact CA-O 3.43Å; T216-R245 PolarHBondContact N-O 2.89Å; T216-R245 PolarHBondContact O-N 2.99Å; T218-R245 HydrophobicContact CG2-CB 3.63Å
246	R	92.7	Very high	93	Very high	8 Å²	8	43.4 Å²	43.4	3%	0.03	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	138.8	-178.7	-169.2	-179.3	-61.2	-81.6	-3.6	113.3	E81 D175 F215 R248 Y251	E81-R246 IonicContact OE1-CZ 3.17Å; E81-R246 IonicContact OE1-NH1 2.71Å; E81-R246 PolarHBondContact OE1-NH1 3.35Å; E81-R246 IonicContact OE1-NH2 2.77Å; E81-R246 PolarHBondContact OE1-NH2 3.35Å; D175-R246 PolarHBondContact O-N 2.81Å; D175-R246 WeakPolarHBondContact OD1-CD 3.37Å; D175-R246 IonicContact OD1-CZ 3.4Å; D175-R246 IonicContact OD1-NE 3.76Å; D175-R246 PolarHBondContact OD1-NE 3.11Å; D175-R246 IonicContact OD1-NH2 3.74Å; D175-R246 IonicContact OD2-CZ 3.94Å; D175-R246 IonicContact OD2-NE 3.81Å; D175-R246 PolarHBondContact OD2-NE 3.41Å; D175-R246 VanDerWaalsContact OD2-NE 3.15Å; D175-R246 IonicContact OD2-NH2 3.72Å; D175-R246 PolarHBondContact OD2-NH2 2.91Å; F215-R246 HydrophobicContact CD1-CB 4.19Å; F215-R246 HydrophobicContact CE1-CB 4.1Å; F215-R246 HydrophobicContact CE1-CG 4.31Å; F215-R246 VanDerWaalsContact CZ-NH1 3.32Å; R246-R248 PolarHBondContact O-N 3.37Å; R246-Y251 HydrophobicContact CG-CE2 4.03Å; R246-Y251 PolarHBondContact NH1-OH 3.19Å
247	N	91.3	Very high	93.2	Very high	62 Å²	62	48.1 Å²	48.1	33%	0.332	24%	0.235	S	C	.	.			trans	-76.5	86.8	173.5	-76.2	-26.2	0	0	0	111.7	Q214 F215 T216 G249	Q214-N247 WeakPolarHBondContact O-CB 3.31Å; Q214-N247 PolarHBondContact O-N 2.85Å; F215-N247 PolarHBondContact O-ND2 2.86Å; T216-N247 PolarHBondContact OG1-OD1 3.01Å; N247-G249 PolarHBondContact O-N 3.37Å; N247-G249 VanDerWaalsContact O-N 3.07Å
248	R	89.8	Confident	93.1	Very high	120 Å²	120	48.9 Å²	48.9	45%	0.453	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.3	-16.4	-176.3	66.5	-177.6	-177.2	176.1	0	116.7	R246 V250 Y251 I252 T460	R246-R248 PolarHBondContact O-N 3.37Å; R248-V250 PolarHBondContact O-N 3.43Å; R248-Y251 PolarHBondContact O-N 3Å; R248-I252 HydrophobicContact CG-CD1 4.11Å; R248-I252 WeakPolarHBondContact O-CG1 3.29Å; R248-I252 PolarHBondContact O-N 2.9Å; R248-I252 VanDerWaalsContact O-N 3.13Å; R248-T460 VanDerWaalsContact NH1-CG2 3.34Å
249	G	89.1	Confident	93	Very high	40 Å²	40	48.9 Å²	48.9	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-59.7	-41.7	-171.4	0	0	0	0	0	114.9	N247 I252 I253	N247-G249 PolarHBondContact O-N 3.37Å; N247-G249 VanDerWaalsContact O-N 3.07Å; G249-I252 PolarHBondContact O-N 3.11Å; G249-I253 PolarHBondContact O-N 3.1Å
250	V	89.2	Confident	92.9	Very high	81 Å²	81	51.3 Å²	51.3	49%	0.491	26%	0.256	S	S	.	.	H	α-helix	trans	-64.1	-44.5	179.4	179.1	0	0	0	0	110.8	R248 I252 I253 Q254	R248-V250 PolarHBondContact O-N 3.43Å; V250-I252 VanDerWaalsContact C-N 3.35Å; V250-I252 PolarHBondContact O-N 2.94Å; V250-I253 PolarHBondContact O-N 2.71Å; V250-Q254 HydrophobicContact CG1-CG 4.17Å; V250-Q254 WeakPolarHBondContact O-CB 3.26Å; V250-Q254 WeakPolarHBondContact O-CG 3.3Å; V250-Q254 PolarHBondContact O-N 3.17Å
251	Y	90.7	Very high	92.9	Very high	36 Å²	36	56.6 Å²	56.6	14%	0.141	28%	0.283	C	S	.	.	H	α-helix	trans	-66.3	-34.4	179.5	-55.4	-81	0	0	0	112.8	Y172 P173 R246 R248 I253 S255 Y256	Y172-Y251 HydrophobicContact CE1-CE1 4.45Å; Y172-Y251 AromaticContact CZ-CE1 3.86Å; Y172-Y251 WeakPolarHBondContact OH-CE1 3.32Å; P173-Y251 HydrophobicContact CB-CD1 4.15Å; P173-Y251 HydrophobicContact CB-CD2 3.63Å; P173-Y251 HydrophobicContact CB-CE1 4.49Å; P173-Y251 HydrophobicContact CB-CE2 4Å; P173-Y251 HydrophobicContact CB-CG 3.69Å; P173-Y251 HydrophobicContact CG-CD1 4.42Å; P173-Y251 HydrophobicContact CG-CD2 4.1Å; P173-Y251 HydrophobicContact CG-CG 3.8Å; R246-Y251 HydrophobicContact CG-CE2 4.03Å; R246-Y251 PolarHBondContact NH1-OH 3.19Å; R248-Y251 PolarHBondContact O-N 3Å; Y251-I253 VanDerWaalsContact C-N 3.32Å; Y251-I253 PolarHBondContact O-N 2.88Å; Y251-S255 WeakPolarHBondContact O-CA 3.41Å; Y251-S255 WeakPolarHBondContact O-CB 3.49Å; Y251-S255 PolarHBondContact O-N 3.37Å; Y251-Y256 WeakPolarHBondContact O-CD2 3.43Å; Y251-Y256 PolarHBondContact O-N 2.77Å
252	I	92.1	Very high	92.8	Very high	47 Å²	47	55.8 Å²	55.8	24%	0.241	28%	0.282	C	S	.	.	I	π-helix	trans	-58.3	-46.4	173.1	-69.3	167.3	0	0	0	110.4	R248 G249 V250 Y256 M257 W456	R248-I252 HydrophobicContact CG-CD1 4.11Å; R248-I252 WeakPolarHBondContact O-CG1 3.29Å; R248-I252 PolarHBondContact O-N 2.9Å; R248-I252 VanDerWaalsContact O-N 3.13Å; G249-I252 PolarHBondContact O-N 3.11Å; V250-I252 VanDerWaalsContact C-N 3.35Å; V250-I252 PolarHBondContact O-N 2.94Å; I252-Y256 HydrophobicContact CG1-CD2 4.45Å; I252-Y256 PolarHBondContact O-N 2.71Å; I252-M257 HydrophobicContact CG2-CG 4.48Å; I252-M257 WeakPolarHBondContact O-CB 3.28Å; I252-M257 WeakPolarHBondContact O-CG 3.36Å; I252-M257 PolarHBondContact O-N 3.01Å; I252-W456 HydrophobicContact CD1-CH2 4.46Å; I252-W456 HydrophobicContact CG1-CH2 4.11Å
253	I	91.7	Very high	92.8	Very high	122 Å²	122	55.7 Å²	55.7	63%	0.626	28%	0.281	S	S	*	.	I	π-helix	trans	-75.4	-39.5	-178	-62.3	171.2	0	0	0	111.9	G249 V250 Y251 P258	G249-I253 PolarHBondContact O-N 3.1Å; V250-I253 PolarHBondContact O-N 2.71Å; Y251-I253 VanDerWaalsContact C-N 3.32Å; Y251-I253 PolarHBondContact O-N 2.88Å; I253-P258 VanDerWaalsContact O-CD 3.28Å; I253-P258 WeakPolarHBondContact O-CD 3.29Å
254	Q	89.8	Confident	92.8	Very high	127 Å²	127	54.3 Å²	54.3	59%	0.593	28%	0.28	S	S	*	.	I	π-helix	trans	-87.5	-24.2	-174	-68.4	-176.4	-5.8	0	0	114.8	V250	V250-Q254 HydrophobicContact CG1-CG 4.17Å; V250-Q254 WeakPolarHBondContact O-CB 3.26Å; V250-Q254 WeakPolarHBondContact O-CG 3.3Å; V250-Q254 PolarHBondContact O-N 3.17Å
255	S	91.7	Very high	92.6	Very high	13 Å²	13	59 Å²	59	9%	0.091	30%	0.304	C	S	.	.	I	π-helix	trans	-123.4	-51.3	-174.2	-54.7	0	0	0	0	113.4	Y251 S259	Y251-S255 WeakPolarHBondContact O-CA 3.41Å; Y251-S255 WeakPolarHBondContact O-CB 3.49Å; Y251-S255 PolarHBondContact O-N 3.37Å; S255-S259 WeakPolarHBondContact O-CB 3.42Å; S255-S259 PolarHBondContact O-N 3.04Å; S255-S259 PolarHBondContact O-OG 3.41Å
256	Y	93.4	Very high	92.6	Very high	3 Å²	3	53.7 Å²	53.7	1%	0.012	29%	0.285	C	S	.	.	I	π-helix	trans	-71	-50	-176.5	-69.9	-91.6	0	0	0	111.9	P173 M174 Y251 I252 S259 I260 L311 Y314 Y455 W456	P173-Y256 WeakPolarHBondContact CD-OH 3.21Å; P173-Y256 HydrophobicContact CG-CE2 4.13Å; M174-Y256 WeakPolarHBondContact CE-OH 3.37Å; Y251-Y256 WeakPolarHBondContact O-CD2 3.43Å; Y251-Y256 PolarHBondContact O-N 2.77Å; I252-Y256 HydrophobicContact CG1-CD2 4.45Å; I252-Y256 PolarHBondContact O-N 2.71Å; Y256-S259 WeakPolarHBondContact O-CB 3.41Å; Y256-S259 PolarHBondContact O-N 3.32Å; Y256-I260 WeakPolarHBondContact O-CG1 3.26Å; Y256-I260 PolarHBondContact O-N 2.97Å; Y256-L311 HydrophobicContact CD2-CD1 4.29Å; Y256-L311 HydrophobicContact CE1-CD1 4.28Å; Y256-L311 HydrophobicContact CE2-CD1 3.63Å; Y256-Y314 AromaticContact CD1-CD1 3.48Å; Y256-Y314 HydrophobicContact CD1-CD1 3.48Å; Y256-Y314 VanDerWaalsContact CD1-CD1 3.48Å; Y256-Y314 HydrophobicContact CD1-CD2 4.11Å; Y256-Y314 AromaticContact CD1-CE1 3.49Å; Y256-Y314 HydrophobicContact CD1-CE1 3.49Å; Y256-Y314 VanDerWaalsContact CD1-CE1 3.49Å; Y256-Y314 HydrophobicContact CD1-CE2 4.12Å; Y256-Y314 AromaticContact CD1-CG 3.8Å; Y256-Y314 HydrophobicContact CD1-CG 3.8Å; Y256-Y314 AromaticContact CD1-CZ 3.83Å; Y256-Y314 AromaticContact CE1-CD1 3.67Å; Y256-Y314 HydrophobicContact CE1-CD1 3.67Å; Y256-Y314 AromaticContact CE1-CD2 3.9Å; Y256-Y314 HydrophobicContact CE1-CD2 3.9Å; Y256-Y314 HydrophobicContact CE1-CE1 4.13Å; Y256-Y314 HydrophobicContact CE1-CE2 4.34Å; Y256-Y314 AromaticContact CE1-CG 3.54Å; Y256-Y314 HydrophobicContact CE1-CG 3.54Å; Y256-Y314 HydrophobicContact CG-CD1 4.46Å; Y256-Y314 HydrophobicContact CG-CE1 4.36Å; Y256-Y455 AromaticContact CE1-CE1 3.77Å; Y256-Y455 HydrophobicContact CE1-CE1 3.77Å; Y256-Y455 PolarHBondContact OH-OH 3.2Å; Y256-W456 HydrophobicContact CD1-CH2 4.01Å; Y256-W456 AromaticContact CD1-CZ2 3.63Å; Y256-W456 HydrophobicContact CD1-CZ2 3.63Å; Y256-W456 HydrophobicContact CD2-CH2 4.39Å; Y256-W456 HydrophobicContact CE1-CH2 4.09Å; Y256-W456 AromaticContact CE1-CZ2 4Å; Y256-W456 HydrophobicContact CE1-CZ2 4Å; Y256-W456 HydrophobicContact CE2-CH2 4.45Å; Y256-W456 HydrophobicContact CG-CH2 4.18Å; Y256-W456 HydrophobicContact CG-CZ2 4.04Å
257	M	94.4	Very high	92.6	Very high	102 Å²	102	55.7 Å²	55.7	50%	0.502	29%	0.292	S	S	.	.	H	α-helix	trans	-59.3	-48.6	-179.4	-76.8	-68.3	177.6	0	0	113.1	I252 S259 I260 L261	I252-M257 HydrophobicContact CG2-CG 4.48Å; I252-M257 WeakPolarHBondContact O-CB 3.28Å; I252-M257 WeakPolarHBondContact O-CG 3.36Å; I252-M257 PolarHBondContact O-N 3.01Å; M257-S259 VanDerWaalsContact C-N 3.31Å; M257-S259 PolarHBondContact O-N 3.43Å; M257-I260 PolarHBondContact O-N 3.38Å; M257-L261 WeakPolarHBondContact O-CG 3.45Å; M257-L261 PolarHBondContact O-N 2.98Å
258	P	94.9	Very high	92.6	Very high	44 Å²	44	56.3 Å²	56.3	29%	0.286	30%	0.298	S	S	.	.	H	α-helix	trans	-59.6	-38.3	174.2	-27.7	37.4	0	0	0	113.1	I253 L261 L262 L294	I253-P258 VanDerWaalsContact O-CD 3.28Å; I253-P258 WeakPolarHBondContact O-CD 3.29Å; P258-L261 PolarHBondContact O-N 3.48Å; P258-L262 VanDerWaalsContact O-CG 3.31Å; P258-L262 WeakPolarHBondContact O-CG 3.49Å; P258-L262 PolarHBondContact O-N 3.03Å; P258-L294 HydrophobicContact CB-CD2 4.07Å
259	S	95.3	Very high	92.5	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-44.2	177.3	-57.9	0	0	0	0	112.2	S255 Y256 M257 L261 L262 V263 L294 F315	S255-S259 WeakPolarHBondContact O-CB 3.42Å; S255-S259 PolarHBondContact O-N 3.04Å; S255-S259 PolarHBondContact O-OG 3.41Å; Y256-S259 WeakPolarHBondContact O-CB 3.41Å; Y256-S259 PolarHBondContact O-N 3.32Å; M257-S259 VanDerWaalsContact C-N 3.31Å; M257-S259 PolarHBondContact O-N 3.43Å; S259-L261 VanDerWaalsContact C-N 3.32Å; S259-L261 PolarHBondContact O-N 3.35Å; S259-L262 PolarHBondContact O-N 3.39Å; S259-V263 WeakPolarHBondContact O-CG2 3.44Å; S259-V263 PolarHBondContact O-N 3.23Å; S259-L294 WeakPolarHBondContact OG-CD2 3.21Å; S259-F315 WeakPolarHBondContact OG-CE1 3.41Å
260	I	95.1	Very high	92.6	Very high	52 Å²	52	49.1 Å²	49.1	27%	0.267	26%	0.26	S	S	.	.	H	α-helix	trans	-60.7	-43.7	175.3	-67.5	165.2	0	0	0	110.5	Y256 M257 V263 A264 Y314 F448	Y256-I260 WeakPolarHBondContact O-CG1 3.26Å; Y256-I260 PolarHBondContact O-N 2.97Å; M257-I260 PolarHBondContact O-N 3.38Å; I260-V263 PolarHBondContact O-N 2.95Å; I260-A264 WeakPolarHBondContact O-CB 3.21Å; I260-A264 PolarHBondContact O-N 3.49Å; I260-Y314 WeakPolarHBondContact CD1-OH 3.35Å; I260-Y314 WeakPolarHBondContact CG1-OH 3.41Å; I260-F448 HydrophobicContact CG1-CE1 4.34Å; I260-F448 HydrophobicContact CG1-CZ 4.25Å; I260-F448 HydrophobicContact CG2-CE1 4.31Å
261	L	94.6	Very high	92.5	Very high	110 Å²	110	54.2 Å²	54.2	58%	0.576	27%	0.27	S	S	*	.	H	α-helix	trans	-66.4	-37.7	177.9	-67.3	172.3	0	0	0	112.3	M257 P258 S259 A264 M265	M257-L261 WeakPolarHBondContact O-CG 3.45Å; M257-L261 PolarHBondContact O-N 2.98Å; P258-L261 PolarHBondContact O-N 3.48Å; S259-L261 VanDerWaalsContact C-N 3.32Å; S259-L261 PolarHBondContact O-N 3.35Å; L261-A264 PolarHBondContact O-N 3.28Å; L261-M265 WeakPolarHBondContact O-CB 3.3Å; L261-M265 WeakPolarHBondContact O-CG 3.39Å; L261-M265 PolarHBondContact O-N 2.91Å
262	L	94.7	Very high	92.4	Very high	18 Å²	18	54.5 Å²	54.5	9%	0.094	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-43.6	173.2	-73.7	178.6	0	0	0	111.8	P258 S259 M265 S266 T290 M291 L294	P258-L262 VanDerWaalsContact O-CG 3.31Å; P258-L262 WeakPolarHBondContact O-CG 3.49Å; P258-L262 PolarHBondContact O-N 3.03Å; S259-L262 PolarHBondContact O-N 3.39Å; L262-M265 HydrophobicContact CD2-CE 3.67Å; L262-M265 PolarHBondContact O-N 2.61Å; L262-S266 PolarHBondContact O-N 2.86Å; L262-S266 VanDerWaalsContact O-N 3.1Å; L262-T290 VanDerWaalsContact CD2-OG1 3.26Å; L262-T290 WeakPolarHBondContact CD2-OG1 3.48Å; L262-M291 HydrophobicContact CD1-CB 4.27Å; L262-M291 HydrophobicContact CD1-SD 3.96Å; L262-L294 HydrophobicContact CD1-CD2 4.13Å
263	V	95.8	Very high	92	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-61.8	-46.6	174.1	174.8	0	0	0	0	110.4	S259 I260 M265 S266 W267 C318 F321 V322 F448	S259-V263 WeakPolarHBondContact O-CG2 3.44Å; S259-V263 PolarHBondContact O-N 3.23Å; I260-V263 PolarHBondContact O-N 2.95Å; V263-M265 VanDerWaalsContact C-N 3.35Å; V263-M265 PolarHBondContact O-N 2.96Å; V263-S266 WeakPolarHBondContact O-CB 3.38Å; V263-S266 PolarHBondContact O-N 3.05Å; V263-S266 VanDerWaalsContact O-N 3.11Å; V263-S266 PolarHBondContact O-OG 2.94Å; V263-W267 HydrophobicContact CG1-CZ2 3.7Å; V263-W267 PolarHBondContact O-NE1 3.42Å; V263-C318 HydrophobicContact CG2-CB 3.66Å; V263-F321 HydrophobicContact CG1-CB 4.08Å; V263-V322 HydrophobicContact CG2-CG2 3.98Å; V263-F448 HydrophobicContact CB-CE1 4.44Å; V263-F448 HydrophobicContact CB-CE2 4.3Å; V263-F448 HydrophobicContact CB-CZ 4.09Å; V263-F448 HydrophobicContact CG1-CD1 4.21Å; V263-F448 HydrophobicContact CG1-CD2 3.97Å; V263-F448 HydrophobicContact CG1-CE1 4.17Å; V263-F448 HydrophobicContact CG1-CE2 3.93Å; V263-F448 HydrophobicContact CG1-CG 4.11Å; V263-F448 HydrophobicContact CG1-CZ 4.03Å; V263-F448 HydrophobicContact CG2-CE2 4Å; V263-F448 HydrophobicContact CG2-CZ 4.07Å
264	A	93.7	Very high	91.4	Very high	35 Å²	35	51 Å²	51	29%	0.289	26%	0.261	S	S	.	.	H	α-helix	trans	-62.3	-38.2	177.3	0	0	0	0	0	112.9	I260 L261 S266 W267	I260-A264 WeakPolarHBondContact O-CB 3.21Å; I260-A264 PolarHBondContact O-N 3.49Å; L261-A264 PolarHBondContact O-N 3.28Å; A264-S266 VanDerWaalsContact C-N 3.3Å; A264-S266 PolarHBondContact O-N 3.02Å; A264-W267 HydrophobicContact CB-CE3 4.23Å; A264-W267 HydrophobicContact CB-CZ3 4.26Å; A264-W267 WeakPolarHBondContact O-CB 3.39Å; A264-W267 PolarHBondContact O-N 3.3Å
265	M	92	Very high	90.9	Very high	101 Å²	101	50 Å²	50	50%	0.498	27%	0.268	S	S	.	.	H	α-helix	trans	-64.4	-32.1	173.8	-77.2	-161.2	-62.5	0	0	112.7	L261 L262 V263 W267 V268 T287	L261-M265 WeakPolarHBondContact O-CB 3.3Å; L261-M265 WeakPolarHBondContact O-CG 3.39Å; L261-M265 PolarHBondContact O-N 2.91Å; L262-M265 HydrophobicContact CD2-CE 3.67Å; L262-M265 PolarHBondContact O-N 2.61Å; V263-M265 VanDerWaalsContact C-N 3.35Å; V263-M265 PolarHBondContact O-N 2.96Å; M265-W267 PolarHBondContact O-N 2.85Å; M265-V268 WeakPolarHBondContact O-CB 3.35Å; M265-V268 WeakPolarHBondContact O-CG2 3.11Å; M265-V268 PolarHBondContact O-N 3.26Å; M265-T287 HydrophobicContact CB-CG2 4.36Å
266	S	93.6	Very high	90.8	Very high	6 Å²	6	50.8 Å²	50.8	4%	0.042	28%	0.276	C	S	.	.	H	α-helix	trans	-61.2	-32.7	174.2	79.9	0	0	0	0	112.3	L262 V263 A264 V268 S269	L262-S266 PolarHBondContact O-N 2.86Å; L262-S266 VanDerWaalsContact O-N 3.1Å; V263-S266 WeakPolarHBondContact O-CB 3.38Å; V263-S266 PolarHBondContact O-N 3.05Å; V263-S266 VanDerWaalsContact O-N 3.11Å; V263-S266 PolarHBondContact O-OG 2.94Å; A264-S266 VanDerWaalsContact C-N 3.3Å; A264-S266 PolarHBondContact O-N 3.02Å; S266-V268 VanDerWaalsContact C-N 3.27Å; S266-V268 PolarHBondContact O-N 3.29Å; S266-S269 WeakPolarHBondContact O-CB 3.12Å; S266-S269 PolarHBondContact O-N 2.94Å; S266-S269 PolarHBondContact O-OG 2.98Å
267	W	92.3	Very high	90.5	Very high	51 Å²	51	53.1 Å²	53.1	19%	0.193	29%	0.291	C	S	.	.	H	α-helix	trans	-72	-17.6	179.2	-50.2	-21.4	0	0	0	113.8	V263 A264 M265 S269 F270 P445 F448	V263-W267 HydrophobicContact CG1-CZ2 3.7Å; V263-W267 PolarHBondContact O-NE1 3.42Å; A264-W267 HydrophobicContact CB-CE3 4.23Å; A264-W267 HydrophobicContact CB-CZ3 4.26Å; A264-W267 WeakPolarHBondContact O-CB 3.39Å; A264-W267 PolarHBondContact O-N 3.3Å; M265-W267 PolarHBondContact O-N 2.85Å; W267-S269 PolarHBondContact O-N 2.83Å; W267-F270 HydrophobicContact CB-CD2 3.9Å; W267-F270 HydrophobicContact CB-CE2 3.93Å; W267-F270 AromaticContact CD1-CE2 3.74Å; W267-F270 HydrophobicContact CG-CD2 4.49Å; W267-F270 HydrophobicContact CG-CE2 4.06Å; W267-F270 WeakPolarHBondContact O-CB 3.39Å; W267-F270 WeakPolarHBondContact O-CD2 3.28Å; W267-F270 PolarHBondContact O-N 2.93Å; W267-F270 VanDerWaalsContact O-N 3.1Å; W267-P445 HydrophobicContact CD2-CG 4.02Å; W267-P445 HydrophobicContact CE3-CB 4.26Å; W267-P445 HydrophobicContact CE3-CG 3.74Å; W267-P445 HydrophobicContact CH2-CB 3.75Å; W267-P445 HydrophobicContact CH2-CG 4.07Å; W267-P445 HydrophobicContact CZ2-CB 4.27Å; W267-P445 HydrophobicContact CZ2-CG 4.31Å; W267-P445 HydrophobicContact CZ3-CB 3.75Å; W267-P445 HydrophobicContact CZ3-CG 3.77Å; W267-F448 HydrophobicContact CH2-CD1 4.02Å; W267-F448 HydrophobicContact CZ2-CB 3.96Å; W267-F448 AromaticContact CZ2-CD1 3.93Å; W267-F448 HydrophobicContact CZ2-CD1 3.93Å; W267-F448 HydrophobicContact CZ2-CG 4.11Å
268	V	90.5	Very high	90.3	Very high	74 Å²	74	52.9 Å²	52.9	45%	0.448	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-60.4	-28.6	173.7	-179.7	0	0	0	0	110.6	M265 S266 F270 W271 I272	M265-V268 WeakPolarHBondContact O-CB 3.35Å; M265-V268 WeakPolarHBondContact O-CG2 3.11Å; M265-V268 PolarHBondContact O-N 3.26Å; S266-V268 VanDerWaalsContact C-N 3.27Å; S266-V268 PolarHBondContact O-N 3.29Å; V268-F270 VanDerWaalsContact C-N 3.26Å; V268-F270 PolarHBondContact O-N 3.36Å; V268-W271 PolarHBondContact O-N 3.02Å; V268-W271 VanDerWaalsContact O-N 3.09Å; V268-I272 HydrophobicContact CG1-CD1 4.42Å
269	S	88.9	Confident	90.1	Very high	9 Å²	9	52.8 Å²	52.8	6%	0.063	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-57.6	-35.7	174.8	69.1	0	0	0	0	113.1	S266 W267 W271 I272 R280	S266-S269 WeakPolarHBondContact O-CB 3.12Å; S266-S269 PolarHBondContact O-N 2.94Å; S266-S269 PolarHBondContact O-OG 2.98Å; W267-S269 PolarHBondContact O-N 2.83Å; S269-W271 PolarHBondContact O-N 3.17Å; S269-I272 PolarHBondContact O-N 3.3Å; S269-I272 VanDerWaalsContact O-N 3.12Å; S269-R280 PolarHBondContact O-NE 3.5Å; S269-R280 PolarHBondContact O-NH1 2.96Å
270	F	89.3	Confident	89.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-68.5	-13.6	178.9	-47.9	-39.8	0	0	0	113.9	W267 V268 A325 E328 D437 A440 R441 F444	W267-F270 HydrophobicContact CB-CD2 3.9Å; W267-F270 HydrophobicContact CB-CE2 3.93Å; W267-F270 AromaticContact CD1-CE2 3.74Å; W267-F270 HydrophobicContact CG-CD2 4.49Å; W267-F270 HydrophobicContact CG-CE2 4.06Å; W267-F270 WeakPolarHBondContact O-CB 3.39Å; W267-F270 WeakPolarHBondContact O-CD2 3.28Å; W267-F270 PolarHBondContact O-N 2.93Å; W267-F270 VanDerWaalsContact O-N 3.1Å; V268-F270 VanDerWaalsContact C-N 3.26Å; V268-F270 PolarHBondContact O-N 3.36Å; F270-A325 HydrophobicContact CE1-CB 4.09Å; F270-A325 HydrophobicContact CZ-CB 3.83Å; F270-E328 HydrophobicContact CD1-CG 4.34Å; F270-E328 WeakPolarHBondContact CD1-OE2 3.48Å; F270-E328 HydrophobicContact CE1-CB 4.15Å; F270-E328 HydrophobicContact CE1-CG 3.82Å; F270-E328 WeakPolarHBondContact CE1-OE2 3.35Å; F270-D437 WeakPolarHBondContact CA-OD1 3.44Å; F270-A440 HydrophobicContact CD1-CB 3.9Å; F270-A440 HydrophobicContact CD2-CB 4.04Å; F270-A440 HydrophobicContact CE1-CB 3.96Å; F270-A440 HydrophobicContact CE2-CB 4.08Å; F270-A440 HydrophobicContact CG-CB 3.97Å; F270-A440 HydrophobicContact CZ-CB 4.04Å; F270-R441 HydrophobicContact CB-CG 3.87Å; F270-R441 VanDerWaalsContact O-CZ 3.27Å; F270-R441 PolarHBondContact O-NE 3.13Å; F270-R441 PolarHBondContact O-NH2 3.18Å; F270-F444 HydrophobicContact CE2-CB 3.99Å; F270-F444 HydrophobicContact CE2-CD1 4.27Å; F270-F444 HydrophobicContact CE2-CD2 4.01Å; F270-F444 AromaticContact CE2-CG 3.85Å; F270-F444 HydrophobicContact CE2-CG 3.85Å; F270-F444 HydrophobicContact CZ-CB 4.49Å; F270-F444 AromaticContact CZ-CD1 3.97Å; F270-F444 HydrophobicContact CZ-CD1 3.97Å; F270-F444 AromaticContact CZ-CD2 3.83Å; F270-F444 HydrophobicContact CZ-CD2 3.83Å; F270-F444 HydrophobicContact CZ-CE1 4.06Å; F270-F444 AromaticContact CZ-CE2 3.92Å; F270-F444 HydrophobicContact CZ-CE2 3.92Å; F270-F444 AromaticContact CZ-CG 3.86Å; F270-F444 HydrophobicContact CZ-CG 3.86Å; F270-F444 HydrophobicContact CZ-CZ 4.04Å
271	W	88.2	Confident	89.6	Confident	188 Å²	188	52.8 Å²	52.8	71%	0.712	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-96.8	-14.6	176.2	-68.3	87.1	0	0	0	112.7	V268 S269	V268-W271 PolarHBondContact O-N 3.02Å; V268-W271 VanDerWaalsContact O-N 3.09Å; S269-W271 PolarHBondContact O-N 3.17Å
272	I	88.3	Confident	89.5	Confident	42 Å²	42	51.5 Å²	51.5	22%	0.215	30%	0.299	C	S	.	.	S	Bend	trans	-85.7	132.6	179.8	-64.9	170.5	0	0	0	109.4	V268 S269 A276 A279 R280 L283	V268-I272 HydrophobicContact CG1-CD1 4.42Å; S269-I272 PolarHBondContact O-N 3.3Å; S269-I272 VanDerWaalsContact O-N 3.12Å; I272-A276 HydrophobicContact CG2-CB 3.77Å; I272-A279 HydrophobicContact CG2-CB 4.48Å; I272-R280 HydrophobicContact CB-CG 3.91Å; I272-R280 HydrophobicContact CG2-CG 3.77Å; I272-R280 PolarHBondContact O-NH1 3.32Å; I272-L283 HydrophobicContact CD1-CD1 3.39Å
273	S	84.3	Confident	89.4	Confident	71 Å²	71	54 Å²	54	50%	0.497	31%	0.312	S	S	.	.			trans	-59.1	140.3	178.5	60.8	0	0	0	0	111.6	S275 A276	S273-S275 PolarHBondContact O-N 2.96Å; S273-S275 VanDerWaalsContact O-N 3.08Å; S273-S275 PolarHBondContact OG-OG 2.87Å; S273-S275 VanDerWaalsContact OG-OG 3.07Å; S273-A276 WeakPolarHBondContact O-CB 3.47Å; S273-A276 PolarHBondContact O-N 2.95Å
274	Q	79.1	Confident	89.2	Confident	24 Å²	24	54.5 Å²	54.5	11%	0.112	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-18.3	-176.6	-64.6	170.7	6.4	0	0	113.6	A276 A433 D437	Q274-A276 PolarHBondContact O-N 3.11Å; Q274-A433 PolarHBondContact NE2-O 3.35Å; Q274-D437 PolarHBondContact NE2-OD2 3.12Å
275	S	79.7	Confident	89.1	Confident	106 Å²	106	57.4 Å²	57.4	74%	0.741	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-24.4	170.3	52.1	0	0	0	0	113.6	S273 V277	S273-S275 PolarHBondContact O-N 2.96Å; S273-S275 VanDerWaalsContact O-N 3.08Å; S273-S275 PolarHBondContact OG-OG 2.87Å; S273-S275 VanDerWaalsContact OG-OG 3.07Å; S275-V277 PolarHBondContact O-N 2.71Å; S275-V277 VanDerWaalsContact O-N 3.08Å
276	A	88.3	Confident	89.2	Confident	31 Å²	31	56 Å²	56	26%	0.256	32%	0.323	S	S	.	.			trans	-87	52.4	179.1	0	0	0	0	0	112.1	I272 S273 Q274 P278 A279 R280	I272-A276 HydrophobicContact CG2-CB 3.77Å; S273-A276 WeakPolarHBondContact O-CB 3.47Å; S273-A276 PolarHBondContact O-N 2.95Å; Q274-A276 PolarHBondContact O-N 3.11Å; A276-P278 VanDerWaalsContact C-CD 3.46Å; A276-A279 HydrophobicContact CB-CB 4.28Å; A276-A279 WeakPolarHBondContact O-CB 3.27Å; A276-A279 PolarHBondContact O-N 3.4Å; A276-R280 PolarHBondContact O-N 3.23Å
277	V	87.6	Confident	89.3	Confident	51 Å²	51	56.1 Å²	56.1	31%	0.309	32%	0.324	S	S	.	.	H	α-helix	trans	-45.2	-49.4	-179.2	170.7	0	0	0	0	113.5	S275 A279 R280 V281 Y329	S275-V277 PolarHBondContact O-N 2.71Å; S275-V277 VanDerWaalsContact O-N 3.08Å; V277-A279 VanDerWaalsContact C-N 3.28Å; V277-A279 PolarHBondContact O-N 3.29Å; V277-R280 PolarHBondContact O-N 2.86Å; V277-V281 HydrophobicContact CG1-CG2 4.32Å; V277-V281 WeakPolarHBondContact O-CG2 3.07Å; V277-V281 PolarHBondContact O-N 3.09Å; V277-V281 VanDerWaalsContact O-N 3.11Å; V277-Y329 WeakPolarHBondContact CA-OH 3.41Å; V277-Y329 WeakPolarHBondContact CG1-OH 3.36Å
278	P	90.1	Very high	89.4	Confident	97 Å²	97	54.8 Å²	54.8	63%	0.63	32%	0.321	S	S	*	.	H	α-helix	trans	-63.3	-33.1	-178	-21.7	34.8	0	0	0	113.2	A276 T282	A276-P278 VanDerWaalsContact C-CD 3.46Å; P278-T282 VanDerWaalsContact O-CB 3.26Å; P278-T282 WeakPolarHBondContact O-CB 3.29Å; P278-T282 PolarHBondContact O-N 3.31Å; P278-T282 VanDerWaalsContact O-N 3.09Å; P278-T282 PolarHBondContact O-OG1 3.2Å
279	A	89.9	Confident	89.6	Confident	43 Å²	43	56.4 Å²	56.4	36%	0.355	33%	0.327	S	S	.	.	H	α-helix	trans	-71.7	-49.3	-178.9	0	0	0	0	0	111.5	I272 A276 V277 T282 L283	I272-A279 HydrophobicContact CG2-CB 4.48Å; A276-A279 HydrophobicContact CB-CB 4.28Å; A276-A279 WeakPolarHBondContact O-CB 3.27Å; A276-A279 PolarHBondContact O-N 3.4Å; V277-A279 VanDerWaalsContact C-N 3.28Å; V277-A279 PolarHBondContact O-N 3.29Å; A279-T282 PolarHBondContact O-N 3.28Å; A279-L283 WeakPolarHBondContact O-CB 3.43Å; A279-L283 VanDerWaalsContact O-CG 3.32Å; A279-L283 WeakPolarHBondContact O-CG 3.47Å; A279-L283 PolarHBondContact O-N 3.29Å
280	R	90.4	Very high	89.8	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-64.5	-42.7	179.3	-72.4	-177.5	74.9	156.6	-7	112.1	S269 I272 A276 V277 G284 E328 Y329 D437	S269-R280 PolarHBondContact O-NE 3.5Å; S269-R280 PolarHBondContact O-NH1 2.96Å; I272-R280 HydrophobicContact CB-CG 3.91Å; I272-R280 HydrophobicContact CG2-CG 3.77Å; I272-R280 PolarHBondContact O-NH1 3.32Å; A276-R280 PolarHBondContact O-N 3.23Å; V277-R280 PolarHBondContact O-N 2.86Å; R280-G284 PolarHBondContact O-N 2.93Å; R280-E328 IonicContact NH2-OE1 3.94Å; R280-E328 IonicContact NH2-OE2 3.13Å; R280-E328 PolarHBondContact NH2-OE2 2.73Å; R280-Y329 HydrophobicContact CB-CD1 4.38Å; R280-Y329 HydrophobicContact CB-CD2 3.74Å; R280-Y329 HydrophobicContact CB-CE1 4.35Å; R280-Y329 HydrophobicContact CB-CE2 3.67Å; R280-Y329 HydrophobicContact CB-CG 4.08Å; R280-Y329 HydrophobicContact CG-CD2 4.24Å; R280-Y329 HydrophobicContact CG-CE2 4.28Å; R280-D437 IonicContact CZ-OD1 3.81Å; R280-D437 VanDerWaalsContact CZ-OD1 3.31Å; R280-D437 IonicContact CZ-OD2 3.64Å; R280-D437 VanDerWaalsContact NH1-CG 3.34Å; R280-D437 IonicContact NH1-OD1 3.35Å; R280-D437 PolarHBondContact NH1-OD1 3.36Å; R280-D437 IonicContact NH1-OD2 2.74Å; R280-D437 PolarHBondContact NH1-OD2 3.11Å; R280-D437 IonicContact NH2-OD1 2.81Å; R280-D437 PolarHBondContact NH2-OD1 3.08Å; R280-D437 IonicContact NH2-OD2 2.68Å
281	V	90.8	Very high	90	Very high	50 Å²	50	58.6 Å²	58.6	30%	0.303	34%	0.34	S	S	.	.	H	α-helix	trans	-61	-48.5	175.9	174	0	0	0	0	111.3	V277 G284 I285 Y329	V277-V281 HydrophobicContact CG1-CG2 4.32Å; V277-V281 WeakPolarHBondContact O-CG2 3.07Å; V277-V281 PolarHBondContact O-N 3.09Å; V277-V281 VanDerWaalsContact O-N 3.11Å; V281-G284 PolarHBondContact O-N 3.23Å; V281-I285 HydrophobicContact CG1-CD1 3.64Å; V281-I285 HydrophobicContact CG1-CG1 4.38Å; V281-I285 WeakPolarHBondContact O-CG1 3.5Å; V281-I285 PolarHBondContact O-N 2.67Å; V281-Y329 HydrophobicContact CG2-CD1 4.42Å; V281-Y329 HydrophobicContact CG2-CE1 3.46Å; V281-Y329 VanDerWaalsContact CG2-CE1 3.46Å
282	T	92.4	Very high	90.3	Very high	82 Å²	82	52.1 Å²	52.1	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-63	-48.4	-178.1	-55.3	0	0	0	0	110.8	P278 A279 G284 I285 T286	P278-T282 VanDerWaalsContact O-CB 3.26Å; P278-T282 WeakPolarHBondContact O-CB 3.29Å; P278-T282 PolarHBondContact O-N 3.31Å; P278-T282 VanDerWaalsContact O-N 3.09Å; P278-T282 PolarHBondContact O-OG1 3.2Å; A279-T282 PolarHBondContact O-N 3.28Å; T282-G284 VanDerWaalsContact C-N 3.35Å; T282-G284 PolarHBondContact O-N 2.74Å; T282-I285 PolarHBondContact O-N 3.18Å; T282-T286 VanDerWaalsContact O-CB 3.25Å; T282-T286 WeakPolarHBondContact O-CB 3.38Å; T282-T286 PolarHBondContact O-N 3.24Å; T282-T286 PolarHBondContact O-OG1 3.39Å
283	L	91.6	Very high	90.5	Very high	71 Å²	71	54.2 Å²	54.2	37%	0.372	34%	0.336	S	S	.	.	H	α-helix	trans	-58.9	-43.6	177.6	-72.2	168.8	0	0	0	112.4	I272 A279 T287	I272-L283 HydrophobicContact CD1-CD1 3.39Å; A279-L283 WeakPolarHBondContact O-CB 3.43Å; A279-L283 VanDerWaalsContact O-CG 3.32Å; A279-L283 WeakPolarHBondContact O-CG 3.47Å; A279-L283 PolarHBondContact O-N 3.29Å; L283-T287 WeakPolarHBondContact O-CB 3.31Å; L283-T287 VanDerWaalsContact O-CG2 3.32Å; L283-T287 WeakPolarHBondContact O-CG2 3.2Å; L283-T287 PolarHBondContact O-N 2.7Å; L283-T287 PolarHBondContact O-OG1 2.92Å
284	G	91.6	Very high	90.8	Very high	10 Å²	10	52.4 Å²	52.4	10%	0.103	32%	0.321	C	S	.	.	H	α-helix	trans	-65.7	-46.2	178.4	0	0	0	0	0	113.3	R280 V281 T282 T287 V288	R280-G284 PolarHBondContact O-N 2.93Å; V281-G284 PolarHBondContact O-N 3.23Å; T282-G284 VanDerWaalsContact C-N 3.35Å; T282-G284 PolarHBondContact O-N 2.74Å; G284-T287 PolarHBondContact O-OG1 2.88Å; G284-T287 VanDerWaalsContact O-OG1 3.04Å; G284-V288 WeakPolarHBondContact O-CG2 3.41Å; G284-V288 PolarHBondContact O-N 2.88Å; G284-V288 VanDerWaalsContact O-N 3.17Å
285	I	92.8	Very high	91.3	Very high	97 Å²	97	52.2 Å²	52.2	50%	0.497	32%	0.32	S	S	.	.	H	α-helix	trans	-67.8	-43.6	178.5	-65.6	174.8	0	0	0	110.9	V281 T282 T287 V288 L289	V281-I285 HydrophobicContact CG1-CD1 3.64Å; V281-I285 HydrophobicContact CG1-CG1 4.38Å; V281-I285 WeakPolarHBondContact O-CG1 3.5Å; V281-I285 PolarHBondContact O-N 2.67Å; T282-I285 PolarHBondContact O-N 3.18Å; I285-T287 PolarHBondContact O-N 2.88Å; I285-V288 PolarHBondContact O-N 3.15Å; I285-L289 WeakPolarHBondContact O-CB 3.38Å; I285-L289 PolarHBondContact O-N 2.98Å
286	T	94.4	Very high	91.8	Very high	70 Å²	70	51.7 Å²	51.7	43%	0.429	31%	0.312	S	S	.	.	H	α-helix	trans	-63.7	-40.7	178.3	-62	0	0	0	0	111.6	T282 L289 T290	T282-T286 VanDerWaalsContact O-CB 3.25Å; T282-T286 WeakPolarHBondContact O-CB 3.38Å; T282-T286 PolarHBondContact O-N 3.24Å; T282-T286 PolarHBondContact O-OG1 3.39Å; T286-L289 PolarHBondContact O-N 2.93Å; T286-T290 HydrophobicContact CG2-CG2 4.39Å; T286-T290 WeakPolarHBondContact O-CG2 3.28Å; T286-T290 PolarHBondContact O-N 3.44Å; T286-T290 PolarHBondContact O-OG1 3.46Å; T286-T290 VanDerWaalsContact O-OG1 3.05Å
287	T	94	Very high	91.7	Very high	10 Å²	10	53.7 Å²	53.7	6%	0.061	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-40.4	177.5	46.5	0	0	0	0	112.8	M265 L283 G284 I285 T290 M291	M265-T287 HydrophobicContact CB-CG2 4.36Å; L283-T287 WeakPolarHBondContact O-CB 3.31Å; L283-T287 VanDerWaalsContact O-CG2 3.32Å; L283-T287 WeakPolarHBondContact O-CG2 3.2Å; L283-T287 PolarHBondContact O-N 2.7Å; L283-T287 PolarHBondContact O-OG1 2.92Å; G284-T287 PolarHBondContact O-OG1 2.88Å; G284-T287 VanDerWaalsContact O-OG1 3.04Å; I285-T287 PolarHBondContact O-N 2.88Å; T287-T290 WeakPolarHBondContact CA-OG1 3.3Å; T287-T290 PolarHBondContact O-N 3.38Å; T287-T290 PolarHBondContact O-OG1 3.21Å; T287-M291 VanDerWaalsContact O-CB 3.31Å; T287-M291 WeakPolarHBondContact O-CB 3.42Å; T287-M291 PolarHBondContact O-N 3.34Å
288	V	94.5	Very high	91.5	Very high	22 Å²	22	52 Å²	52	13%	0.133	32%	0.316	C	S	.	.	H	α-helix	trans	-60.9	-44.1	171.5	173.5	0	0	0	0	111.1	G284 I285 M291 T292 Y319 V322 L326	G284-V288 WeakPolarHBondContact O-CG2 3.41Å; G284-V288 PolarHBondContact O-N 2.88Å; G284-V288 VanDerWaalsContact O-N 3.17Å; I285-V288 PolarHBondContact O-N 3.15Å; V288-M291 PolarHBondContact O-N 2.77Å; V288-T292 WeakPolarHBondContact O-CB 3.4Å; V288-T292 PolarHBondContact O-N 2.9Å; V288-T292 PolarHBondContact O-OG1 3.13Å; V288-Y319 HydrophobicContact CG1-CE2 3.96Å; V288-V322 HydrophobicContact CG2-CG1 3.74Å; V288-L326 HydrophobicContact CG2-CD2 4.48Å
289	L	94.7	Very high	91.1	Very high	108 Å²	108	52.6 Å²	52.6	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-63.4	-47.7	178.4	179.5	61	0	0	0	111.6	I285 T286 M291 T292 T293	I285-L289 WeakPolarHBondContact O-CB 3.38Å; I285-L289 PolarHBondContact O-N 2.98Å; T286-L289 PolarHBondContact O-N 2.93Å; L289-M291 VanDerWaalsContact C-N 3.31Å; L289-M291 PolarHBondContact O-N 2.89Å; L289-T292 WeakPolarHBondContact O-CB 3.29Å; L289-T292 PolarHBondContact O-N 2.68Å; L289-T293 PolarHBondContact O-N 2.74Å; L289-T293 PolarHBondContact O-OG1 2.81Å
290	T	94.8	Very high	90.6	Very high	55 Å²	55	55.3 Å²	55.3	34%	0.337	32%	0.322	S	S	.	.	H	α-helix	trans	-63.5	-36.9	177.7	49	0	0	0	0	112.5	L262 T286 T287 T293 L294	L262-T290 VanDerWaalsContact CD2-OG1 3.26Å; L262-T290 WeakPolarHBondContact CD2-OG1 3.48Å; T286-T290 HydrophobicContact CG2-CG2 4.39Å; T286-T290 WeakPolarHBondContact O-CG2 3.28Å; T286-T290 PolarHBondContact O-N 3.44Å; T286-T290 PolarHBondContact O-OG1 3.46Å; T286-T290 VanDerWaalsContact O-OG1 3.05Å; T287-T290 WeakPolarHBondContact CA-OG1 3.3Å; T287-T290 PolarHBondContact O-N 3.38Å; T287-T290 PolarHBondContact O-OG1 3.21Å; T290-T293 PolarHBondContact O-N 3.29Å; T290-L294 WeakPolarHBondContact O-CB 3.37Å; T290-L294 PolarHBondContact O-N 3.38Å
291	M	93.4	Very high	89.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65	-42.5	175.5	-171.6	65.1	-161.1	0	0	111.3	L262 T287 V288 L289 L294 M295 F315 C318 Y319	L262-M291 HydrophobicContact CD1-CB 4.27Å; L262-M291 HydrophobicContact CD1-SD 3.96Å; T287-M291 VanDerWaalsContact O-CB 3.31Å; T287-M291 WeakPolarHBondContact O-CB 3.42Å; T287-M291 PolarHBondContact O-N 3.34Å; V288-M291 PolarHBondContact O-N 2.77Å; L289-M291 VanDerWaalsContact C-N 3.31Å; L289-M291 PolarHBondContact O-N 2.89Å; M291-L294 PolarHBondContact O-N 2.88Å; M291-M295 WeakPolarHBondContact O-CB 3.43Å; M291-M295 PolarHBondContact O-N 2.05Å; M291-F315 HydrophobicContact CE-CB 3.91Å; M291-F315 HydrophobicContact CE-CD1 3.71Å; M291-F315 HydrophobicContact CE-CG 4.22Å; M291-F315 VanDerWaalsContact CE-O 3.31Å; M291-F315 WeakPolarHBondContact CE-O 3.14Å; M291-C318 HydrophobicContact CE-CB 3.42Å; M291-C318 VanDerWaalsContact CE-CB 3.42Å; M291-C318 HydrophobicContact SD-CB 4.17Å; M291-Y319 HydrophobicContact CB-CD2 4.49Å; M291-Y319 HydrophobicContact CG-CD2 4.05Å
292	T	93.1	Very high	88.9	Confident	53 Å²	53	57 Å²	57	33%	0.325	34%	0.335	S	S	.	.	H	α-helix	trans	-61.4	-45	174.8	-52.6	0	0	0	0	111.1	V288 L289 M295 V296	V288-T292 WeakPolarHBondContact O-CB 3.4Å; V288-T292 PolarHBondContact O-N 2.9Å; V288-T292 PolarHBondContact O-OG1 3.13Å; L289-T292 WeakPolarHBondContact O-CB 3.29Å; L289-T292 PolarHBondContact O-N 2.68Å; T292-M295 PolarHBondContact O-N 3.18Å; T292-V296 WeakPolarHBondContact O-CG2 3.1Å; T292-V296 PolarHBondContact O-N 3.47Å
293	T	92.9	Very high	88	Confident	86 Å²	86	54 Å²	54	53%	0.528	32%	0.318	S	S	.	.	H	α-helix	trans	-62	-43.7	177.7	-58.8	0	0	0	0	112	L289 T290 V296 S297	L289-T293 PolarHBondContact O-N 2.74Å; L289-T293 PolarHBondContact O-OG1 2.81Å; T290-T293 PolarHBondContact O-N 3.29Å; T293-V296 PolarHBondContact O-N 3.07Å; T293-S297 VanDerWaalsContact O-CB 3.32Å; T293-S297 WeakPolarHBondContact O-CB 3.4Å; T293-S297 PolarHBondContact O-N 3.36Å
294	L	91.5	Very high	86.5	Confident	33 Å²	33	63 Å²	63	17%	0.173	35%	0.347	C	S	.	.	H	α-helix	trans	-61.6	-45.4	176.8	-177.7	62.3	0	0	0	111.6	P258 S259 L262 T290 M291 S297 A298 F315	P258-L294 HydrophobicContact CB-CD2 4.07Å; S259-L294 WeakPolarHBondContact OG-CD2 3.21Å; L262-L294 HydrophobicContact CD1-CD2 4.13Å; T290-L294 WeakPolarHBondContact O-CB 3.37Å; T290-L294 PolarHBondContact O-N 3.38Å; M291-L294 PolarHBondContact O-N 2.88Å; L294-S297 PolarHBondContact O-N 3.22Å; L294-A298 WeakPolarHBondContact O-CB 3.43Å; L294-A298 PolarHBondContact O-N 3.01Å; L294-F315 HydrophobicContact CD2-CE1 4.25Å; L294-F315 HydrophobicContact CG-CE1 4.21Å
295	M	89.1	Confident	85	Confident	19 Å²	19	67.5 Å²	67.5	9%	0.094	38%	0.382	C	S	.	.	H	α-helix	trans	-63.1	-41.3	178.3	-176.1	-179.6	-173.8	0	0	112.7	M291 T292 R299 F315 W316	M291-M295 WeakPolarHBondContact O-CB 3.43Å; M291-M295 PolarHBondContact O-N 2.05Å; T292-M295 PolarHBondContact O-N 3.18Å; M295-R299 VanDerWaalsContact O-CG 3.32Å; M295-R299 WeakPolarHBondContact O-CG 3.45Å; M295-R299 PolarHBondContact O-N 2.66Å; M295-F315 HydrophobicContact CB-CB 4.4Å; M295-F315 HydrophobicContact CB-CD2 4.28Å; M295-F315 HydrophobicContact CB-CG 4.35Å; M295-F315 HydrophobicContact CG-CB 4.03Å; M295-F315 HydrophobicContact CG-CD2 4.02Å; M295-F315 HydrophobicContact CG-CG 4.27Å; M295-F315 HydrophobicContact SD-CB 4.25Å; M295-W316 HydrophobicContact CE-CD2 4.47Å; M295-W316 HydrophobicContact CE-CG 4.36Å
296	V	89.1	Confident	83.5	Confident	95 Å²	95	64.5 Å²	64.5	58%	0.576	37%	0.37	S	S	*	.	H	α-helix	trans	-67.7	-42.5	175	172.2	0	0	0	0	111.3	T292 T293 A298 R299 S300	T292-V296 WeakPolarHBondContact O-CG2 3.1Å; T292-V296 PolarHBondContact O-N 3.47Å; T293-V296 PolarHBondContact O-N 3.07Å; V296-A298 PolarHBondContact O-N 3.49Å; V296-R299 PolarHBondContact O-N 3.49Å; V296-S300 PolarHBondContact O-N 2.7Å
297	S	87.6	Confident	82.4	Confident	74 Å²	74	64.2 Å²	64.2	52%	0.517	38%	0.375	S	S	.	.	H	α-helix	trans	-60.6	-46.2	178.5	-172.5	0	0	0	0	111.8	T293 L294 R299 S300	T293-S297 VanDerWaalsContact O-CB 3.32Å; T293-S297 WeakPolarHBondContact O-CB 3.4Å; T293-S297 PolarHBondContact O-N 3.36Å; L294-S297 PolarHBondContact O-N 3.22Å; S297-R299 VanDerWaalsContact C-N 3.25Å; S297-R299 PolarHBondContact O-N 3.43Å; S297-S300 WeakPolarHBondContact O-CB 3.42Å; S297-S300 PolarHBondContact O-N 3.3Å; S297-S300 PolarHBondContact O-OG 3.2Å
298	A	83.5	Confident	81.9	Confident	15 Å²	15	70 Å²	70	12%	0.124	40%	0.404	C	S	.	.	H	α-helix	trans	-68.5	-18.6	178.8	0	0	0	0	0	114.4	L294 V296 L311 F315	L294-A298 WeakPolarHBondContact O-CB 3.43Å; L294-A298 PolarHBondContact O-N 3.01Å; V296-A298 PolarHBondContact O-N 3.49Å; A298-L311 HydrophobicContact CB-CD2 4.48Å; A298-F315 HydrophobicContact CB-CE2 3.44Å; A298-F315 VanDerWaalsContact CB-CE2 3.44Å; A298-F315 HydrophobicContact CB-CZ 3.56Å
299	R	81.2	Confident	81.7	Confident	109 Å²	109	69.5 Å²	69.5	41%	0.411	40%	0.4	S	S	.	.	H	α-helix	trans	-87.9	-17.5	174.9	-76.1	173.5	170.4	-162	-8.6	113.9	M295 V296 S297 S301 L302 D312	M295-R299 VanDerWaalsContact O-CG 3.32Å; M295-R299 WeakPolarHBondContact O-CG 3.45Å; M295-R299 PolarHBondContact O-N 2.66Å; V296-R299 PolarHBondContact O-N 3.49Å; S297-R299 VanDerWaalsContact C-N 3.25Å; S297-R299 PolarHBondContact O-N 3.43Å; R299-S301 VanDerWaalsContact C-N 3.28Å; R299-S301 PolarHBondContact O-N 2.71Å; R299-L302 PolarHBondContact O-N 2.85Å; R299-D312 IonicContact CZ-OD1 2.7Å; R299-D312 IonicContact NE-OD1 2.95Å; R299-D312 PolarHBondContact NE-OD1 3.48Å; R299-D312 VanDerWaalsContact NH2-CG 3.28Å; R299-D312 IonicContact NH2-OD1 3.27Å; R299-D312 PolarHBondContact NH2-OD1 2.89Å; R299-D312 IonicContact NH2-OD2 2.66Å
300	S	79.8	Confident	81.6	Confident	100 Å²	100	64.4 Å²	64.4	70%	0.699	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-24.3	-173.2	69.3	0	0	0	0	113.8	V296 S297	V296-S300 PolarHBondContact O-N 2.7Å; S297-S300 WeakPolarHBondContact O-CB 3.42Å; S297-S300 PolarHBondContact O-N 3.3Å; S297-S300 PolarHBondContact O-OG 3.2Å
301	S	70.4	Confident	81.4	Confident	75 Å²	75	62.1 Å²	62.1	52%	0.524	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	-0.1	179.4	51.2	0	0	0	0	114.7	R299	R299-S301 VanDerWaalsContact C-N 3.28Å; R299-S301 PolarHBondContact O-N 2.71Å
302	L	75.7	Confident	81.3	Confident	13 Å²	13	62.5 Å²	62.5	7%	0.068	36%	0.361	C	S	.	.	S	Bend	trans	-123.2	155.5	-170.8	-70	172.4	0	0	0	112	E81 Y172 R299 R304 K309	E81-L302 HydrophobicContact CB-CD2 4.23Å; Y172-L302 HydrophobicContact CD1-CD1 4.04Å; Y172-L302 HydrophobicContact CD2-CD2 4.49Å; Y172-L302 HydrophobicContact CE1-CD1 3.62Å; Y172-L302 HydrophobicContact CE1-CD2 4.43Å; Y172-L302 HydrophobicContact CE2-CD2 3.88Å; R299-L302 PolarHBondContact O-N 2.85Å; L302-R304 PolarHBondContact O-N 2.96Å; L302-K309 HydrophobicContact CD1-CD 3.8Å
303	P	72.9	Confident	81.3	Confident	20 Å²	20	61.9 Å²	61.9	13%	0.13	36%	0.357	C	S	.	.			trans	-61.7	128.8	-179	23.8	-32.6	0	0	0	111.1	E81 L169 A305 S306	E81-P303 VanDerWaalsContact O-CG 3.3Å; E81-P303 WeakPolarHBondContact O-CG 3.41Å; L169-P303 HydrophobicContact CD1-CG 3.93Å; P303-A305 PolarHBondContact O-N 2.89Å; P303-A305 VanDerWaalsContact O-N 3.09Å; P303-S306 WeakPolarHBondContact O-CB 3.38Å; P303-S306 PolarHBondContact O-N 2.89Å; P303-S306 PolarHBondContact O-OG 2.82Å
304	R	60.5	Low	81.4	Confident	260 Å²	260	57.8 Å²	57.8	98%	0.981	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-19.7	-177.8	-70.3	-176.6	176.2	176.2	-0.6	114.4	L302	L302-R304 PolarHBondContact O-N 2.96Å
305	A	58.8	Low	81.5	Confident	103 Å²	103	56.3 Å²	56.3	85%	0.851	32%	0.324	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	1.2	178.7	0	0	0	0	0	113.9	P303	P303-A305 PolarHBondContact O-N 2.89Å; P303-A305 VanDerWaalsContact O-N 3.09Å
306	S	61.6	Low	81.7	Confident	34 Å²	34	62 Å²	62	24%	0.238	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-64.9	146.1	179.5	49.4	0	0	0	0	112.9	P303 K309	P303-S306 WeakPolarHBondContact O-CB 3.38Å; P303-S306 PolarHBondContact O-N 2.89Å; P303-S306 PolarHBondContact O-OG 2.82Å; S306-K309 PolarHBondContact OG-NZ 2.91Å
307	A	71.1	Confident	82	Confident	64 Å²	64	59.1 Å²	59.1	53%	0.529	33%	0.326	S	S	.	.	P	Polyproline II helix	trans	-58.5	173.9	171.2	0	0	0	0	0	112.7	T170 K309	T170-A307 HydrophobicContact CG2-CB 4.49Å; A307-K309 PolarHBondContact O-N 2.86Å; A307-K309 PolarHBondContact O-NZ 2.89Å
308	I	84.7	Confident	82.4	Confident	131 Å²	131	55.6 Å²	55.6	67%	0.672	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-62.3	118.6	173.8	-59.7	176.1	0	0	0	108.6	D312 V313	I308-D312 HydrophobicContact CG2-CB 4.39Å; I308-V313 HydrophobicContact CG2-CG2 3.67Å
309	K	89.6	Confident	82.9	Confident	13 Å²	13	57.8 Å²	57.8	6%	0.057	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-91.2	155.3	-179.1	-68.5	163.6	-70.1	-57.9	0	111.1	L169 T170 Y172 L302 S306 A307 L311 D312 V313	L169-K309 HydrophobicContact CB-CG 4.44Å; L169-K309 WeakPolarHBondContact O-CG 3.42Å; T170-K309 CarbonylContact O-C 3.54Å; Y172-K309 HydrophobicContact CD1-CD 4.39Å; Y172-K309 HydrophobicContact CG-CD 4.49Å; L302-K309 HydrophobicContact CD1-CD 3.8Å; S306-K309 PolarHBondContact OG-NZ 2.91Å; A307-K309 PolarHBondContact O-N 2.86Å; A307-K309 PolarHBondContact O-NZ 2.89Å; K309-L311 PolarHBondContact O-N 3.42Å; K309-D312 HydrophobicContact CB-CB 4.47Å; K309-D312 WeakPolarHBondContact CE-OD2 3.4Å; K309-D312 PolarHBondContact N-OD2 2.83Å; K309-D312 IonicContact NZ-OD2 3.18Å; K309-D312 PolarHBondContact NZ-OD2 2.58Å; K309-D312 WeakPolarHBondContact O-CA 3.27Å; K309-D312 WeakPolarHBondContact O-CB 3.26Å; K309-D312 PolarHBondContact O-N 2.8Å; K309-V313 PolarHBondContact O-N 3.4Å; K309-V313 VanDerWaalsContact O-N 3.11Å
310	A	91.9	Very high	83.6	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-52.6	-41.7	173	0	0	0	0	0	112.2	T170 D312 V313 Y314 Y455 Y459	T170-A310 PolarHBondContact O-N 2.94Å; A310-D312 VanDerWaalsContact C-N 3.35Å; A310-D312 PolarHBondContact O-N 2.96Å; A310-V313 PolarHBondContact O-N 2.85Å; A310-Y314 PolarHBondContact O-N 2.83Å; A310-Y455 WeakPolarHBondContact O-CE2 3.36Å; A310-Y455 PolarHBondContact O-OH 3.13Å; A310-Y459 HydrophobicContact CB-CD1 3.34Å; A310-Y459 HydrophobicContact CB-CD2 4.32Å; A310-Y459 HydrophobicContact CB-CE1 3.49Å; A310-Y459 VanDerWaalsContact CB-CE1 3.49Å; A310-Y459 HydrophobicContact CB-CE2 4.44Å; A310-Y459 HydrophobicContact CB-CG 3.79Å
311	L	91.4	Very high	84.4	Confident	7 Å²	7	53.3 Å²	53.3	4%	0.037	28%	0.284	C	S	.	.	H	α-helix	trans	-62.1	-37.2	174.6	-173.5	64.7	0	0	0	113.3	Y172 Y256 A298 K309 Y314 F315	Y172-L311 HydrophobicContact CD1-CB 4.35Å; Y172-L311 HydrophobicContact CD1-CD2 4.32Å; Y172-L311 HydrophobicContact CE1-CD2 3.98Å; Y172-L311 PolarHBondContact O-N 2.89Å; Y172-L311 VanDerWaalsContact O-N 3.13Å; Y256-L311 HydrophobicContact CD2-CD1 4.29Å; Y256-L311 HydrophobicContact CE1-CD1 4.28Å; Y256-L311 HydrophobicContact CE2-CD1 3.63Å; A298-L311 HydrophobicContact CB-CD2 4.48Å; K309-L311 PolarHBondContact O-N 3.42Å; L311-Y314 PolarHBondContact O-N 2.99Å; L311-F315 HydrophobicContact CD1-CE1 4.31Å; L311-F315 HydrophobicContact CD1-CE2 4.01Å; L311-F315 HydrophobicContact CD1-CZ 3.84Å; L311-F315 HydrophobicContact CD2-CE2 3.91Å; L311-F315 HydrophobicContact CD2-CZ 4.18Å; L311-F315 HydrophobicContact CG-CD2 4.15Å; L311-F315 HydrophobicContact CG-CE2 3.56Å; L311-F315 HydrophobicContact CG-CZ 3.91Å; L311-F315 WeakPolarHBondContact O-CD2 3.44Å; L311-F315 PolarHBondContact O-N 3.01Å
312	D	90.9	Very high	85.6	Confident	8 Å²	8	49.8 Å²	49.8	4%	0.043	26%	0.26	C	S	.	.	H	α-helix	trans	-65.1	-40.1	176.2	-74.9	-50.5	0	0	0	111.6	R299 I308 K309 A310 Y314 F315 W316	R299-D312 IonicContact CZ-OD1 2.7Å; R299-D312 IonicContact NE-OD1 2.95Å; R299-D312 PolarHBondContact NE-OD1 3.48Å; R299-D312 VanDerWaalsContact NH2-CG 3.28Å; R299-D312 IonicContact NH2-OD1 3.27Å; R299-D312 PolarHBondContact NH2-OD1 2.89Å; R299-D312 IonicContact NH2-OD2 2.66Å; I308-D312 HydrophobicContact CG2-CB 4.39Å; K309-D312 HydrophobicContact CB-CB 4.47Å; K309-D312 WeakPolarHBondContact CE-OD2 3.4Å; K309-D312 PolarHBondContact N-OD2 2.83Å; K309-D312 IonicContact NZ-OD2 3.18Å; K309-D312 PolarHBondContact NZ-OD2 2.58Å; K309-D312 WeakPolarHBondContact O-CA 3.27Å; K309-D312 WeakPolarHBondContact O-CB 3.26Å; K309-D312 PolarHBondContact O-N 2.8Å; A310-D312 VanDerWaalsContact C-N 3.35Å; A310-D312 PolarHBondContact O-N 2.96Å; D312-Y314 VanDerWaalsContact C-N 3.34Å; D312-F315 PolarHBondContact O-N 3.24Å; D312-W316 PolarHBondContact O-N 3.01Å
313	V	92.9	Very high	86.4	Confident	40 Å²	40	53.7 Å²	53.7	24%	0.242	28%	0.276	C	S	.	.	H	α-helix	trans	-63.8	-41.7	174.9	178.1	0	0	0	0	110.5	I308 K309 A310 W316 I317	I308-V313 HydrophobicContact CG2-CG2 3.67Å; K309-V313 PolarHBondContact O-N 3.4Å; K309-V313 VanDerWaalsContact O-N 3.11Å; A310-V313 PolarHBondContact O-N 2.85Å; V313-W316 PolarHBondContact O-N 2.81Å; V313-I317 HydrophobicContact CG1-CD1 4.07Å; V313-I317 WeakPolarHBondContact O-CG1 3.29Å; V313-I317 PolarHBondContact O-N 2.99Å
314	Y	94.6	Very high	87.4	Confident	1 Å²	1	54.2 Å²	54.2	0%	0.004	28%	0.283	C	S	.	.	H	α-helix	trans	-62.8	-44	177.2	-166.6	-100.9	0	0	0	113	Y256 I260 A310 L311 D312 W316 I317 C318 N452 Y455	Y256-Y314 AromaticContact CD1-CD1 3.48Å; Y256-Y314 HydrophobicContact CD1-CD1 3.48Å; Y256-Y314 VanDerWaalsContact CD1-CD1 3.48Å; Y256-Y314 HydrophobicContact CD1-CD2 4.11Å; Y256-Y314 AromaticContact CD1-CE1 3.49Å; Y256-Y314 HydrophobicContact CD1-CE1 3.49Å; Y256-Y314 VanDerWaalsContact CD1-CE1 3.49Å; Y256-Y314 HydrophobicContact CD1-CE2 4.12Å; Y256-Y314 AromaticContact CD1-CG 3.8Å; Y256-Y314 HydrophobicContact CD1-CG 3.8Å; Y256-Y314 AromaticContact CD1-CZ 3.83Å; Y256-Y314 AromaticContact CE1-CD1 3.67Å; Y256-Y314 HydrophobicContact CE1-CD1 3.67Å; Y256-Y314 AromaticContact CE1-CD2 3.9Å; Y256-Y314 HydrophobicContact CE1-CD2 3.9Å; Y256-Y314 HydrophobicContact CE1-CE1 4.13Å; Y256-Y314 HydrophobicContact CE1-CE2 4.34Å; Y256-Y314 AromaticContact CE1-CG 3.54Å; Y256-Y314 HydrophobicContact CE1-CG 3.54Å; Y256-Y314 HydrophobicContact CG-CD1 4.46Å; Y256-Y314 HydrophobicContact CG-CE1 4.36Å; I260-Y314 WeakPolarHBondContact CD1-OH 3.35Å; I260-Y314 WeakPolarHBondContact CG1-OH 3.41Å; A310-Y314 PolarHBondContact O-N 2.83Å; L311-Y314 PolarHBondContact O-N 2.99Å; D312-Y314 VanDerWaalsContact C-N 3.34Å; Y314-W316 VanDerWaalsContact C-N 3.33Å; Y314-W316 PolarHBondContact O-N 3.07Å; Y314-I317 PolarHBondContact O-N 2.88Å; Y314-C318 WeakPolarHBondContact CE1-SG 3.36Å; Y314-C318 PolarHBondContact O-N 3.15Å; Y314-C318 PolarHBondContact O-SG 3.24Å; Y314-C318 VanDerWaalsContact O-SG 3.4Å; Y314-N452 WeakPolarHBondContact CE2-OD1 3.45Å; Y314-N452 PolarHBondContact OH-OD1 3.08Å; Y314-Y455 AromaticContact CD2-CD1 3.61Å; Y314-Y455 HydrophobicContact CD2-CD1 3.61Å; Y314-Y455 AromaticContact CD2-CD2 4Å; Y314-Y455 HydrophobicContact CD2-CD2 4Å; Y314-Y455 AromaticContact CD2-CE1 3.59Å; Y314-Y455 HydrophobicContact CD2-CE1 3.59Å; Y314-Y455 AromaticContact CD2-CE2 3.96Å; Y314-Y455 HydrophobicContact CD2-CE2 3.96Å; Y314-Y455 AromaticContact CD2-CG 3.84Å; Y314-Y455 HydrophobicContact CD2-CG 3.84Å; Y314-Y455 AromaticContact CD2-CZ 3.78Å; Y314-Y455 HydrophobicContact CE2-CD1 4.04Å; Y314-Y455 HydrophobicContact CE2-CE1 4.29Å; Y314-Y455 HydrophobicContact CE2-CG 4.4Å; Y314-Y455 HydrophobicContact CG-CE1 4.23Å; Y314-Y455 HydrophobicContact CG-CE2 4.37Å
315	F	93.8	Very high	89	Confident	1 Å²	1	42 Å²	42	0%	0.004	24%	0.237	C	C	.	.	H	α-helix	trans	-62.9	-40.1	174.3	-67.4	-41.9	0	0	0	111.7	S259 M291 L294 M295 A298 L311 D312 C318 Y319	S259-F315 WeakPolarHBondContact OG-CE1 3.41Å; M291-F315 HydrophobicContact CE-CB 3.91Å; M291-F315 HydrophobicContact CE-CD1 3.71Å; M291-F315 HydrophobicContact CE-CG 4.22Å; M291-F315 VanDerWaalsContact CE-O 3.31Å; M291-F315 WeakPolarHBondContact CE-O 3.14Å; L294-F315 HydrophobicContact CD2-CE1 4.25Å; L294-F315 HydrophobicContact CG-CE1 4.21Å; M295-F315 HydrophobicContact CB-CB 4.4Å; M295-F315 HydrophobicContact CB-CD2 4.28Å; M295-F315 HydrophobicContact CB-CG 4.35Å; M295-F315 HydrophobicContact CG-CB 4.03Å; M295-F315 HydrophobicContact CG-CD2 4.02Å; M295-F315 HydrophobicContact CG-CG 4.27Å; M295-F315 HydrophobicContact SD-CB 4.25Å; A298-F315 HydrophobicContact CB-CE2 3.44Å; A298-F315 VanDerWaalsContact CB-CE2 3.44Å; A298-F315 HydrophobicContact CB-CZ 3.56Å; L311-F315 HydrophobicContact CD1-CE1 4.31Å; L311-F315 HydrophobicContact CD1-CE2 4.01Å; L311-F315 HydrophobicContact CD1-CZ 3.84Å; L311-F315 HydrophobicContact CD2-CE2 3.91Å; L311-F315 HydrophobicContact CD2-CZ 4.18Å; L311-F315 HydrophobicContact CG-CD2 4.15Å; L311-F315 HydrophobicContact CG-CE2 3.56Å; L311-F315 HydrophobicContact CG-CZ 3.91Å; L311-F315 WeakPolarHBondContact O-CD2 3.44Å; L311-F315 PolarHBondContact O-N 3.01Å; D312-F315 PolarHBondContact O-N 3.24Å; F315-C318 PolarHBondContact O-N 2.88Å; F315-Y319 WeakPolarHBondContact O-CB 3.31Å; F315-Y319 PolarHBondContact O-N 2.74Å
316	W	94.2	Very high	90.5	Very high	138 Å²	138	39.2 Å²	39.2	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-62.4	-41.9	174.8	-93.4	114.8	0	0	0	113.2	M295 D312 V313 Y314 Y319 V320	M295-W316 HydrophobicContact CE-CD2 4.47Å; M295-W316 HydrophobicContact CE-CG 4.36Å; D312-W316 PolarHBondContact O-N 3.01Å; V313-W316 PolarHBondContact O-N 2.81Å; Y314-W316 VanDerWaalsContact C-N 3.33Å; Y314-W316 PolarHBondContact O-N 3.07Å; W316-Y319 HydrophobicContact CE3-CD1 4.22Å; W316-Y319 AromaticContact CZ3-CD1 3.97Å; W316-Y319 HydrophobicContact CZ3-CD1 3.97Å; W316-Y319 HydrophobicContact CZ3-CE1 4.33Å; W316-Y319 PolarHBondContact O-N 3.03Å; W316-V320 WeakPolarHBondContact O-CG2 3.17Å; W316-V320 PolarHBondContact O-N 2.85Å
317	I	95.1	Very high	92	Very high	36 Å²	36	42 Å²	42	19%	0.185	22%	0.219	C	C	.	.	H	α-helix	trans	-57.3	-56.2	173.3	-71.3	164.7	0	0	0	109.8	V313 Y314 Y319 V320 F321 V451 Y455	V313-I317 HydrophobicContact CG1-CD1 4.07Å; V313-I317 WeakPolarHBondContact O-CG1 3.29Å; V313-I317 PolarHBondContact O-N 2.99Å; Y314-I317 PolarHBondContact O-N 2.88Å; I317-Y319 VanDerWaalsContact C-N 3.29Å; I317-Y319 PolarHBondContact O-N 2.8Å; I317-V320 PolarHBondContact O-N 2.99Å; I317-F321 HydrophobicContact CG2-CD2 4.01Å; I317-F321 HydrophobicContact CG2-CE2 3.97Å; I317-F321 WeakPolarHBondContact O-CD2 3.49Å; I317-F321 PolarHBondContact O-N 2.89Å; I317-F321 VanDerWaalsContact O-N 3.12Å; I317-V451 HydrophobicContact CD1-CG1 4.02Å; I317-V451 HydrophobicContact CG1-CG1 4.37Å; I317-V451 HydrophobicContact CG2-CG1 3.58Å; I317-Y455 HydrophobicContact CD1-CD2 4.07Å
318	C	95.8	Very high	93	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-58.2	-40.8	179.7	-69.2	0	0	0	0	112.3	V263 M291 Y314 F315 F321 V322	V263-C318 HydrophobicContact CG2-CB 3.66Å; M291-C318 HydrophobicContact CE-CB 3.42Å; M291-C318 VanDerWaalsContact CE-CB 3.42Å; M291-C318 HydrophobicContact SD-CB 4.17Å; Y314-C318 WeakPolarHBondContact CE1-SG 3.36Å; Y314-C318 PolarHBondContact O-N 3.15Å; Y314-C318 PolarHBondContact O-SG 3.24Å; Y314-C318 VanDerWaalsContact O-SG 3.4Å; F315-C318 PolarHBondContact O-N 2.88Å; C318-F321 PolarHBondContact O-N 3.37Å; C318-V322 WeakPolarHBondContact O-CG2 3.38Å; C318-V322 PolarHBondContact O-N 2.83Å
319	Y	94.7	Very high	93.2	Very high	60 Å²	60	34.1 Å²	34.1	24%	0.235	17%	0.168	C	C	.	.	H	α-helix	trans	-62	-44	177.2	-173.6	-86.3	0	0	0	112.1	V288 M291 F315 W316 I317 F321 V322 F323	V288-Y319 HydrophobicContact CG1-CE2 3.96Å; M291-Y319 HydrophobicContact CB-CD2 4.49Å; M291-Y319 HydrophobicContact CG-CD2 4.05Å; F315-Y319 WeakPolarHBondContact O-CB 3.31Å; F315-Y319 PolarHBondContact O-N 2.74Å; W316-Y319 HydrophobicContact CE3-CD1 4.22Å; W316-Y319 AromaticContact CZ3-CD1 3.97Å; W316-Y319 HydrophobicContact CZ3-CD1 3.97Å; W316-Y319 HydrophobicContact CZ3-CE1 4.33Å; W316-Y319 PolarHBondContact O-N 3.03Å; I317-Y319 VanDerWaalsContact C-N 3.29Å; I317-Y319 PolarHBondContact O-N 2.8Å; Y319-F321 VanDerWaalsContact C-N 3.33Å; Y319-F321 PolarHBondContact O-N 3.31Å; Y319-V322 PolarHBondContact O-N 3.5Å; Y319-F323 HydrophobicContact CE1-CB 4.49Å; Y319-F323 VanDerWaalsContact O-CB 3.27Å; Y319-F323 WeakPolarHBondContact O-CB 3.25Å; Y319-F323 PolarHBondContact O-N 2.95Å
320	V	95.5	Very high	93.3	Very high	85 Å²	85	36.3 Å²	36.3	52%	0.515	19%	0.188	S	C	.	.	H	α-helix	trans	-61.7	-40.3	175.7	169.1	0	0	0	0	111.3	W316 I317 F323 A324	W316-V320 WeakPolarHBondContact O-CG2 3.17Å; W316-V320 PolarHBondContact O-N 2.85Å; I317-V320 PolarHBondContact O-N 2.99Å; V320-F323 PolarHBondContact O-N 2.8Å; V320-A324 WeakPolarHBondContact O-CB 3.1Å; V320-A324 PolarHBondContact O-N 2.74Å
321	F	95.6	Very high	93.1	Very high	30 Å²	30	41.5 Å²	41.5	13%	0.132	21%	0.211	C	C	.	.	H	α-helix	trans	-64.9	-44.9	175.9	-84.9	-79.2	0	0	0	113	V263 I317 C318 Y319 A324 A325 F444 T447 F448 V451	V263-F321 HydrophobicContact CG1-CB 4.08Å; I317-F321 HydrophobicContact CG2-CD2 4.01Å; I317-F321 HydrophobicContact CG2-CE2 3.97Å; I317-F321 WeakPolarHBondContact O-CD2 3.49Å; I317-F321 PolarHBondContact O-N 2.89Å; I317-F321 VanDerWaalsContact O-N 3.12Å; C318-F321 PolarHBondContact O-N 3.37Å; Y319-F321 VanDerWaalsContact C-N 3.33Å; Y319-F321 PolarHBondContact O-N 3.31Å; F321-A324 PolarHBondContact O-N 2.84Å; F321-A325 PolarHBondContact O-N 3.29Å; F321-A325 VanDerWaalsContact O-N 3.09Å; F321-F444 HydrophobicContact CD1-CD1 4.14Å; F321-T447 WeakPolarHBondContact CE1-OG1 3.47Å; F321-F448 HydrophobicContact CD1-CB 4.32Å; F321-F448 HydrophobicContact CD1-CD2 4.43Å; F321-F448 AromaticContact CD2-CD2 3.62Å; F321-F448 HydrophobicContact CD2-CD2 3.62Å; F321-F448 HydrophobicContact CD2-CE2 4.28Å; F321-F448 HydrophobicContact CE1-CB 4Å; F321-F448 HydrophobicContact CE2-CB 4.44Å; F321-F448 AromaticContact CE2-CD2 3.8Å; F321-F448 HydrophobicContact CE2-CD2 3.8Å; F321-F448 AromaticContact CG-CD2 3.97Å; F321-F448 HydrophobicContact CG-CD2 3.97Å; F321-F448 HydrophobicContact CZ-CB 4.07Å; F321-F448 HydrophobicContact CZ-CD2 4.28Å; F321-V451 HydrophobicContact CE2-CB 4.46Å; F321-V451 HydrophobicContact CE2-CG2 4.41Å; F321-V451 HydrophobicContact CZ-CG2 4.35Å
322	V	95.3	Very high	92.9	Very high	1 Å²	1	41.2 Å²	41.2	1%	0.006	21%	0.209	C	C	.	.	H	α-helix	trans	-63.9	-42.9	176.6	175.3	0	0	0	0	111	V263 V288 C318 Y319 A325 L326	V263-V322 HydrophobicContact CG2-CG2 3.98Å; V288-V322 HydrophobicContact CG2-CG1 3.74Å; C318-V322 WeakPolarHBondContact O-CG2 3.38Å; C318-V322 PolarHBondContact O-N 2.83Å; Y319-V322 PolarHBondContact O-N 3.5Å; V322-A325 PolarHBondContact O-N 2.81Å; V322-L326 PolarHBondContact O-N 3.31Å
323	F	94.3	Very high	92.8	Very high	95 Å²	95	44.3 Å²	44.3	42%	0.417	22%	0.223	S	C	.	.	H	α-helix	trans	-67.1	-37.1	177.3	-172.7	-112.9	0	0	0	112.4	Y319 V320 A325 L326 I327	Y319-F323 HydrophobicContact CE1-CB 4.49Å; Y319-F323 VanDerWaalsContact O-CB 3.27Å; Y319-F323 WeakPolarHBondContact O-CB 3.25Å; Y319-F323 PolarHBondContact O-N 2.95Å; V320-F323 PolarHBondContact O-N 2.8Å; F323-A325 VanDerWaalsContact C-N 3.32Å; F323-A325 PolarHBondContact O-N 2.81Å; F323-L326 WeakPolarHBondContact O-CB 3.24Å; F323-L326 PolarHBondContact O-N 3.32Å; F323-I327 HydrophobicContact CD1-CD1 3.78Å; F323-I327 HydrophobicContact CE1-CD1 3.47Å; F323-I327 VanDerWaalsContact CE1-CD1 3.47Å; F323-I327 HydrophobicContact CE1-CG1 4.29Å; F323-I327 HydrophobicContact CZ-CD1 4.08Å; F323-I327 PolarHBondContact O-N 3.34Å
324	A	94.1	Very high	92.6	Very high	32 Å²	32	49.3 Å²	49.3	26%	0.264	24%	0.239	S	C	.	.	H	α-helix	trans	-64.8	-33.8	174.2	0	0	0	0	0	112.5	V320 F321 I327 E328 F444	V320-A324 WeakPolarHBondContact O-CB 3.1Å; V320-A324 PolarHBondContact O-N 2.74Å; F321-A324 PolarHBondContact O-N 2.84Å; A324-I327 PolarHBondContact O-N 2.89Å; A324-E328 WeakPolarHBondContact O-CB 3.33Å; A324-E328 PolarHBondContact O-N 3.4Å; A324-F444 HydrophobicContact CB-CE1 3.8Å; A324-F444 HydrophobicContact CB-CZ 4.05Å
325	A	92.3	Very high	92.2	Very high	4 Å²	4	50.2 Å²	50.2	3%	0.033	24%	0.244	C	C	.	.	H	α-helix	trans	-66.7	-34.9	172.7	0	0	0	0	0	112.4	F270 F321 V322 F323 Y329 F444	F270-A325 HydrophobicContact CE1-CB 4.09Å; F270-A325 HydrophobicContact CZ-CB 3.83Å; F321-A325 PolarHBondContact O-N 3.29Å; F321-A325 VanDerWaalsContact O-N 3.09Å; V322-A325 PolarHBondContact O-N 2.81Å; F323-A325 VanDerWaalsContact C-N 3.32Å; F323-A325 PolarHBondContact O-N 2.81Å; A325-Y329 PolarHBondContact O-N 2.93Å; A325-F444 HydrophobicContact CB-CE1 4.22Å
326	L	91.8	Very high	91.8	Very high	44 Å²	44	51.2 Å²	51.2	23%	0.23	25%	0.253	C	S	.	.	H	α-helix	trans	-68.1	-38.6	172.6	-177.2	65.9	0	0	0	112.1	V288 V322 F323 Y329 A330	V288-L326 HydrophobicContact CG2-CD2 4.48Å; V322-L326 PolarHBondContact O-N 3.31Å; F323-L326 WeakPolarHBondContact O-CB 3.24Å; F323-L326 PolarHBondContact O-N 3.32Å; L326-Y329 PolarHBondContact O-N 2.89Å; L326-A330 PolarHBondContact O-N 3.12Å; L326-A330 VanDerWaalsContact O-N 3.12Å
327	I	92.1	Very high	91.4	Very high	92 Å²	92	47.2 Å²	47.2	47%	0.472	24%	0.241	S	C	.	.	H	α-helix	trans	-67	-42.5	174.8	-71.4	173.7	0	0	0	111.6	F323 A324 Y329 A330 F331	F323-I327 HydrophobicContact CD1-CD1 3.78Å; F323-I327 HydrophobicContact CE1-CD1 3.47Å; F323-I327 VanDerWaalsContact CE1-CD1 3.47Å; F323-I327 HydrophobicContact CE1-CG1 4.29Å; F323-I327 HydrophobicContact CZ-CD1 4.08Å; F323-I327 PolarHBondContact O-N 3.34Å; A324-I327 PolarHBondContact O-N 2.89Å; I327-Y329 VanDerWaalsContact C-N 3.3Å; I327-Y329 PolarHBondContact O-N 2.92Å; I327-A330 PolarHBondContact O-N 3.02Å; I327-F331 WeakPolarHBondContact O-CB 3.17Å; I327-F331 PolarHBondContact O-N 3.36Å
328	E	92.1	Very high	91	Very high	15 Å²	15	51 Å²	51	7%	0.07	25%	0.254	C	S	.	.	H	α-helix	trans	-51.7	-52.9	173.7	-178.7	-69.3	134.9	0	0	109.8	F270 R280 A324 A330 F331 A332 I436 A440 F444	F270-E328 HydrophobicContact CD1-CG 4.34Å; F270-E328 WeakPolarHBondContact CD1-OE2 3.48Å; F270-E328 HydrophobicContact CE1-CB 4.15Å; F270-E328 HydrophobicContact CE1-CG 3.82Å; F270-E328 WeakPolarHBondContact CE1-OE2 3.35Å; R280-E328 IonicContact NH2-OE1 3.94Å; R280-E328 IonicContact NH2-OE2 3.13Å; R280-E328 PolarHBondContact NH2-OE2 2.73Å; A324-E328 WeakPolarHBondContact O-CB 3.33Å; A324-E328 PolarHBondContact O-N 3.4Å; E328-A330 PolarHBondContact O-N 3.37Å; E328-F331 WeakPolarHBondContact O-CB 3.49Å; E328-F331 PolarHBondContact O-N 2.53Å; E328-F331 VanDerWaalsContact O-N 3.11Å; E328-A332 WeakPolarHBondContact O-CB 3.47Å; E328-A332 PolarHBondContact O-N 2.95Å; E328-I436 HydrophobicContact CG-CG2 4.36Å; E328-I436 WeakPolarHBondContact OE1-CG2 3.5Å; E328-A440 HydrophobicContact CG-CB 4.11Å; E328-F444 HydrophobicContact CB-CZ 4.41Å
329	Y	89.6	Confident	90.3	Very high	15 Å²	15	54 Å²	54	6%	0.059	27%	0.265	C	S	.	.	H	α-helix	trans	-60.2	-43.5	179.9	167	-107.9	0	0	0	112.5	V277 R280 V281 A325 L326 I327 F331 A332 H333	V277-Y329 WeakPolarHBondContact CA-OH 3.41Å; V277-Y329 WeakPolarHBondContact CG1-OH 3.36Å; R280-Y329 HydrophobicContact CB-CD1 4.38Å; R280-Y329 HydrophobicContact CB-CD2 3.74Å; R280-Y329 HydrophobicContact CB-CE1 4.35Å; R280-Y329 HydrophobicContact CB-CE2 3.67Å; R280-Y329 HydrophobicContact CB-CG 4.08Å; R280-Y329 HydrophobicContact CG-CD2 4.24Å; R280-Y329 HydrophobicContact CG-CE2 4.28Å; V281-Y329 HydrophobicContact CG2-CD1 4.42Å; V281-Y329 HydrophobicContact CG2-CE1 3.46Å; V281-Y329 VanDerWaalsContact CG2-CE1 3.46Å; A325-Y329 PolarHBondContact O-N 2.93Å; L326-Y329 PolarHBondContact O-N 2.89Å; I327-Y329 VanDerWaalsContact C-N 3.3Å; I327-Y329 PolarHBondContact O-N 2.92Å; Y329-F331 VanDerWaalsContact C-N 3.28Å; Y329-F331 PolarHBondContact O-N 3.09Å; Y329-A332 PolarHBondContact O-N 3.26Å; Y329-H333 HydrophobicContact CE2-CB 4.13Å; Y329-H333 VanDerWaalsContact O-CB 3.28Å; Y329-H333 WeakPolarHBondContact O-CB 3.44Å; Y329-H333 PolarHBondContact O-N 2.81Å
330	A	90.4	Very high	89.7	Confident	58 Å²	58	56.5 Å²	56.5	48%	0.479	28%	0.282	S	S	.	.	H	α-helix	trans	-61	-38.8	177.3	0	0	0	0	0	111.9	L326 I327 E328 Y334	L326-A330 PolarHBondContact O-N 3.12Å; L326-A330 VanDerWaalsContact O-N 3.12Å; I327-A330 PolarHBondContact O-N 3.02Å; E328-A330 PolarHBondContact O-N 3.37Å; A330-Y334 WeakPolarHBondContact O-CB 3.3Å; A330-Y334 PolarHBondContact O-N 2.89Å
331	F	89.3	Confident	89.2	Confident	110 Å²	110	58.1 Å²	58.1	48%	0.482	28%	0.282	S	S	.	.	H	α-helix	trans	-71.1	-44.1	176.7	-177.2	-108.6	0	0	0	112.5	I327 E328 Y329 Y334 N335 I436	I327-F331 WeakPolarHBondContact O-CB 3.17Å; I327-F331 PolarHBondContact O-N 3.36Å; E328-F331 WeakPolarHBondContact O-CB 3.49Å; E328-F331 PolarHBondContact O-N 2.53Å; E328-F331 VanDerWaalsContact O-N 3.11Å; Y329-F331 VanDerWaalsContact C-N 3.28Å; Y329-F331 PolarHBondContact O-N 3.09Å; F331-Y334 PolarHBondContact O-N 2.97Å; F331-N335 WeakPolarHBondContact CE1-ND2 3.38Å; F331-N335 WeakPolarHBondContact CZ-ND2 3.43Å; F331-N335 PolarHBondContact O-N 3.16Å; F331-N335 PolarHBondContact O-ND2 3.2Å; F331-I436 HydrophobicContact CD1-CD1 3.92Å; F331-I436 HydrophobicContact CE1-CD1 3.83Å
332	A	87.6	Confident	88.7	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-60.3	-47.2	175	0	0	0	0	0	111.4	E328 Y329 Y334 N335 A336	E328-A332 WeakPolarHBondContact O-CB 3.47Å; E328-A332 PolarHBondContact O-N 2.95Å; Y329-A332 PolarHBondContact O-N 3.26Å; A332-Y334 PolarHBondContact O-N 2.77Å; A332-N335 PolarHBondContact O-N 2.81Å; A332-A336 WeakPolarHBondContact O-CB 3.37Å; A332-A336 PolarHBondContact O-N 3.47Å
333	H	88.3	Confident	88.1	Confident	73 Å²	73	66 Å²	66	34%	0.338	32%	0.317	S	S	.	.	H	α-helix	trans	-62.5	-42.4	176.8	-176.9	-91.1	0	0	0	112.5	Y329 N335 A336 D337	Y329-H333 HydrophobicContact CE2-CB 4.13Å; Y329-H333 VanDerWaalsContact O-CB 3.28Å; Y329-H333 WeakPolarHBondContact O-CB 3.44Å; Y329-H333 PolarHBondContact O-N 2.81Å; H333-N335 PolarHBondContact O-N 3Å; H333-A336 PolarHBondContact O-N 2.89Å; H333-D337 WeakPolarHBondContact O-CB 3.48Å; H333-D337 PolarHBondContact O-N 2.9Å
334	Y	88.4	Confident	87.6	Confident	145 Å²	145	64.2 Å²	64.2	57%	0.569	32%	0.32	S	S	*	.	H	α-helix	trans	-60.4	-45	175.2	179.3	-95.1	0	0	0	112.1	A330 F331 A332 Y338	A330-Y334 WeakPolarHBondContact O-CB 3.3Å; A330-Y334 PolarHBondContact O-N 2.89Å; F331-Y334 PolarHBondContact O-N 2.97Å; A332-Y334 PolarHBondContact O-N 2.77Å; Y334-Y338 VanDerWaalsContact O-CB 3.31Å; Y334-Y338 WeakPolarHBondContact O-CB 3.35Å; Y334-Y338 PolarHBondContact O-N 2.84Å
335	N	86.8	Confident	87.2	Confident	21 Å²	21	69.5 Å²	69.5	11%	0.112	34%	0.337	C	S	.	.	H	α-helix	trans	-66	-40.2	177.5	-71.8	-30.3	0	0	0	112	F331 A332 H333 Y338 R339 I436	F331-N335 WeakPolarHBondContact CE1-ND2 3.38Å; F331-N335 WeakPolarHBondContact CZ-ND2 3.43Å; F331-N335 PolarHBondContact O-N 3.16Å; F331-N335 PolarHBondContact O-ND2 3.2Å; A332-N335 PolarHBondContact O-N 2.81Å; H333-N335 PolarHBondContact O-N 3Å; N335-Y338 PolarHBondContact O-N 3.4Å; N335-R339 WeakPolarHBondContact O-CB 3.14Å; N335-R339 WeakPolarHBondContact O-CG 3.46Å; N335-R339 PolarHBondContact O-N 3.22Å; N335-I436 WeakPolarHBondContact ND2-CD1 3.38Å
336	A	85.1	Confident	86.8	Confident	22 Å²	22	73.6 Å²	73.6	18%	0.182	36%	0.362	C	S	.	.	H	α-helix	trans	-61.8	-47.9	175.9	0	0	0	0	0	112.2	A332 H333 R339 L340 A433	A332-A336 WeakPolarHBondContact O-CB 3.37Å; A332-A336 PolarHBondContact O-N 3.47Å; H333-A336 PolarHBondContact O-N 2.89Å; A336-R339 PolarHBondContact O-N 3.3Å; A336-L340 WeakPolarHBondContact O-CG 3.35Å; A336-L340 PolarHBondContact O-N 3.08Å; A336-A433 HydrophobicContact CB-CB 4.1Å
337	D	85.8	Confident	86.4	Confident	53 Å²	53	78.6 Å²	78.6	28%	0.283	38%	0.382	S	S	.	.	H	α-helix	trans	-65.1	-41.6	176.7	174.3	56.6	0	0	0	112.3	H333 R339 L340 K341	H333-D337 WeakPolarHBondContact O-CB 3.48Å; H333-D337 PolarHBondContact O-N 2.9Å; D337-R339 VanDerWaalsContact C-N 3.34Å; D337-R339 PolarHBondContact O-N 3.23Å; D337-L340 PolarHBondContact O-N 2.9Å; D337-K341 WeakPolarHBondContact O-CB 3.44Å; D337-K341 WeakPolarHBondContact O-CG 3.33Å; D337-K341 PolarHBondContact O-N 2.84Å; D337-K341 WeakPolarHBondContact OD1-CE 3.33Å; D337-K341 IonicContact OD1-NZ 3.78Å; D337-K341 PolarHBondContact OD1-NZ 3.44Å; D337-K341 VanDerWaalsContact OD2-CE 3.31Å; D337-K341 WeakPolarHBondContact OD2-CE 3.33Å; D337-K341 IonicContact OD2-NZ 2.9Å; D337-K341 PolarHBondContact OD2-NZ 2.92Å
338	Y	85.8	Confident	85.9	Confident	116 Å²	116	77 Å²	77	46%	0.455	38%	0.382	S	S	.	.	H	α-helix	trans	-58.4	-45.4	173.2	-174	-85.7	0	0	0	111.7	Y334 N335 K341 E342	Y334-Y338 VanDerWaalsContact O-CB 3.31Å; Y334-Y338 WeakPolarHBondContact O-CB 3.35Å; Y334-Y338 PolarHBondContact O-N 2.84Å; N335-Y338 PolarHBondContact O-N 3.4Å; Y338-K341 PolarHBondContact O-N 3.07Å; Y338-E342 WeakPolarHBondContact CE1-OE2 3.41Å; Y338-E342 PolarHBondContact O-N 3.13Å
339	R	80.8	Confident	85.4	Confident	63 Å²	63	81.8 Å²	81.8	24%	0.238	41%	0.408	C	S	.	.	H	α-helix	trans	-65.2	-38.6	176.4	-70.9	-82.6	85.2	-163.9	8.9	112.4	N335 A336 D337 E342 K343 P430	N335-R339 WeakPolarHBondContact O-CB 3.14Å; N335-R339 WeakPolarHBondContact O-CG 3.46Å; N335-R339 PolarHBondContact O-N 3.22Å; A336-R339 PolarHBondContact O-N 3.3Å; D337-R339 VanDerWaalsContact C-N 3.34Å; D337-R339 PolarHBondContact O-N 3.23Å; R339-E342 IonicContact CZ-OE1 3.15Å; R339-E342 IonicContact CZ-OE2 2.69Å; R339-E342 IonicContact NH1-OE1 3.46Å; R339-E342 IonicContact NH2-OE1 2.77Å; R339-E342 PolarHBondContact NH2-OE1 2.84Å; R339-E342 IonicContact NH2-OE2 3.85Å; R339-E342 PolarHBondContact NH2-OE2 3.12Å; R339-E342 PolarHBondContact O-N 3.48Å; R339-K343 WeakPolarHBondContact O-CB 3.39Å; R339-K343 VanDerWaalsContact O-CG 3.29Å; R339-K343 WeakPolarHBondContact O-CG 3.26Å; R339-K343 PolarHBondContact O-N 3.49Å; R339-P430 HydrophobicContact CG-CB 4.43Å
340	L	83.4	Confident	84.9	Confident	113 Å²	113	87.2 Å²	87.2	59%	0.592	43%	0.432	S	S	*	.	H	α-helix	trans	-61.9	-47	174.1	-78.6	163.6	0	0	0	111.1	A336 D337 E342 K343 A344	A336-L340 WeakPolarHBondContact O-CG 3.35Å; A336-L340 PolarHBondContact O-N 3.08Å; D337-L340 PolarHBondContact O-N 2.9Å; L340-E342 VanDerWaalsContact C-N 3.34Å; L340-E342 PolarHBondContact O-N 2.8Å; L340-K343 PolarHBondContact O-N 2.82Å; L340-A344 WeakPolarHBondContact O-CB 3.31Å; L340-A344 PolarHBondContact O-N 3.32Å
341	K	84.8	Confident	84.4	Confident	118 Å²	118	90 Å²	90	51%	0.513	44%	0.439	S	S	.	.	H	α-helix	trans	-61.3	-38.9	175.9	-74.1	166.7	177.3	166.7	0	112.5	D337 Y338 A344 K345	D337-K341 WeakPolarHBondContact O-CB 3.44Å; D337-K341 WeakPolarHBondContact O-CG 3.33Å; D337-K341 PolarHBondContact O-N 2.84Å; D337-K341 WeakPolarHBondContact OD1-CE 3.33Å; D337-K341 IonicContact OD1-NZ 3.78Å; D337-K341 PolarHBondContact OD1-NZ 3.44Å; D337-K341 VanDerWaalsContact OD2-CE 3.31Å; D337-K341 WeakPolarHBondContact OD2-CE 3.33Å; D337-K341 IonicContact OD2-NZ 2.9Å; D337-K341 PolarHBondContact OD2-NZ 2.92Å; Y338-K341 PolarHBondContact O-N 3.07Å; K341-A344 PolarHBondContact O-N 3.41Å; K341-K345 WeakPolarHBondContact O-CG 3.42Å; K341-K345 PolarHBondContact O-N 3.25Å
342	E	85.3	Confident	83.7	Confident	68 Å²	68	87.7 Å²	87.7	32%	0.318	44%	0.436	S	S	.	.	H	α-helix	trans	-72.1	-43.1	176.4	-161.8	179.3	120.9	0	0	112.6	Y338 R339 L340 A344 K345 V346	Y338-E342 WeakPolarHBondContact CE1-OE2 3.41Å; Y338-E342 PolarHBondContact O-N 3.13Å; R339-E342 IonicContact CZ-OE1 3.15Å; R339-E342 IonicContact CZ-OE2 2.69Å; R339-E342 IonicContact NH1-OE1 3.46Å; R339-E342 IonicContact NH2-OE1 2.77Å; R339-E342 PolarHBondContact NH2-OE1 2.84Å; R339-E342 IonicContact NH2-OE2 3.85Å; R339-E342 PolarHBondContact NH2-OE2 3.12Å; R339-E342 PolarHBondContact O-N 3.48Å; L340-E342 VanDerWaalsContact C-N 3.34Å; L340-E342 PolarHBondContact O-N 2.8Å; E342-A344 PolarHBondContact O-N 2.85Å; E342-K345 PolarHBondContact O-N 2.82Å; E342-K345 VanDerWaalsContact O-N 3.14Å; E342-V346 WeakPolarHBondContact O-CG2 3.16Å; E342-V346 PolarHBondContact O-N 2.9Å
343	K	83.1	Confident	83	Confident	128 Å²	128	90.5 Å²	90.5	56%	0.557	46%	0.455	S	S	*	.	H	α-helix	trans	-57.7	-37.3	172.1	-74.3	172.7	-178.5	174.6	0	111.3	R339 L340 K347	R339-K343 WeakPolarHBondContact O-CB 3.39Å; R339-K343 VanDerWaalsContact O-CG 3.29Å; R339-K343 WeakPolarHBondContact O-CG 3.26Å; R339-K343 PolarHBondContact O-N 3.49Å; L340-K343 PolarHBondContact O-N 2.82Å; K343-K347 WeakPolarHBondContact O-CB 3.35Å; K343-K347 WeakPolarHBondContact O-CG 3.47Å; K343-K347 PolarHBondContact O-N 2.84Å
344	A	83.8	Confident	82.3	Confident	58 Å²	58	91.6 Å²	91.6	48%	0.479	46%	0.461	S	S	.	.	H	α-helix	trans	-66.1	-45.8	173.9	0	0	0	0	0	112.5	L340 K341 E342 V346 K347 A348	L340-A344 WeakPolarHBondContact O-CB 3.31Å; L340-A344 PolarHBondContact O-N 3.32Å; K341-A344 PolarHBondContact O-N 3.41Å; E342-A344 PolarHBondContact O-N 2.85Å; A344-V346 PolarHBondContact O-N 3.31Å; A344-K347 PolarHBondContact O-N 3.22Å; A344-A348 WeakPolarHBondContact O-CB 3.42Å; A344-A348 PolarHBondContact O-N 2.87Å
345	K	84.8	Confident	81.2	Confident	143 Å²	143	87.3 Å²	87.3	62%	0.622	45%	0.452	S	S	*	.	H	α-helix	trans	-59.4	-44.8	174.5	-73.4	174.2	-179.1	-179.3	0	112.4	K341 E342 A348 N349	K341-K345 WeakPolarHBondContact O-CG 3.42Å; K341-K345 PolarHBondContact O-N 3.25Å; E342-K345 PolarHBondContact O-N 2.82Å; E342-K345 VanDerWaalsContact O-N 3.14Å; K345-A348 PolarHBondContact O-N 2.86Å; K345-N349 WeakPolarHBondContact O-CB 3.44Å; K345-N349 PolarHBondContact O-N 3.22Å; K345-N349 PolarHBondContact O-OD1 2.98Å
346	V	84.1	Confident	80.3	Confident	91 Å²	91	91.7 Å²	91.7	55%	0.552	47%	0.474	S	S	*	.	H	α-helix	trans	-65	-41.5	177.8	174.6	0	0	0	0	111.3	E342 A344 N349 K350	E342-V346 WeakPolarHBondContact O-CG2 3.16Å; E342-V346 PolarHBondContact O-N 2.9Å; A344-V346 PolarHBondContact O-N 3.31Å; V346-N349 PolarHBondContact O-N 2.79Å; V346-K350 WeakPolarHBondContact O-CB 3.47Å; V346-K350 PolarHBondContact O-N 2.94Å
347	K	82.6	Confident	79.6	Confident	149 Å²	149	94.8 Å²	94.8	65%	0.648	49%	0.49	S	S	*	.	H	α-helix	trans	-61.9	-45.3	173.1	-80.5	-176.2	175.6	-176.2	0	112	K343 A344 N349 K350 L351	K343-K347 WeakPolarHBondContact O-CB 3.35Å; K343-K347 WeakPolarHBondContact O-CG 3.47Å; K343-K347 PolarHBondContact O-N 2.84Å; A344-K347 PolarHBondContact O-N 3.22Å; K347-N349 PolarHBondContact O-N 2.84Å; K347-K350 PolarHBondContact O-N 3.02Å; K347-L351 WeakPolarHBondContact O-CD1 3.45Å; K347-L351 PolarHBondContact O-N 2.99Å
348	A	82.3	Confident	78.5	Confident	57 Å²	57	99.4 Å²	99.4	47%	0.471	51%	0.508	S	S	.	.	H	α-helix	trans	-60.6	-45.4	177.8	0	0	0	0	0	112	A344 K345 K350 L351 S352	A344-A348 WeakPolarHBondContact O-CB 3.42Å; A344-A348 PolarHBondContact O-N 2.87Å; K345-A348 PolarHBondContact O-N 2.86Å; A348-K350 VanDerWaalsContact C-N 3.34Å; A348-K350 PolarHBondContact O-N 2.74Å; A348-L351 PolarHBondContact O-N 3.22Å; A348-S352 WeakPolarHBondContact O-CB 3.33Å; A348-S352 PolarHBondContact O-N 3.39Å
349	N	80.9	Confident	77.3	Confident	117 Å²	117	98.5 Å²	98.5	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-62.7	-40	175.3	-71.1	0.6	0	0	0	111.8	K345 V346 K347 S352 S353	K345-N349 WeakPolarHBondContact O-CB 3.44Å; K345-N349 PolarHBondContact O-N 3.22Å; K345-N349 PolarHBondContact O-OD1 2.98Å; V346-N349 PolarHBondContact O-N 2.79Å; K347-N349 PolarHBondContact O-N 2.84Å; N349-S352 PolarHBondContact O-N 2.62Å; N349-S353 PolarHBondContact O-N 2.92Å
350	K	80.4	Confident	76.2	Confident	129 Å²	129	97.4 Å²	97.4	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-65.4	-47.3	176.5	-170.7	173.6	178.4	-177.1	0	111.8	V346 K347 A348 S352 S353 E354	V346-K350 WeakPolarHBondContact O-CB 3.47Å; V346-K350 PolarHBondContact O-N 2.94Å; K347-K350 PolarHBondContact O-N 3.02Å; A348-K350 VanDerWaalsContact C-N 3.34Å; A348-K350 PolarHBondContact O-N 2.74Å; K350-S352 VanDerWaalsContact C-N 3.3Å; K350-S352 PolarHBondContact O-N 2.76Å; K350-S353 PolarHBondContact O-N 3.26Å; K350-S353 VanDerWaalsContact O-N 3.13Å; K350-S353 PolarHBondContact O-OG 3.45Å; K350-E354 WeakPolarHBondContact CE-OE1 3.4Å; K350-E354 IonicContact NZ-OE1 3.59Å; K350-E354 WeakPolarHBondContact O-CG 3.24Å; K350-E354 PolarHBondContact O-N 3.47Å
351	L	79.6	Confident	75.1	Confident	117 Å²	117	98.9 Å²	98.9	61%	0.613	52%	0.521	S	S	*	.	H	α-helix	trans	-59.9	-38.3	174.6	-93.8	120.2	0	0	0	112.5	K347 A348 E354 S355	K347-L351 WeakPolarHBondContact O-CD1 3.45Å; K347-L351 PolarHBondContact O-N 2.99Å; A348-L351 PolarHBondContact O-N 3.22Å; L351-E354 PolarHBondContact O-N 3.06Å; L351-S355 WeakPolarHBondContact O-CB 3.3Å; L351-S355 PolarHBondContact O-N 3.12Å; L351-S355 PolarHBondContact O-OG 3.2Å
352	S	73.3	Confident	73.7	Confident	61 Å²	61	99.2 Å²	99.2	43%	0.427	53%	0.525	S	S	.	.	H	α-helix	trans	-64.5	-42.4	172.9	176.6	0	0	0	0	112.1	A348 N349 K350 S355 I356	A348-S352 WeakPolarHBondContact O-CB 3.33Å; A348-S352 PolarHBondContact O-N 3.39Å; N349-S352 PolarHBondContact O-N 2.62Å; K350-S352 VanDerWaalsContact C-N 3.3Å; K350-S352 PolarHBondContact O-N 2.76Å; S352-S355 PolarHBondContact O-N 3.17Å; S352-S355 PolarHBondContact O-OG 2.81Å; S352-I356 WeakPolarHBondContact O-CB 3.38Å; S352-I356 WeakPolarHBondContact O-CD1 3.34Å; S352-I356 VanDerWaalsContact O-CG1 3.22Å; S352-I356 WeakPolarHBondContact O-CG1 3.45Å; S352-I356 PolarHBondContact O-N 3.07Å
353	S	73.4	Confident	72.2	Confident	58 Å²	58	98.7 Å²	98.7	41%	0.406	53%	0.532	S	S	.	.	H	α-helix	trans	-66.1	-38.8	175.8	71.2	0	0	0	0	112.7	N349 K350 I356 V357	N349-S353 PolarHBondContact O-N 2.92Å; K350-S353 PolarHBondContact O-N 3.26Å; K350-S353 VanDerWaalsContact O-N 3.13Å; K350-S353 PolarHBondContact O-OG 3.45Å; S353-I356 PolarHBondContact O-N 2.95Å; S353-V357 WeakPolarHBondContact O-CG2 3.36Å; S353-V357 PolarHBondContact O-N 2.81Å
354	E	73.6	Confident	70.7	Confident	97 Å²	97	99.4 Å²	99.4	45%	0.453	54%	0.539	S	S	.	.	H	α-helix	trans	-70.5	-34.9	177.6	-73.5	179.1	-176.8	0	0	112.4	K350 L351 K358	K350-E354 WeakPolarHBondContact CE-OE1 3.4Å; K350-E354 IonicContact NZ-OE1 3.59Å; K350-E354 WeakPolarHBondContact O-CG 3.24Å; K350-E354 PolarHBondContact O-N 3.47Å; L351-E354 PolarHBondContact O-N 3.06Å; E354-K358 WeakPolarHBondContact O-CB 3.4Å; E354-K358 PolarHBondContact O-N 3.02Å
355	S	66.4	Low	69.4	Low	55 Å²	55	100.7 Å²	100.7	39%	0.385	54%	0.54	S	S	.	.	H	α-helix	trans	-71.3	-38.8	174.4	68.4	0	0	0	0	112.1	L351 S352 V357 K358 N359	L351-S355 WeakPolarHBondContact O-CB 3.3Å; L351-S355 PolarHBondContact O-N 3.12Å; L351-S355 PolarHBondContact O-OG 3.2Å; S352-S355 PolarHBondContact O-N 3.17Å; S352-S355 PolarHBondContact O-OG 2.81Å; S355-V357 PolarHBondContact O-N 3.45Å; S355-K358 PolarHBondContact O-N 2.82Å; S355-N359 WeakPolarHBondContact O-CB 3.48Å; S355-N359 VanDerWaalsContact O-CG 3.22Å; S355-N359 PolarHBondContact O-N 3.13Å; S355-N359 PolarHBondContact O-OD1 3.04Å
356	I	67.4	Low	67.9	Low	112 Å²	112	99.6 Å²	99.6	57%	0.574	54%	0.541	S	S	*	.	H	α-helix	trans	-60.5	-44.1	172.2	-69.5	164.5	0	0	0	110.7	S352 S353 N359 G360	S352-I356 WeakPolarHBondContact O-CB 3.38Å; S352-I356 WeakPolarHBondContact O-CD1 3.34Å; S352-I356 VanDerWaalsContact O-CG1 3.22Å; S352-I356 WeakPolarHBondContact O-CG1 3.45Å; S352-I356 PolarHBondContact O-N 3.07Å; S353-I356 PolarHBondContact O-N 2.95Å; I356-N359 PolarHBondContact O-N 2.84Å; I356-G360 PolarHBondContact O-N 2.72Å
357	V	69.8	Low	66.2	Low	87 Å²	87	102.4 Å²	102.4	53%	0.527	55%	0.546	S	S	.	.	H	α-helix	trans	-67.7	-38.5	177.8	171.4	0	0	0	0	112.4	S353 S355 K361	S353-V357 WeakPolarHBondContact O-CG2 3.36Å; S353-V357 PolarHBondContact O-N 2.81Å; S355-V357 PolarHBondContact O-N 3.45Å; V357-K361 WeakPolarHBondContact O-CG 3.37Å; V357-K361 PolarHBondContact O-N 3.39Å; V357-K361 VanDerWaalsContact O-N 3.07Å
358	K	63.3	Low	64.7	Low	150 Å²	150	99.1 Å²	99.1	65%	0.652	54%	0.541	S	S	*	.	H	α-helix	trans	-65.6	-45.8	174	-82.6	-177.9	174.4	178.2	0	112.1	E354 S355 G360 K361 Q362	E354-K358 WeakPolarHBondContact O-CB 3.4Å; E354-K358 PolarHBondContact O-N 3.02Å; S355-K358 PolarHBondContact O-N 2.82Å; K358-G360 VanDerWaalsContact C-N 3.33Å; K358-G360 PolarHBondContact O-N 2.9Å; K358-K361 PolarHBondContact O-N 3.19Å; K358-Q362 PolarHBondContact O-N 2.86Å
359	N	59.6	Low	63.1	Low	97 Å²	97	102 Å²	102	52%	0.519	55%	0.548	S	S	.	.	H	α-helix	trans	-64.1	-38.8	177.4	-70.8	1.3	0	0	0	111.3	S355 I356 K361 Q362 A363	S355-N359 WeakPolarHBondContact O-CB 3.48Å; S355-N359 VanDerWaalsContact O-CG 3.22Å; S355-N359 PolarHBondContact O-N 3.13Å; S355-N359 PolarHBondContact O-OD1 3.04Å; I356-N359 PolarHBondContact O-N 2.84Å; N359-K361 PolarHBondContact O-N 2.98Å; N359-Q362 PolarHBondContact O-N 2.89Å; N359-A363 VanDerWaalsContact O-CB 3.28Å; N359-A363 WeakPolarHBondContact O-CB 3.45Å; N359-A363 PolarHBondContact O-N 3.23Å
360	G	58.8	Low	61.5	Low	41 Å²	41	100.1 Å²	100.1	42%	0.423	54%	0.544	S	S	.	.	H	α-helix	trans	-61.7	-40.4	173.3	0	0	0	0	0	113.1	I356 K358 M364	I356-G360 PolarHBondContact O-N 2.72Å; K358-G360 VanDerWaalsContact C-N 3.33Å; K358-G360 PolarHBondContact O-N 2.9Å; G360-M364 WeakPolarHBondContact O-CB 3.35Å; G360-M364 PolarHBondContact O-N 2.9Å
361	K	59.2	Low	59.8	Low	143 Å²	143	99.3 Å²	99.3	62%	0.622	55%	0.55	S	S	*	.	H	α-helix	trans	-68.5	-40.2	174	-73.4	-178.1	178.3	-173.9	0	112.6	V357 K358 N359 M364 V365	V357-K361 WeakPolarHBondContact O-CG 3.37Å; V357-K361 PolarHBondContact O-N 3.39Å; V357-K361 VanDerWaalsContact O-N 3.07Å; K358-K361 PolarHBondContact O-N 3.19Å; N359-K361 PolarHBondContact O-N 2.98Å; K361-M364 PolarHBondContact O-N 3.41Å; K361-V365 WeakPolarHBondContact O-CG2 3.43Å; K361-V365 PolarHBondContact O-N 3.12Å
362	Q	55.3	Low	58	Low	126 Å²	126	99.5 Å²	99.5	59%	0.589	56%	0.556	S	S	*	*	H	α-helix	trans	-67.3	-38.8	175	-76.2	-179.9	-42	0	0	112.4	K358 N359 V365 L366	K358-Q362 PolarHBondContact O-N 2.86Å; N359-Q362 PolarHBondContact O-N 2.89Å; Q362-V365 PolarHBondContact O-N 3.08Å; Q362-L366 WeakPolarHBondContact O-CB 3.49Å; Q362-L366 PolarHBondContact O-N 3.5Å
363	A	54.3	Low	56.3	Low	56 Å²	56	99.5 Å²	99.5	46%	0.463	57%	0.566	S	S	.	*	H	α-helix	trans	-63.6	-41.7	173.4	0	0	0	0	0	111.6	N359 V365 L366 F367	N359-A363 VanDerWaalsContact O-CB 3.28Å; N359-A363 WeakPolarHBondContact O-CB 3.45Å; N359-A363 PolarHBondContact O-N 3.23Å; A363-V365 PolarHBondContact O-N 3.06Å; A363-L366 PolarHBondContact O-N 2.67Å; A363-F367 WeakPolarHBondContact O-CB 3.42Å; A363-F367 PolarHBondContact O-N 3.28Å
364	M	52.9	Low	54.3	Low	144 Å²	144	104.5 Å²	104.5	71%	0.709	59%	0.585	S	S	*	*	H	α-helix	trans	-61.7	-41.2	174.7	-173.9	176.6	-77	0	0	112.2	G360 K361 F367 S368	G360-M364 WeakPolarHBondContact O-CB 3.35Å; G360-M364 PolarHBondContact O-N 2.9Å; K361-M364 PolarHBondContact O-N 3.41Å; M364-F367 PolarHBondContact O-N 3.05Å; M364-S368 PolarHBondContact O-N 3Å; M364-S368 PolarHBondContact O-OG 3.38Å
365	V	55.7	Low	52.4	Low	84 Å²	84	106.1 Å²	106.1	51%	0.509	60%	0.596	S	S	.	*	H	α-helix	trans	-67.2	-42.3	175.5	171.1	0	0	0	0	112	K361 Q362 A363 F367 S368 L369	K361-V365 WeakPolarHBondContact O-CG2 3.43Å; K361-V365 PolarHBondContact O-N 3.12Å; Q362-V365 PolarHBondContact O-N 3.08Å; A363-V365 PolarHBondContact O-N 3.06Å; V365-F367 VanDerWaalsContact C-N 3.34Å; V365-F367 PolarHBondContact O-N 2.68Å; V365-S368 WeakPolarHBondContact CA-OG 3.34Å; V365-S368 PolarHBondContact O-N 2.82Å; V365-S368 PolarHBondContact O-OG 3.04Å; V365-L369 HydrophobicContact CG1-CD1 4.15Å; V365-L369 PolarHBondContact O-N 3.1Å; V365-L369 VanDerWaalsContact O-N 3.08Å
366	L	53.1	Low	50.7	Low	121 Å²	121	113 Å²	113	63%	0.634	62%	0.623	S	S	*	*	H	α-helix	trans	-63.3	-38	173.4	-90.8	161.2	0	0	0	112.2	Q362 A363 L369 S370	Q362-L366 WeakPolarHBondContact O-CB 3.49Å; Q362-L366 PolarHBondContact O-N 3.5Å; A363-L366 PolarHBondContact O-N 2.67Å; L366-L369 PolarHBondContact O-N 2.81Å; L366-S370 PolarHBondContact O-N 2.87Å; L366-S370 PolarHBondContact O-OG 3.09Å
367	F	48.9	Very low	48.9	Very low	150 Å²	150	111.2 Å²	111.2	66%	0.658	63%	0.632	S	S	*	*	H	α-helix	trans	-63.9	-43.6	176.1	-136.4	-88.3	0	0	0	111.2	A363 M364 V365 L369 S370 V371	A363-F367 WeakPolarHBondContact O-CB 3.42Å; A363-F367 PolarHBondContact O-N 3.28Å; M364-F367 PolarHBondContact O-N 3.05Å; V365-F367 VanDerWaalsContact C-N 3.34Å; V365-F367 PolarHBondContact O-N 2.68Å; F367-L369 VanDerWaalsContact C-N 3.28Å; F367-L369 PolarHBondContact O-N 3.18Å; F367-S370 WeakPolarHBondContact CA-OG 3.47Å; F367-S370 PolarHBondContact O-N 2.73Å; F367-S370 PolarHBondContact O-OG 3.18Å; F367-V371 WeakPolarHBondContact O-CG2 3.35Å; F367-V371 PolarHBondContact O-N 3.46Å
368	S	50.3	Low	47.4	Very low	79 Å²	79	113.3 Å²	113.3	55%	0.552	64%	0.644	S	S	*	*	H	α-helix	trans	-64.2	-28.3	174.2	49.9	0	0	0	0	114.1	M364 V365	M364-S368 PolarHBondContact O-N 3Å; M364-S368 PolarHBondContact O-OG 3.38Å; V365-S368 WeakPolarHBondContact CA-OG 3.34Å; V365-S368 PolarHBondContact O-N 2.82Å; V365-S368 PolarHBondContact O-OG 3.04Å
369	L	48.9	Very low	46	Very low	118 Å²	118	112.9 Å²	112.9	62%	0.618	65%	0.654	S	S	*	*	H	α-helix	trans	-82.3	-19.4	175	-80.3	161.2	0	0	0	113.6	V365 L366 F367	V365-L369 HydrophobicContact CG1-CD1 4.15Å; V365-L369 PolarHBondContact O-N 3.1Å; V365-L369 VanDerWaalsContact O-N 3.08Å; L366-L369 PolarHBondContact O-N 2.81Å; F367-L369 VanDerWaalsContact C-N 3.28Å; F367-L369 PolarHBondContact O-N 3.18Å
370	S	47.4	Very low	45	Very low	77 Å²	77	115 Å²	115	54%	0.538	66%	0.664	S	S	.	*	H	α-helix	trans	-89.1	-10.5	176.1	56.2	0	0	0	0	115.1	L366 F367 T372	L366-S370 PolarHBondContact O-N 2.87Å; L366-S370 PolarHBondContact O-OG 3.09Å; F367-S370 WeakPolarHBondContact CA-OG 3.47Å; F367-S370 PolarHBondContact O-N 2.73Å; F367-S370 PolarHBondContact O-OG 3.18Å; S370-T372 VanDerWaalsContact C-N 3.29Å
371	V	44.6	Very low	43.7	Very low	112 Å²	112	118.8 Å²	118.8	68%	0.679	68%	0.684	S	S	*	*	S	Bend	trans	-76.4	-16.8	176.4	169.9	0	0	0	0	112.4	F367	F367-V371 WeakPolarHBondContact O-CG2 3.35Å; F367-V371 PolarHBondContact O-N 3.46Å
372	T	42.7	Very low	42.5	Very low	122 Å²	122	118.4 Å²	118.4	75%	0.748	69%	0.689	S	S	*	*	S	Bend	trans	-100.7	58.2	167	49.2	0	0	0	0	111.4	S370	S370-T372 VanDerWaalsContact C-N 3.29Å
373	G	37.1	Very low	41.5	Very low	60 Å²	60	122.8 Å²	122.8	62%	0.619	70%	0.7	S	S	*	*			trans	-99	120.7	171.5	0	0	0	0	0	111.9
374	M	30.4	Very low	40.4	Very low	164 Å²	164	127.7 Å²	127.7	81%	0.808	71%	0.713	S	S	*	*			trans	-155.1	120.6	148	-119.7	168	59.8	0	0	113.6
375	N	34.8	Very low	39.1	Very low	131 Å²	131	124.1 Å²	124.1	70%	0.701	71%	0.713	S	S	*	*			trans	58.8	109	146.7	-57.1	-11.9	0	0	0	120.2
376	Q	30.4	Very low	37.8	Very low	200 Å²	200	131.5 Å²	131.5	94%	0.935	73%	0.731	S	S	*	*				169.1	162.5	99.5	-97.1	176	-16.6	0	0	112
377	G	29.6	Very low	36.6	Very low	74 Å²	74	130.5 Å²	130.5	76%	0.763	73%	0.731	S	S	*	*			trans	109.5	83.7	153	0	0	0	0	0	116.9
378	V	37.8	Very low	35.8	Very low	131 Å²	131	130.9 Å²	130.9	79%	0.794	74%	0.735	S	S	*	*			trans	-69.7	127.5	155.4	171.8	0	0	0	0	108.9	I380	V378-I380 HydrophobicContact CG1-CG1 4.44Å
379	V	34.5	Very low	34.7	Very low	141 Å²	141	137 Å²	137	86%	0.855	75%	0.745	S	S	*	*			trans	-138.2	126.8	150.7	179.5	0	0	0	0	110.2
380	I	38.1	Very low	33.7	Very low	141 Å²	141	136 Å²	136	72%	0.723	75%	0.749	S	S	*	*			trans	-86.5	140.5	173.2	-65.3	156.1	0	0	0	108.5	V378	V378-I380 HydrophobicContact CG1-CG1 4.44Å
381	S	31.3	Very low	32.8	Very low	121 Å²	121	135.9 Å²	135.9	85%	0.846	76%	0.759	S	S	*	*			trans	-149.1	126.9	139.6	-160.8	0	0	0	0	113.1
382	N	33.2	Very low	32.1	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	76%	0.76	S	S	*	*			trans	-92.9	160	179.2	-170.4	3.7	0	0	0	109.4
383	R	34.8	Very low	31.4	Very low	217 Å²	217	137.6 Å²	137.6	82%	0.819	76%	0.763	S	S	*	*			trans	141.7	157.3	145.6	-80.9	-171.1	153.4	153.3	0.6	114.1
384	Q	31.7	Very low	31.5	Very low	160 Å²	160	142 Å²	142	75%	0.748	77%	0.77	S	S	*	*			cis	179	146.4	-29.4	-167.2	160	15.3	0	0	108.5
385	G	26.3	Very low	32.1	Very low	68 Å²	68	139.9 Å²	139.9	70%	0.701	77%	0.769	S	S	*	*			trans	91.6	124.6	169.5	0	0	0	0	0	114.2
386	R	28.1	Very low	31.7	Very low	239 Å²	239	137 Å²	137	90%	0.902	77%	0.77	S	S	*	*				70.3	125.5	56.7	-155.5	172.3	-168.1	168.1	4.3	109.5
387	T	28.3	Very low	31.6	Very low	101 Å²	101	137 Å²	137	62%	0.62	77%	0.77	S	S	*	*				-172.4	139.1	69.6	-39.6	0	0	0	0	112.5
388	Q	30.6	Very low	31.4	Very low	158 Å²	158	136.7 Å²	136.7	74%	0.738	77%	0.767	S	S	*	*			trans	54.1	164.7	146.7	-76.5	174.1	-6	0	0	120
389	R	28.9	Very low	30.9	Very low	206 Å²	206	135.2 Å²	135.2	78%	0.777	77%	0.768	S	S	*	*			cis	-162.7	174.1	1.1	-125.7	-174.1	161.4	148.1	-5.7	107.2
390	S	27.5	Very low	30.5	Very low	99 Å²	99	134.2 Å²	134.2	69%	0.692	76%	0.762	S	S	*	*			cis	-164.4	144.7	-10.9	-148.5	0	0	0	0	109.6
391	G	27.9	Very low	29.9	Very low	73 Å²	73	135.5 Å²	135.5	75%	0.753	77%	0.766	S	S	*	*			trans	80.6	148.8	158.7	0	0	0	0	0	117.5
392	S	29.6	Very low	29.7	Very low	101 Å²	101	138.4 Å²	138.4	71%	0.706	77%	0.766	S	S	*	*			cis	-159.4	129.3	-3.5	48.3	0	0	0	0	112
393	E	27.8	Very low	29.8	Very low	170 Å²	170	137.2 Å²	137.2	79%	0.794	77%	0.765	S	S	*	*			trans	66.5	123.2	131.9	-65.7	165	175.8	0	0	120.4
394	I	39.7	Very low	29.5	Very low	153 Å²	153	131 Å²	131	79%	0.785	76%	0.761	S	S	*	*			cis	99.1	140.6	44.4	-81.9	171.6	0	0	0	111.7
395	P	43.3	Very low	30.1	Very low	119 Å²	119	128.7 Å²	128.7	77%	0.773	76%	0.759	S	S	*	*			cis	-145.9	-161.6	-24	43	-22.5	0	0	0	114.9
396	G	27.1	Very low	30.1	Very low	71 Å²	71	130.1 Å²	130.1	73%	0.732	76%	0.759	S	S	*	*			trans	128.3	102.8	158	0	0	0	0	0	113.4
397	E	26.8	Very low	30	Very low	200 Å²	200	128 Å²	128	94%	0.935	75%	0.751	S	S	*	*			cis	112.8	133.5	20	-165.3	171.3	-162.3	0	0	112.4
398	G	27	Very low	29.8	Very low	67 Å²	67	132 Å²	132	69%	0.691	75%	0.754	S	S	*	*			trans	105.5	110.5	-172.6	0	0	0	0	0	112.7
399	A	26.3	Very low	29.6	Very low	99 Å²	99	135 Å²	135	82%	0.818	76%	0.759	S	S	*	*				65.8	131	50.1	0	0	0	0	0	112.5
400	T	25.8	Very low	29.4	Very low	120 Å²	120	130.5 Å²	130.5	74%	0.736	76%	0.759	S	S	*	*			cis	-156.8	159.3	15.8	-25.5	0	0	0	0	112.5
401	E	26	Very low	29.2	Very low	169 Å²	169	137.1 Å²	137.1	79%	0.79	77%	0.769	S	S	*	*			trans	9.9	120.8	150.4	-72.9	167.5	164.6	0	0	120.9
402	E	27	Very low	29.5	Very low	182 Å²	182	139.5 Å²	139.5	85%	0.85	77%	0.771	S	S	*	*				82.5	166.1	95.5	-107.6	-157.2	178.6	0	0	114.9
403	P	36	Very low	29.2	Very low	109 Å²	109	139.5 Å²	139.5	71%	0.708	78%	0.777	S	S	*	*			cis	-131.7	-169.7	-9.8	35.1	-13.3	0	0	0	115.3
404	A	28.8	Very low	29.2	Very low	88 Å²	88	140.4 Å²	140.4	73%	0.727	78%	0.781	S	S	*	*			trans	-81.9	-156.9	176.2	0	0	0	0	0	112
405	P	43.8	Very low	28.4	Very low	111 Å²	111	142 Å²	142	72%	0.721	79%	0.786	S	S	*	*			cis	-148.8	-175.8	3.1	42.9	-21.3	0	0	0	119.5
406	S	26	Very low	27.4	Very low	98 Å²	98	141 Å²	141	69%	0.685	78%	0.782	S	S	*	*			trans	94.3	153.7	144.2	89.6	0	0	0	0	119
407	R	25.3	Very low	27.4	Very low	194 Å²	194	147.4 Å²	147.4	73%	0.732	79%	0.789	S	S	*	*			cis	-163.1	140.3	18.6	-144.4	159.5	-164	-159.5	9.7	115.4
408	R	25.4	Very low	27.3	Very low	184 Å²	184	147.3 Å²	147.3	69%	0.694	79%	0.789	S	S	*	*			trans	64.8	122.5	144.4	-81.8	177.2	-175.9	-176.9	-1.1	121.7
409	R	25.3	Very low	27.5	Very low	221 Å²	221	151 Å²	151	83%	0.834	79%	0.792	S	S	*	*				72	141.8	99.4	-79.3	-174.1	175.5	-179.5	-2.8	114.5
410	S	24.3	Very low	27.6	Very low	112 Å²	112	156.3 Å²	156.3	78%	0.783	80%	0.797	S	S	*	*			cis	-163.9	162	13.4	29.3	0	0	0	0	113.4
411	R	25	Very low	27.9	Very low	238 Å²	238	159.8 Å²	159.8	90%	0.898	80%	0.802	S	S	*	*			trans	-73.3	167.6	161.1	-90.5	-177.5	180	-175.9	-0.4	111
412	P	33.8	Very low	27.9	Very low	124 Å²	124	157.5 Å²	157.5	81%	0.805	80%	0.803	S	S	*	*			cis	-148.7	175.3	38.4	43.5	-23.8	0	0	0	118.7
413	A	23.2	Very low	28.3	Very low	101 Å²	101	154.5 Å²	154.5	84%	0.835	80%	0.801	S	S	*	*			trans	166.3	149.2	136	0	0	0	0	0	111.5
414	E	26.9	Very low	28.3	Very low	188 Å²	188	154.9 Å²	154.9	88%	0.879	81%	0.807	S	S	*	*			trans	-107.5	143.1	165.3	-67.2	176.4	116.3	0	0	109.1
415	E	22.9	Very low	28.8	Very low	187 Å²	187	159.8 Å²	159.8	87%	0.874	81%	0.811	S	S	*	*				-175.8	154.3	122.4	-105.9	-167.7	146.8	0	0	114.9
416	S	22.1	Very low	28.4	Very low	98 Å²	98	160.5 Å²	160.5	69%	0.685	82%	0.818	S	S	*	*			trans	48	111.6	153.7	57.2	0	0	0	0	124
417	K	28.7	Very low	29	Very low	206 Å²	206	161.6 Å²	161.6	90%	0.896	82%	0.82	S	S	*	*				27.5	124.8	125.6	-61.4	175.1	179.5	173.3	0	120.3
418	E	24.4	Very low	29.8	Very low	197 Å²	197	157.7 Å²	157.7	92%	0.921	82%	0.821	S	S	*	*			trans	-153	160	132.9	-128.9	174.5	-163.2	0	0	112.8
419	D	30.2	Very low	30.8	Very low	144 Å²	144	157.8 Å²	157.8	77%	0.77	83%	0.826	S	S	*	*			trans	-81.1	137.2	-157.7	-80.3	-72.5	0	0	0	116.9
420	K	28.6	Very low	32.2	Very low	211 Å²	211	149.8 Å²	149.8	92%	0.917	80%	0.803	S	S	*	*			trans	-136.3	69.6	150.4	-75.7	-165.2	177.8	176	0	112.3	C422	K420-C422 PolarHBondContact O-N 2.91Å
421	K	32.7	Very low	34	Very low	194 Å²	194	149 Å²	149	84%	0.843	79%	0.79	S	S	*	*			trans	-77.3	80.5	170.4	-171	-180	-178.5	-179.7	0	111
422	C	25.9	Very low	36.1	Very low	120 Å²	120	142 Å²	142	81%	0.811	77%	0.77	S	S	*	*			trans	-95.2	133.4	165.5	-163.9	0	0	0	0	110.4	K420 S424	K420-C422 PolarHBondContact O-N 2.91Å; C422-S424 PolarHBondContact O-N 2.85Å
423	C	34.3	Very low	37.9	Very low	120 Å²	120	136.3 Å²	136.3	81%	0.811	73%	0.734	S	S	*	*			trans	-69.3	84.7	-167.4	-71.7	0	0	0	0	114.9	K425	C423-K425 VanDerWaalsContact C-N 3.28Å; C423-K425 PolarHBondContact O-N 3.5Å; C423-K425 VanDerWaalsContact O-N 3.1Å
424	S	37.3	Very low	40.4	Very low	117 Å²	117	136 Å²	136	82%	0.818	72%	0.718	S	S	*	*			trans	-84.1	64.3	166.5	-167.8	0	0	0	0	112.1	C422	C422-S424 PolarHBondContact O-N 2.85Å
425	K	38.8	Very low	43	Very low	190 Å²	190	129.4 Å²	129.4	83%	0.826	69%	0.69	S	S	*	*			trans	-146.6	51.2	169.3	-76.4	-160	179.2	178.3	0	113.7	C423	C423-K425 VanDerWaalsContact C-N 3.28Å; C423-K425 PolarHBondContact O-N 3.5Å; C423-K425 VanDerWaalsContact O-N 3.1Å
426	C	34.7	Very low	45.8	Very low	127 Å²	127	121.6 Å²	121.6	86%	0.858	65%	0.654	S	S	*	*			trans	-100	64.3	149.4	-78.4	0	0	0	0	109.2	C428	C426-C428 VanDerWaalsContact C-N 3.31Å; C426-C428 PolarHBondContact O-N 2.71Å
427	V	38.5	Very low	48.8	Very low	121 Å²	121	117 Å²	117	73%	0.733	62%	0.622	S	S	*	*			trans	-76	91.5	166.6	-179.9	0	0	0	0	106.8	K429	V427-K429 PolarHBondContact O-N 3.16Å; V427-K429 VanDerWaalsContact O-N 3.08Å
428	C	43.7	Very low	51.6	Low	111 Å²	111	111.8 Å²	111.8	75%	0.75	60%	0.603	S	S	*	*			trans	-55.1	115.9	164.3	-67.5	0	0	0	0	107.5	C426 P430	C426-C428 VanDerWaalsContact C-N 3.31Å; C426-C428 PolarHBondContact O-N 2.71Å; C428-P430 WeakPolarHBondContact O-CD 3.47Å
429	K	45.6	Very low	54.6	Low	186 Å²	186	109.9 Å²	109.9	81%	0.809	59%	0.589	S	S	*	*			trans	-57.2	127.5	171	-71.1	179.8	178.5	176.4	0	106.9	V427 I431	V427-K429 PolarHBondContact O-N 3.16Å; V427-K429 VanDerWaalsContact O-N 3.08Å; K429-I431 PolarHBondContact O-N 2.99Å
430	P	53.9	Low	57.4	Low	54 Å²	54	103.4 Å²	103.4	35%	0.351	56%	0.555	S	S	.	*			trans	-59	115.7	-179.1	-26.6	36.6	0	0	0	109.7	R339 C428	R339-P430 HydrophobicContact CG-CB 4.43Å; C428-P430 WeakPolarHBondContact O-CD 3.47Å
431	I	62	Low	60.4	Low	96 Å²	96	97.4 Å²	97.4	49%	0.492	53%	0.527	S	S	.	.			trans	-66.7	135.9	173.2	-61.1	172.9	0	0	0	106.5	K429 A433 T435 I436	K429-I431 PolarHBondContact O-N 2.99Å; I431-A433 PolarHBondContact O-N 3.29Å; I431-T435 HydrophobicContact CG2-CG2 4.13Å; I431-I436 HydrophobicContact CB-CG1 4.33Å; I431-I436 HydrophobicContact CG2-CG1 3.78Å
432	D	69.7	Low	63.1	Low	89 Å²	89	91.3 Å²	91.3	48%	0.476	51%	0.512	S	S	.	.			trans	-65.1	135.5	179.8	-164.3	24.5	0	0	0	109.6	D434 T435 I436	D432-D434 VanDerWaalsContact C-N 3.3Å; D432-D434 PolarHBondContact O-N 2.99Å; D432-T435 WeakPolarHBondContact O-CA 3.48Å; D432-T435 WeakPolarHBondContact O-CB 3.45Å; D432-T435 PolarHBondContact O-N 3.14Å; D432-I436 PolarHBondContact O-N 2.75Å
433	A	72.3	Confident	66.3	Low	6 Å²	6	89.1 Å²	89.1	5%	0.05	50%	0.495	C	S	.	.	H	α-helix	trans	-68.6	-33.8	-165.5	0	0	0	0	0	111.4	Q274 A336 I431 T435 I436 D437	Q274-A433 PolarHBondContact NE2-O 3.35Å; A336-A433 HydrophobicContact CB-CB 4.1Å; I431-A433 PolarHBondContact O-N 3.29Å; A433-T435 PolarHBondContact O-N 3.46Å; A433-I436 WeakPolarHBondContact O-CB 3.34Å; A433-I436 PolarHBondContact O-N 2.83Å; A433-I436 VanDerWaalsContact O-N 3.12Å; A433-D437 PolarHBondContact O-N 3.03Å
434	D	75.8	Confident	69.1	Low	94 Å²	94	84.9 Å²	84.9	50%	0.503	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-28.2	171	-67.5	-28.8	0	0	0	112.3	D432 I438	D432-D434 VanDerWaalsContact C-N 3.3Å; D432-D434 PolarHBondContact O-N 2.99Å; D434-I438 WeakPolarHBondContact O-CD1 3.3Å; D434-I438 VanDerWaalsContact O-CG1 3.22Å; D434-I438 WeakPolarHBondContact O-CG1 3.38Å; D434-I438 PolarHBondContact O-N 2.84Å
435	T	81.6	Confident	71.8	Confident	50 Å²	50	81.2 Å²	81.2	31%	0.307	44%	0.436	S	S	.	.	H	α-helix	trans	-71.2	-33.3	174.5	-59.8	0	0	0	0	111.5	I431 D432 A433 I438 Y439	I431-T435 HydrophobicContact CG2-CG2 4.13Å; D432-T435 WeakPolarHBondContact O-CA 3.48Å; D432-T435 WeakPolarHBondContact O-CB 3.45Å; D432-T435 PolarHBondContact O-N 3.14Å; A433-T435 PolarHBondContact O-N 3.46Å; T435-I438 PolarHBondContact O-N 2.77Å; T435-Y439 HydrophobicContact CG2-CD2 3.79Å; T435-Y439 HydrophobicContact CG2-CE2 3.57Å; T435-Y439 VanDerWaalsContact O-CD2 3.22Å; T435-Y439 WeakPolarHBondContact O-CD2 3.41Å; T435-Y439 PolarHBondContact O-N 2.85Å
436	I	81.6	Confident	74.4	Confident	22 Å²	22	79 Å²	79	11%	0.113	43%	0.427	C	S	.	.	H	α-helix	trans	-64.1	-50	175.2	-54.7	172.8	0	0	0	109.6	E328 F331 N335 I431 D432 A433 I438 Y439 A440	E328-I436 HydrophobicContact CG-CG2 4.36Å; E328-I436 WeakPolarHBondContact OE1-CG2 3.5Å; F331-I436 HydrophobicContact CD1-CD1 3.92Å; F331-I436 HydrophobicContact CE1-CD1 3.83Å; N335-I436 WeakPolarHBondContact ND2-CD1 3.38Å; I431-I436 HydrophobicContact CB-CG1 4.33Å; I431-I436 HydrophobicContact CG2-CG1 3.78Å; D432-I436 PolarHBondContact O-N 2.75Å; A433-I436 WeakPolarHBondContact O-CB 3.34Å; A433-I436 PolarHBondContact O-N 2.83Å; A433-I436 VanDerWaalsContact O-N 3.12Å; I436-I438 VanDerWaalsContact C-N 3.29Å; I436-I438 PolarHBondContact O-N 2.9Å; I436-Y439 PolarHBondContact O-N 2.79Å; I436-A440 WeakPolarHBondContact O-CB 3.5Å; I436-A440 PolarHBondContact O-N 2.79Å
437	D	85.1	Confident	77.3	Confident	3 Å²	3	75.4 Å²	75.4	2%	0.016	40%	0.401	C	S	.	.	H	α-helix	trans	-56.9	-40.4	174.9	-84	-50.4	0	0	0	111.8	F270 Q274 R280 A433 A440 R441	F270-D437 WeakPolarHBondContact CA-OD1 3.44Å; Q274-D437 PolarHBondContact NE2-OD2 3.12Å; R280-D437 IonicContact CZ-OD1 3.81Å; R280-D437 VanDerWaalsContact CZ-OD1 3.31Å; R280-D437 IonicContact CZ-OD2 3.64Å; R280-D437 VanDerWaalsContact NH1-CG 3.34Å; R280-D437 IonicContact NH1-OD1 3.35Å; R280-D437 PolarHBondContact NH1-OD1 3.36Å; R280-D437 IonicContact NH1-OD2 2.74Å; R280-D437 PolarHBondContact NH1-OD2 3.11Å; R280-D437 IonicContact NH2-OD1 2.81Å; R280-D437 PolarHBondContact NH2-OD1 3.08Å; R280-D437 IonicContact NH2-OD2 2.68Å; A433-D437 PolarHBondContact O-N 3.03Å; D437-A440 PolarHBondContact O-N 3Å; D437-R441 VanDerWaalsContact O-CG 3.26Å; D437-R441 WeakPolarHBondContact O-CG 3.21Å; D437-R441 PolarHBondContact O-N 2.71Å; D437-R441 VanDerWaalsContact O-N 3.09Å
438	I	86.6	Confident	80	Confident	96 Å²	96	70.2 Å²	70.2	49%	0.492	37%	0.369	S	S	.	.	H	α-helix	trans	-62.8	-45.1	176.5	-73.3	163.8	0	0	0	112.2	D434 T435 I436	D434-I438 WeakPolarHBondContact O-CD1 3.3Å; D434-I438 VanDerWaalsContact O-CG1 3.22Å; D434-I438 WeakPolarHBondContact O-CG1 3.38Å; D434-I438 PolarHBondContact O-N 2.84Å; T435-I438 PolarHBondContact O-N 2.77Å; I436-I438 VanDerWaalsContact C-N 3.29Å; I436-I438 PolarHBondContact O-N 2.9Å
439	Y	88.3	Confident	82.4	Confident	157 Å²	157	67.3 Å²	67.3	62%	0.616	35%	0.353	S	S	*	.	H	α-helix	trans	-66.7	-40.7	175.7	-80.4	-70.1	0	0	0	111.6	T435 I436 R441 A442 V443	T435-Y439 HydrophobicContact CG2-CD2 3.79Å; T435-Y439 HydrophobicContact CG2-CE2 3.57Å; T435-Y439 VanDerWaalsContact O-CD2 3.22Å; T435-Y439 WeakPolarHBondContact O-CD2 3.41Å; T435-Y439 PolarHBondContact O-N 2.85Å; I436-Y439 PolarHBondContact O-N 2.79Å; Y439-R441 VanDerWaalsContact C-N 3.32Å; Y439-R441 PolarHBondContact O-N 3.24Å; Y439-A442 PolarHBondContact O-N 3.15Å; Y439-A442 VanDerWaalsContact O-N 3.17Å; Y439-V443 WeakPolarHBondContact O-CB 3.38Å; Y439-V443 WeakPolarHBondContact O-CG2 3.38Å; Y439-V443 PolarHBondContact O-N 3.27Å
440	A	88.9	Confident	84.9	Confident	7 Å²	7	61.6 Å²	61.6	6%	0.058	33%	0.333	C	S	.	.	H	α-helix	trans	-58.4	-42.3	179.4	0	0	0	0	0	112.2	F270 E328 I436 D437 A442 V443 F444	F270-A440 HydrophobicContact CD1-CB 3.9Å; F270-A440 HydrophobicContact CD2-CB 4.04Å; F270-A440 HydrophobicContact CE1-CB 3.96Å; F270-A440 HydrophobicContact CE2-CB 4.08Å; F270-A440 HydrophobicContact CG-CB 3.97Å; F270-A440 HydrophobicContact CZ-CB 4.04Å; E328-A440 HydrophobicContact CG-CB 4.11Å; I436-A440 WeakPolarHBondContact O-CB 3.5Å; I436-A440 PolarHBondContact O-N 2.79Å; D437-A440 PolarHBondContact O-N 3Å; A440-A442 PolarHBondContact O-N 2.82Å; A440-A442 VanDerWaalsContact O-N 3.16Å; A440-V443 PolarHBondContact O-N 2.94Å; A440-F444 HydrophobicContact CB-CD2 4.01Å; A440-F444 HydrophobicContact CB-CE2 4.12Å; A440-F444 WeakPolarHBondContact O-CB 3.26Å; A440-F444 PolarHBondContact O-N 2.77Å
441	R	90.6	Very high	86.8	Confident	86 Å²	86	61.2 Å²	61.2	33%	0.325	33%	0.33	S	S	.	.	H	α-helix	trans	-55.7	-29.4	176.9	-72	167.5	-160.1	166.8	8.2	114.5	F270 D437 Y439 P445	F270-R441 HydrophobicContact CB-CG 3.87Å; F270-R441 VanDerWaalsContact O-CZ 3.27Å; F270-R441 PolarHBondContact O-NE 3.13Å; F270-R441 PolarHBondContact O-NH2 3.18Å; D437-R441 VanDerWaalsContact O-CG 3.26Å; D437-R441 WeakPolarHBondContact O-CG 3.21Å; D437-R441 PolarHBondContact O-N 2.71Å; D437-R441 VanDerWaalsContact O-N 3.09Å; Y439-R441 VanDerWaalsContact C-N 3.32Å; Y439-R441 PolarHBondContact O-N 3.24Å; R441-P445 VanDerWaalsContact O-CD 3.31Å; R441-P445 WeakPolarHBondContact O-CD 3.46Å; R441-P445 WeakPolarHBondContact O-CG 3.2Å
442	A	90.2	Very high	88.4	Confident	65 Å²	65	57.5 Å²	57.5	54%	0.537	31%	0.311	S	S	.	.	H	α-helix	trans	-97.3	-43.1	178.4	0	0	0	0	0	112.4	Y439 A440 F446	Y439-A442 PolarHBondContact O-N 3.15Å; Y439-A442 VanDerWaalsContact O-N 3.17Å; A440-A442 PolarHBondContact O-N 2.82Å; A440-A442 VanDerWaalsContact O-N 3.16Å; A442-F446 VanDerWaalsContact O-CB 3.28Å; A442-F446 WeakPolarHBondContact O-CB 3.42Å; A442-F446 PolarHBondContact O-N 2.91Å
443	V	92.6	Very high	89.6	Confident	75 Å²	75	58 Å²	58	46%	0.455	32%	0.317	S	S	.	.	H	α-helix	trans	-70.5	-43.8	-173.3	174.9	0	0	0	0	111.9	Y439 A440 T447	Y439-V443 WeakPolarHBondContact O-CB 3.38Å; Y439-V443 WeakPolarHBondContact O-CG2 3.38Å; Y439-V443 PolarHBondContact O-N 3.27Å; A440-V443 PolarHBondContact O-N 2.94Å; V443-T447 HydrophobicContact CG1-CG2 4.1Å; V443-T447 WeakPolarHBondContact O-CB 3.15Å; V443-T447 WeakPolarHBondContact O-CG2 3.48Å; V443-T447 PolarHBondContact O-N 2.97Å; V443-T447 PolarHBondContact O-OG1 3.3Å
444	F	93.2	Very high	90.7	Very high	30 Å²	30	62.8 Å²	62.8	13%	0.132	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-50.5	-177.5	-84.1	-108.7	0	0	0	112.6	F270 F321 A324 A325 E328 A440 F446 T447 F448	F270-F444 HydrophobicContact CE2-CB 3.99Å; F270-F444 HydrophobicContact CE2-CD1 4.27Å; F270-F444 HydrophobicContact CE2-CD2 4.01Å; F270-F444 AromaticContact CE2-CG 3.85Å; F270-F444 HydrophobicContact CE2-CG 3.85Å; F270-F444 HydrophobicContact CZ-CB 4.49Å; F270-F444 AromaticContact CZ-CD1 3.97Å; F270-F444 HydrophobicContact CZ-CD1 3.97Å; F270-F444 AromaticContact CZ-CD2 3.83Å; F270-F444 HydrophobicContact CZ-CD2 3.83Å; F270-F444 HydrophobicContact CZ-CE1 4.06Å; F270-F444 AromaticContact CZ-CE2 3.92Å; F270-F444 HydrophobicContact CZ-CE2 3.92Å; F270-F444 AromaticContact CZ-CG 3.86Å; F270-F444 HydrophobicContact CZ-CG 3.86Å; F270-F444 HydrophobicContact CZ-CZ 4.04Å; F321-F444 HydrophobicContact CD1-CD1 4.14Å; A324-F444 HydrophobicContact CB-CE1 3.8Å; A324-F444 HydrophobicContact CB-CZ 4.05Å; A325-F444 HydrophobicContact CB-CE1 4.22Å; E328-F444 HydrophobicContact CB-CZ 4.41Å; A440-F444 HydrophobicContact CB-CD2 4.01Å; A440-F444 HydrophobicContact CB-CE2 4.12Å; A440-F444 WeakPolarHBondContact O-CB 3.26Å; A440-F444 PolarHBondContact O-N 2.77Å; F444-F446 PolarHBondContact O-N 3.02Å; F444-T447 PolarHBondContact O-OG1 2.75Å; F444-F448 VanDerWaalsContact O-CB 3.27Å; F444-F448 WeakPolarHBondContact O-CB 3.46Å; F444-F448 PolarHBondContact O-N 2.95Å
445	P	93.3	Very high	91.6	Very high	40 Å²	40	58.7 Å²	58.7	26%	0.26	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-40.1	178.3	-23.3	35.2	0	0	0	113.1	W267 R441 A449	W267-P445 HydrophobicContact CD2-CG 4.02Å; W267-P445 HydrophobicContact CE3-CB 4.26Å; W267-P445 HydrophobicContact CE3-CG 3.74Å; W267-P445 HydrophobicContact CH2-CB 3.75Å; W267-P445 HydrophobicContact CH2-CG 4.07Å; W267-P445 HydrophobicContact CZ2-CB 4.27Å; W267-P445 HydrophobicContact CZ2-CG 4.31Å; W267-P445 HydrophobicContact CZ3-CB 3.75Å; W267-P445 HydrophobicContact CZ3-CG 3.77Å; R441-P445 VanDerWaalsContact O-CD 3.31Å; R441-P445 WeakPolarHBondContact O-CD 3.46Å; R441-P445 WeakPolarHBondContact O-CG 3.2Å; P445-A449 WeakPolarHBondContact O-CB 3.48Å; P445-A449 PolarHBondContact O-N 3.02Å
446	F	94.2	Very high	92.1	Very high	143 Å²	143	59.3 Å²	59.3	63%	0.627	32%	0.315	S	S	*	.	H	α-helix	trans	-64.6	-49.3	179.2	179.1	-98.8	0	0	0	112	A442 F444 A449 V450	A442-F446 VanDerWaalsContact O-CB 3.28Å; A442-F446 WeakPolarHBondContact O-CB 3.42Å; A442-F446 PolarHBondContact O-N 2.91Å; F444-F446 PolarHBondContact O-N 3.02Å; F446-A449 PolarHBondContact O-N 2.89Å; F446-V450 HydrophobicContact CD1-CG2 4.46Å; F446-V450 HydrophobicContact CE1-CG2 4.05Å; F446-V450 HydrophobicContact CE2-CG2 4.4Å; F446-V450 HydrophobicContact CZ-CG2 4.01Å; F446-V450 WeakPolarHBondContact O-CG2 3.3Å; F446-V450 PolarHBondContact O-N 3.02Å
447	T	95.1	Very high	92.7	Very high	53 Å²	53	61.8 Å²	61.8	33%	0.325	33%	0.331	S	S	.	.	H	α-helix	trans	-65.7	-39.1	178.8	51.5	0	0	0	0	111.9	F321 V443 F444 V450 V451	F321-T447 WeakPolarHBondContact CE1-OG1 3.47Å; V443-T447 HydrophobicContact CG1-CG2 4.1Å; V443-T447 WeakPolarHBondContact O-CB 3.15Å; V443-T447 WeakPolarHBondContact O-CG2 3.48Å; V443-T447 PolarHBondContact O-N 2.97Å; V443-T447 PolarHBondContact O-OG1 3.3Å; F444-T447 PolarHBondContact O-OG1 2.75Å; T447-V450 PolarHBondContact O-N 3.45Å; T447-V451 VanDerWaalsContact O-CG2 3.31Å; T447-V451 WeakPolarHBondContact O-CG2 3.32Å; T447-V451 PolarHBondContact O-N 3.34Å
448	F	95.9	Very high	93	Very high	11 Å²	11	64.5 Å²	64.5	5%	0.048	35%	0.354	C	S	.	.	H	α-helix	trans	-62.5	-42.1	173.8	-174.8	-111.7	0	0	0	112.1	I260 V263 W267 F321 F444 V451 N452	I260-F448 HydrophobicContact CG1-CE1 4.34Å; I260-F448 HydrophobicContact CG1-CZ 4.25Å; I260-F448 HydrophobicContact CG2-CE1 4.31Å; V263-F448 HydrophobicContact CB-CE1 4.44Å; V263-F448 HydrophobicContact CB-CE2 4.3Å; V263-F448 HydrophobicContact CB-CZ 4.09Å; V263-F448 HydrophobicContact CG1-CD1 4.21Å; V263-F448 HydrophobicContact CG1-CD2 3.97Å; V263-F448 HydrophobicContact CG1-CE1 4.17Å; V263-F448 HydrophobicContact CG1-CE2 3.93Å; V263-F448 HydrophobicContact CG1-CG 4.11Å; V263-F448 HydrophobicContact CG1-CZ 4.03Å; V263-F448 HydrophobicContact CG2-CE2 4Å; V263-F448 HydrophobicContact CG2-CZ 4.07Å; W267-F448 HydrophobicContact CH2-CD1 4.02Å; W267-F448 HydrophobicContact CZ2-CB 3.96Å; W267-F448 AromaticContact CZ2-CD1 3.93Å; W267-F448 HydrophobicContact CZ2-CD1 3.93Å; W267-F448 HydrophobicContact CZ2-CG 4.11Å; F321-F448 HydrophobicContact CD1-CB 4.32Å; F321-F448 HydrophobicContact CD1-CD2 4.43Å; F321-F448 AromaticContact CD2-CD2 3.62Å; F321-F448 HydrophobicContact CD2-CD2 3.62Å; F321-F448 HydrophobicContact CD2-CE2 4.28Å; F321-F448 HydrophobicContact CE1-CB 4Å; F321-F448 HydrophobicContact CE2-CB 4.44Å; F321-F448 AromaticContact CE2-CD2 3.8Å; F321-F448 HydrophobicContact CE2-CD2 3.8Å; F321-F448 AromaticContact CG-CD2 3.97Å; F321-F448 HydrophobicContact CG-CD2 3.97Å; F321-F448 HydrophobicContact CZ-CB 4.07Å; F321-F448 HydrophobicContact CZ-CD2 4.28Å; F444-F448 VanDerWaalsContact O-CB 3.27Å; F444-F448 WeakPolarHBondContact O-CB 3.46Å; F444-F448 PolarHBondContact O-N 2.95Å; F448-V451 PolarHBondContact O-N 2.91Å; F448-N452 WeakPolarHBondContact CD1-ND2 3.23Å; F448-N452 VanDerWaalsContact CE1-ND2 3.26Å; F448-N452 WeakPolarHBondContact CE1-ND2 3.4Å; F448-N452 VanDerWaalsContact CE2-ND2 3.32Å; F448-N452 WeakPolarHBondContact CE2-ND2 3.32Å; F448-N452 WeakPolarHBondContact CZ-ND2 3.36Å; F448-N452 WeakPolarHBondContact O-CB 3.48Å; F448-N452 PolarHBondContact O-N 3.16Å; F448-N452 PolarHBondContact O-ND2 2.84Å
449	A	95	Very high	93.1	Very high	51 Å²	51	62.9 Å²	62.9	42%	0.421	34%	0.342	S	S	.	.	H	α-helix	trans	-62.1	-45.7	176.1	0	0	0	0	0	112.1	P445 F446 V451 N452 V453	P445-A449 WeakPolarHBondContact O-CB 3.48Å; P445-A449 PolarHBondContact O-N 3.02Å; F446-A449 PolarHBondContact O-N 2.89Å; A449-V451 PolarHBondContact O-N 2.88Å; A449-N452 PolarHBondContact O-N 3.06Å; A449-V453 WeakPolarHBondContact O-CG2 3.31Å; A449-V453 PolarHBondContact O-N 2.81Å
450	V	96.1	Very high	92.8	Very high	65 Å²	65	58.4 Å²	58.4	39%	0.394	33%	0.331	S	S	.	.	H	α-helix	trans	-60.6	-46	176.2	171.7	0	0	0	0	111.3	F446 T447 N452 V453 I454	F446-V450 HydrophobicContact CD1-CG2 4.46Å; F446-V450 HydrophobicContact CE1-CG2 4.05Å; F446-V450 HydrophobicContact CE2-CG2 4.4Å; F446-V450 HydrophobicContact CZ-CG2 4.01Å; F446-V450 WeakPolarHBondContact O-CG2 3.3Å; F446-V450 PolarHBondContact O-N 3.02Å; T447-V450 PolarHBondContact O-N 3.45Å; V450-N452 VanDerWaalsContact C-N 3.33Å; V450-N452 PolarHBondContact O-N 3.45Å; V450-V453 PolarHBondContact O-N 3.06Å; V450-I454 HydrophobicContact CG1-CD1 3.88Å; V450-I454 WeakPolarHBondContact O-CG1 3.46Å; V450-I454 PolarHBondContact O-N 3.15Å
451	V	95.9	Very high	91.8	Very high	47 Å²	47	66.3 Å²	66.3	29%	0.285	37%	0.369	S	S	.	.	H	α-helix	trans	-64.6	-36.7	177.9	174	0	0	0	0	111.7	I317 F321 T447 F448 A449 I454 Y455	I317-V451 HydrophobicContact CD1-CG1 4.02Å; I317-V451 HydrophobicContact CG1-CG1 4.37Å; I317-V451 HydrophobicContact CG2-CG1 3.58Å; F321-V451 HydrophobicContact CE2-CB 4.46Å; F321-V451 HydrophobicContact CE2-CG2 4.41Å; F321-V451 HydrophobicContact CZ-CG2 4.35Å; T447-V451 VanDerWaalsContact O-CG2 3.31Å; T447-V451 WeakPolarHBondContact O-CG2 3.32Å; T447-V451 PolarHBondContact O-N 3.34Å; F448-V451 PolarHBondContact O-N 2.91Å; A449-V451 PolarHBondContact O-N 2.88Å; V451-I454 PolarHBondContact O-N 3.12Å; V451-Y455 VanDerWaalsContact O-CB 3.29Å; V451-Y455 WeakPolarHBondContact O-CB 3.43Å; V451-Y455 PolarHBondContact O-N 3.43Å
452	N	94.8	Very high	91.9	Very high	18 Å²	18	65.3 Å²	65.3	10%	0.096	37%	0.371	C	S	.	.	H	α-helix	trans	-62.8	-46.1	173.5	-87.4	-95.3	0	0	0	111.6	Y314 F448 A449 V450 I454 Y455 W456	Y314-N452 WeakPolarHBondContact CE2-OD1 3.45Å; Y314-N452 PolarHBondContact OH-OD1 3.08Å; F448-N452 WeakPolarHBondContact CD1-ND2 3.23Å; F448-N452 VanDerWaalsContact CE1-ND2 3.26Å; F448-N452 WeakPolarHBondContact CE1-ND2 3.4Å; F448-N452 VanDerWaalsContact CE2-ND2 3.32Å; F448-N452 WeakPolarHBondContact CE2-ND2 3.32Å; F448-N452 WeakPolarHBondContact CZ-ND2 3.36Å; F448-N452 WeakPolarHBondContact O-CB 3.48Å; F448-N452 PolarHBondContact O-N 3.16Å; F448-N452 PolarHBondContact O-ND2 2.84Å; A449-N452 PolarHBondContact O-N 3.06Å; V450-N452 VanDerWaalsContact C-N 3.33Å; V450-N452 PolarHBondContact O-N 3.45Å; N452-I454 VanDerWaalsContact C-N 3.33Å; N452-I454 PolarHBondContact O-N 3.44Å; N452-Y455 PolarHBondContact O-N 2.66Å; N452-W456 PolarHBondContact O-N 3.45Å
453	V	94.6	Very high	92	Very high	98 Å²	98	65.3 Å²	65.3	59%	0.594	36%	0.362	S	S	*	.	H	α-helix	trans	-58.8	-46.2	177.2	172.5	0	0	0	0	110.8	A449 V450 Y455 W456 V457	A449-V453 WeakPolarHBondContact O-CG2 3.31Å; A449-V453 PolarHBondContact O-N 2.81Å; V450-V453 PolarHBondContact O-N 3.06Å; V453-Y455 PolarHBondContact O-N 3.5Å; V453-W456 PolarHBondContact O-N 2.99Å; V453-V457 HydrophobicContact CG1-CG2 4.5Å; V453-V457 WeakPolarHBondContact O-CB 3.44Å; V453-V457 VanDerWaalsContact O-CG2 3.28Å; V453-V457 WeakPolarHBondContact O-CG2 3.14Å; V453-V457 PolarHBondContact O-N 3.2Å
454	I	95.3	Very high	91.9	Very high	107 Å²	107	64.8 Å²	64.8	55%	0.549	36%	0.357	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.8	-66.1	166.3	0	0	0	110.9	V450 V451 N452 V457 A458	V450-I454 HydrophobicContact CG1-CD1 3.88Å; V450-I454 WeakPolarHBondContact O-CG1 3.46Å; V450-I454 PolarHBondContact O-N 3.15Å; V451-I454 PolarHBondContact O-N 3.12Å; N452-I454 VanDerWaalsContact C-N 3.33Å; N452-I454 PolarHBondContact O-N 3.44Å; I454-V457 PolarHBondContact O-N 2.89Å; I454-A458 VanDerWaalsContact O-CB 3.28Å; I454-A458 WeakPolarHBondContact O-CB 3.25Å; I454-A458 PolarHBondContact O-N 2.85Å
455	Y	94.6	Very high	91.9	Very high	8 Å²	8	66.8 Å²	66.8	3%	0.031	37%	0.37	C	S	.	.	H	α-helix	trans	-59.5	-52	179.1	174.9	-88.8	0	0	0	112.1	M174 Y256 A310 Y314 I317 V451 N452 V453 V457 A458 Y459	M174-Y455 HydrophobicContact CE-CE1 4.03Å; Y256-Y455 AromaticContact CE1-CE1 3.77Å; Y256-Y455 HydrophobicContact CE1-CE1 3.77Å; Y256-Y455 PolarHBondContact OH-OH 3.2Å; A310-Y455 WeakPolarHBondContact O-CE2 3.36Å; A310-Y455 PolarHBondContact O-OH 3.13Å; Y314-Y455 AromaticContact CD2-CD1 3.61Å; Y314-Y455 HydrophobicContact CD2-CD1 3.61Å; Y314-Y455 AromaticContact CD2-CD2 4Å; Y314-Y455 HydrophobicContact CD2-CD2 4Å; Y314-Y455 AromaticContact CD2-CE1 3.59Å; Y314-Y455 HydrophobicContact CD2-CE1 3.59Å; Y314-Y455 AromaticContact CD2-CE2 3.96Å; Y314-Y455 HydrophobicContact CD2-CE2 3.96Å; Y314-Y455 AromaticContact CD2-CG 3.84Å; Y314-Y455 HydrophobicContact CD2-CG 3.84Å; Y314-Y455 AromaticContact CD2-CZ 3.78Å; Y314-Y455 HydrophobicContact CE2-CD1 4.04Å; Y314-Y455 HydrophobicContact CE2-CE1 4.29Å; Y314-Y455 HydrophobicContact CE2-CG 4.4Å; Y314-Y455 HydrophobicContact CG-CE1 4.23Å; Y314-Y455 HydrophobicContact CG-CE2 4.37Å; I317-Y455 HydrophobicContact CD1-CD2 4.07Å; V451-Y455 VanDerWaalsContact O-CB 3.29Å; V451-Y455 WeakPolarHBondContact O-CB 3.43Å; V451-Y455 PolarHBondContact O-N 3.43Å; N452-Y455 PolarHBondContact O-N 2.66Å; V453-Y455 PolarHBondContact O-N 3.5Å; Y455-V457 PolarHBondContact O-N 3.42Å; Y455-A458 PolarHBondContact O-N 2.73Å; Y455-Y459 AromaticContact CD2-CD2 3.52Å; Y455-Y459 HydrophobicContact CD2-CD2 3.52Å; Y455-Y459 AromaticContact CD2-CE2 3.63Å; Y455-Y459 HydrophobicContact CD2-CE2 3.63Å; Y455-Y459 HydrophobicContact CE1-CD2 4.34Å; Y455-Y459 AromaticContact CE2-CD2 3.32Å; Y455-Y459 HydrophobicContact CE2-CD2 3.32Å; Y455-Y459 AromaticContact CE2-CE2 3.42Å; Y455-Y459 HydrophobicContact CE2-CE2 3.42Å; Y455-Y459 VanDerWaalsContact CE2-CE2 3.42Å; Y455-Y459 HydrophobicContact CE2-CG 4.3Å; Y455-Y459 HydrophobicContact CG-CD2 4.12Å; Y455-Y459 AromaticContact CZ-CD2 3.74Å; Y455-Y459 WeakPolarHBondContact O-CD2 3.41Å; Y455-Y459 PolarHBondContact O-N 2.73Å
456	W	92.9	Very high	91.8	Very high	64 Å²	64	68.5 Å²	68.5	24%	0.242	38%	0.377	C	S	.	.	H	α-helix	trans	-64.6	-40	-178.6	-75	106.7	0	0	0	111.5	M174 I252 Y256 N452 V453 T460	M174-W456 HydrophobicContact CE-CE3 4.34Å; M174-W456 HydrophobicContact CE-CH2 4.45Å; M174-W456 HydrophobicContact CE-CZ3 3.9Å; M174-W456 HydrophobicContact SD-CE3 3.87Å; M174-W456 HydrophobicContact SD-CH2 4.46Å; M174-W456 HydrophobicContact SD-CZ3 3.47Å; M174-W456 WeakPolarHBondContact SD-CZ3 3.4Å; I252-W456 HydrophobicContact CD1-CH2 4.46Å; I252-W456 HydrophobicContact CG1-CH2 4.11Å; Y256-W456 HydrophobicContact CD1-CH2 4.01Å; Y256-W456 AromaticContact CD1-CZ2 3.63Å; Y256-W456 HydrophobicContact CD1-CZ2 3.63Å; Y256-W456 HydrophobicContact CD2-CH2 4.39Å; Y256-W456 HydrophobicContact CE1-CH2 4.09Å; Y256-W456 AromaticContact CE1-CZ2 4Å; Y256-W456 HydrophobicContact CE1-CZ2 4Å; Y256-W456 HydrophobicContact CE2-CH2 4.45Å; Y256-W456 HydrophobicContact CG-CH2 4.18Å; Y256-W456 HydrophobicContact CG-CZ2 4.04Å; N452-W456 PolarHBondContact O-N 3.45Å; V453-W456 PolarHBondContact O-N 2.99Å; W456-T460 HydrophobicContact CE3-CG2 3.72Å; W456-T460 HydrophobicContact CZ3-CG2 4.29Å; W456-T460 VanDerWaalsContact O-CB 3.3Å; W456-T460 WeakPolarHBondContact O-CB 3.34Å; W456-T460 WeakPolarHBondContact O-CG2 3.3Å; W456-T460 PolarHBondContact O-N 3.3Å; W456-T460 PolarHBondContact O-OG1 3.4Å
457	V	92.7	Very high	91.6	Very high	74 Å²	74	63.5 Å²	63.5	45%	0.448	36%	0.361	S	S	.	.	H	α-helix	trans	-62.4	-42.8	174.3	170.4	0	0	0	0	111.7	V453 I454 Y455 Y459 M461	V453-V457 HydrophobicContact CG1-CG2 4.5Å; V453-V457 WeakPolarHBondContact O-CB 3.44Å; V453-V457 VanDerWaalsContact O-CG2 3.28Å; V453-V457 WeakPolarHBondContact O-CG2 3.14Å; V453-V457 PolarHBondContact O-N 3.2Å; I454-V457 PolarHBondContact O-N 2.89Å; Y455-V457 PolarHBondContact O-N 3.42Å; V457-Y459 PolarHBondContact O-N 2.71Å; V457-M461 HydrophobicContact CG1-CE 3.98Å; V457-M461 PolarHBondContact O-N 3.49Å
458	A	91.9	Very high	91.4	Very high	60 Å²	60	64.3 Å²	64.3	50%	0.496	36%	0.363	S	S	.	.	H	α-helix	trans	-71.9	-25	-177.5	0	0	0	0	0	114.8	I454 Y455	I454-A458 VanDerWaalsContact O-CB 3.28Å; I454-A458 WeakPolarHBondContact O-CB 3.25Å; I454-A458 PolarHBondContact O-N 2.85Å; Y455-A458 PolarHBondContact O-N 2.73Å
459	Y	88.8	Confident	91	Very high	61 Å²	61	68.4 Å²	68.4	24%	0.239	39%	0.387	C	S	.	.	H	α-helix	trans	-112.3	-8.4	-176.6	-72.1	-72.1	0	0	0	115.1	A310 Y455 V457	A310-Y459 HydrophobicContact CB-CD1 3.34Å; A310-Y459 HydrophobicContact CB-CD2 4.32Å; A310-Y459 HydrophobicContact CB-CE1 3.49Å; A310-Y459 VanDerWaalsContact CB-CE1 3.49Å; A310-Y459 HydrophobicContact CB-CE2 4.44Å; A310-Y459 HydrophobicContact CB-CG 3.79Å; Y455-Y459 AromaticContact CD2-CD2 3.52Å; Y455-Y459 HydrophobicContact CD2-CD2 3.52Å; Y455-Y459 AromaticContact CD2-CE2 3.63Å; Y455-Y459 HydrophobicContact CD2-CE2 3.63Å; Y455-Y459 HydrophobicContact CE1-CD2 4.34Å; Y455-Y459 AromaticContact CE2-CD2 3.32Å; Y455-Y459 HydrophobicContact CE2-CD2 3.32Å; Y455-Y459 AromaticContact CE2-CE2 3.42Å; Y455-Y459 HydrophobicContact CE2-CE2 3.42Å; Y455-Y459 VanDerWaalsContact CE2-CE2 3.42Å; Y455-Y459 HydrophobicContact CE2-CG 4.3Å; Y455-Y459 HydrophobicContact CG-CD2 4.12Å; Y455-Y459 AromaticContact CZ-CD2 3.74Å; Y455-Y459 WeakPolarHBondContact O-CD2 3.41Å; Y455-Y459 PolarHBondContact O-N 2.73Å; V457-Y459 PolarHBondContact O-N 2.71Å
460	T	83.4	Confident	90.7	Very high	64 Å²	64	69.8 Å²	69.8	39%	0.393	39%	0.385	S	S	.	.	H	α-helix	trans	-105.5	-9.8	171.9	64.3	0	0	0	0	114.8	M174 R248 W456	M174-T460 HydrophobicContact SD-CG2 3.46Å; M174-T460 WeakPolarHBondContact SD-CG2 3.34Å; R248-T460 VanDerWaalsContact NH1-CG2 3.34Å; W456-T460 HydrophobicContact CE3-CG2 3.72Å; W456-T460 HydrophobicContact CZ3-CG2 4.29Å; W456-T460 VanDerWaalsContact O-CB 3.3Å; W456-T460 WeakPolarHBondContact O-CB 3.34Å; W456-T460 WeakPolarHBondContact O-CG2 3.3Å; W456-T460 PolarHBondContact O-N 3.3Å; W456-T460 PolarHBondContact O-OG1 3.4Å
461	M	67.4	Low	90.2	Very high	172 Å²	172	70.3 Å²	70.3	85%	0.847	38%	0.384	S	S	*	.			trans	-99.5	0	162.2	-57.6	-140.7	-83.4	0	0	109.9	K171 V457	K171-M461 PolarHBondContact NZ-OXT 3.13Å; V457-M461 HydrophobicContact CG1-CE 3.98Å; V457-M461 PolarHBondContact O-N 3.49Å

Retrieved 461 of 461 residues in 552 ms (Link to these results)

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