A0A087XUE5_POEFO Loading...

Sulfotransferase

AlphaFold DB , UniProt , Accession A0A087XUE5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 380 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	38.4	Very low	36.2	Very low	252 Å²	252	151 Å²	151	100%	1.241	88%	0.878	S	S	*	*				0	114.5	0	-59.8	176.9	-172.7	0	0	106.3
2	G	35.3	Very low	36.5	Very low	73 Å²	73	155.8 Å²	155.8	75%	0.753	88%	0.881	S	S	*	*			cis	116	106.6	22.1	0	0	0	0	0	109.7
3	C	36.4	Very low	36.5	Very low	146 Å²	146	148.5 Å²	148.5	99%	0.986	86%	0.861	S	S	*	*			trans	65.3	147.4	167.1	-65.4	0	0	0	0	118.4
4	G	34	Very low	37.4	Very low	75 Å²	75	152.9 Å²	152.9	77%	0.773	87%	0.865	S	S	*	*			cis	170.3	143.2	7.1	0	0	0	0	0	107.1
5	G	39.2	Very low	38.1	Very low	84 Å²	84	151.7 Å²	151.7	87%	0.866	86%	0.862	S	S	*	*			trans	-81.4	177.7	-163.7	0	0	0	0	0	116.9
6	C	34	Very low	39	Very low	133 Å²	133	150.7 Å²	150.7	90%	0.899	85%	0.852	S	S	*	*			trans	-150	122.5	150.7	-141	0	0	0	0	110.2
7	R	38.5	Very low	40.2	Very low	241 Å²	241	145.4 Å²	145.4	91%	0.909	83%	0.827	S	S	*	*			trans	-76.2	140.6	173.6	-82.1	174.4	169	170.4	-2.5	109.6
8	V	34.7	Very low	41.1	Very low	131 Å²	131	147.9 Å²	147.9	79%	0.794	83%	0.827	S	S	*	*			trans	-132.6	120.3	149.4	-178.7	0	0	0	0	108.8	L10	V8-L10 HydrophobicContact CG1-CG 4.3Å
9	R	37.3	Very low	42.4	Very low	229 Å²	229	145.6 Å²	145.6	86%	0.864	82%	0.816	S	S	*	*			trans	-105.5	106.5	-179.6	-163	-176.5	-164.2	-178.3	4.1	105.7
10	L	36.5	Very low	43.7	Very low	151 Å²	151	141.4 Å²	141.4	79%	0.791	80%	0.797	S	S	*	*			trans	-96.5	103.1	175.5	-86.9	158.7	0	0	0	109.8	V8	V8-L10 HydrophobicContact CG1-CG 4.3Å
11	N	33.5	Very low	45.3	Very low	146 Å²	146	138.1 Å²	138.1	78%	0.781	78%	0.78	S	S	*	*			trans	-69.7	114.6	165.7	-94.4	-25.7	0	0	0	109.3	G13	N11-G13 VanDerWaalsContact C-N 3.35Å; N11-G13 PolarHBondContact O-N 3.22Å
12	F	39.9	Very low	47.3	Very low	209 Å²	209	133.2 Å²	133.2	92%	0.917	75%	0.752	S	S	*	*			trans	-84.7	86.1	158.6	-97.8	-87.9	0	0	0	108.8
13	G	36.3	Very low	49.4	Very low	60 Å²	60	134.9 Å²	134.9	62%	0.619	74%	0.744	S	S	*	*			trans	-67	135.1	172.3	0	0	0	0	0	111.5	N11 V15	N11-G13 VanDerWaalsContact C-N 3.35Å; N11-G13 PolarHBondContact O-N 3.22Å; G13-V15 PolarHBondContact O-N 3.34Å
14	K	49	Very low	51.6	Low	211 Å²	211	131.1 Å²	131.1	92%	0.917	72%	0.716	S	S	*	*			trans	-55.5	111.5	166.4	-71.4	172.9	176.2	174.8	0	110
15	V	47.9	Very low	54.1	Low	135 Å²	135	132.7 Å²	132.7	82%	0.818	71%	0.705	S	S	*	*			trans	-126.8	74.5	156.2	-173.8	0	0	0	0	106.8	G13 S17	G13-V15 PolarHBondContact O-N 3.34Å; V15-S17 PolarHBondContact O-N 2.83Å
16	L	53.3	Low	56.5	Low	135 Å²	135	131.8 Å²	131.8	71%	0.707	68%	0.682	S	S	*	*			trans	-69.2	108.8	157.4	-115.5	90.7	0	0	0	105.6	K18 V21	L16-K18 PolarHBondContact O-N 3.17Å; L16-V21 HydrophobicContact CD2-CG2 4.36Å
17	S	59.3	Low	59	Low	60 Å²	60	130.4 Å²	130.4	42%	0.42	67%	0.665	S	S	.	*			trans	-48.1	127	174.7	174.4	0	0	0	0	109.5	V15 V19 S20	V15-S17 PolarHBondContact O-N 2.83Å; S17-V19 PolarHBondContact O-N 3.31Å; S17-V19 WeakPolarHBondContact OG-CB 3.49Å; S17-V19 WeakPolarHBondContact OG-CG2 3.34Å; S17-V19 PolarHBondContact OG-N 3.18Å; S17-S20 WeakPolarHBondContact O-CB 3.4Å; S17-S20 PolarHBondContact O-N 2.98Å
18	K	56.4	Low	61.4	Low	192 Å²	192	123.9 Å²	123.9	84%	0.835	65%	0.647	S	S	*	*	H	α-helix	trans	-53.4	-21.1	174.6	-72.4	179.5	175.9	176.2	0	112.2	L16 F22	L16-K18 PolarHBondContact O-N 3.17Å; K18-F22 PolarHBondContact O-N 3.01Å
19	V	65.1	Low	64	Low	103 Å²	103	124.1 Å²	124.1	62%	0.624	64%	0.638	S	S	*	*	H	α-helix	trans	-68	-33.7	174.1	-174.4	0	0	0	0	112.3	S17 F22 L23	S17-V19 PolarHBondContact O-N 3.31Å; S17-V19 WeakPolarHBondContact OG-CB 3.49Å; S17-V19 WeakPolarHBondContact OG-CG2 3.34Å; S17-V19 PolarHBondContact OG-N 3.18Å; V19-F22 PolarHBondContact O-N 3.47Å; V19-L23 WeakPolarHBondContact O-CB 3.37Å; V19-L23 PolarHBondContact O-N 3.25Å
20	S	69.3	Low	66.2	Low	61 Å²	61	117 Å²	117	43%	0.427	62%	0.62	S	S	.	*	H	α-helix	trans	-70.6	-39.1	-178.6	179.2	0	0	0	0	112.5	S17 T24	S17-S20 WeakPolarHBondContact O-CB 3.4Å; S17-S20 PolarHBondContact O-N 2.98Å; S20-T24 PolarHBondContact O-N 2.83Å; S20-T24 VanDerWaalsContact O-N 3.13Å; S20-T24 PolarHBondContact O-OG1 3.46Å
21	V	76.6	Confident	68.4	Low	74 Å²	74	117.3 Å²	117.3	45%	0.448	61%	0.612	S	S	.	*	H	α-helix	trans	-71.1	-36.6	176.2	-177.6	0	0	0	0	111.1	L16 T24 M25	L16-V21 HydrophobicContact CD2-CG2 4.36Å; V21-T24 VanDerWaalsContact CA-OG1 3.31Å; V21-T24 WeakPolarHBondContact CA-OG1 3.33Å; V21-T24 PolarHBondContact O-OG1 3.41Å; V21-M25 WeakPolarHBondContact O-CB 3.36Å; V21-M25 VanDerWaalsContact O-CG 3.24Å; V21-M25 WeakPolarHBondContact O-CG 3.47Å; V21-M25 PolarHBondContact O-N 3.07Å
22	F	79.7	Confident	70.8	Confident	148 Å²	148	116 Å²	116	65%	0.649	60%	0.599	S	S	*	*	H	α-helix	trans	-66.3	-43.9	176.2	-170.4	-98.5	0	0	0	111.8	K18 V19 T24 M25 V26	K18-F22 PolarHBondContact O-N 3.01Å; V19-F22 PolarHBondContact O-N 3.47Å; F22-T24 PolarHBondContact O-N 3.46Å; F22-M25 PolarHBondContact O-N 2.96Å; F22-V26 HydrophobicContact CD1-CG2 4.18Å; F22-V26 HydrophobicContact CE1-CG2 3.87Å; F22-V26 HydrophobicContact CZ-CG2 4.21Å; F22-V26 WeakPolarHBondContact O-CG2 3.36Å; F22-V26 PolarHBondContact O-N 3.32Å
23	L	80.3	Confident	72.7	Confident	109 Å²	109	111.7 Å²	111.7	57%	0.571	58%	0.58	S	S	*	*	H	α-helix	trans	-63.8	-41.1	178.4	-158.1	86.5	0	0	0	112.1	V19 V26 L27	V19-L23 WeakPolarHBondContact O-CB 3.37Å; V19-L23 PolarHBondContact O-N 3.25Å; L23-V26 PolarHBondContact O-N 3.08Å; L23-L27 WeakPolarHBondContact O-CG 3.3Å; L23-L27 PolarHBondContact O-N 2.94Å
24	T	82.7	Confident	74.7	Confident	66 Å²	66	115.1 Å²	115.1	41%	0.405	58%	0.576	S	S	.	*	H	α-helix	trans	-67	-37.9	176.6	36.3	0	0	0	0	112.3	S20 V21 F22 L27 I28	S20-T24 PolarHBondContact O-N 2.83Å; S20-T24 VanDerWaalsContact O-N 3.13Å; S20-T24 PolarHBondContact O-OG1 3.46Å; V21-T24 VanDerWaalsContact CA-OG1 3.31Å; V21-T24 WeakPolarHBondContact CA-OG1 3.33Å; V21-T24 PolarHBondContact O-OG1 3.41Å; F22-T24 PolarHBondContact O-N 3.46Å; T24-L27 PolarHBondContact O-N 3.44Å; T24-I28 VanDerWaalsContact O-CG1 3.3Å; T24-I28 WeakPolarHBondContact O-CG1 3.35Å; T24-I28 PolarHBondContact O-N 3.03Å
25	M	86.2	Confident	75.7	Confident	109 Å²	109	107.6 Å²	107.6	54%	0.537	55%	0.549	S	S	.	.	H	α-helix	trans	-63.9	-43	173.3	-73.4	-73.9	104.2	0	0	112	V21 F22 I28 F29	V21-M25 WeakPolarHBondContact O-CB 3.36Å; V21-M25 VanDerWaalsContact O-CG 3.24Å; V21-M25 WeakPolarHBondContact O-CG 3.47Å; V21-M25 PolarHBondContact O-N 3.07Å; F22-M25 PolarHBondContact O-N 2.96Å; M25-I28 HydrophobicContact CE-CD1 4.02Å; M25-I28 PolarHBondContact O-N 3.03Å; M25-F29 WeakPolarHBondContact O-CB 3.46Å; M25-F29 PolarHBondContact O-N 3.13Å
26	V	89.8	Confident	76.9	Confident	64 Å²	64	106.4 Å²	106.4	39%	0.388	54%	0.537	S	S	.	.	H	α-helix	trans	-62.5	-44.8	176.8	172.2	0	0	0	0	111	F22 L23 I28 F29 T30	F22-V26 HydrophobicContact CD1-CG2 4.18Å; F22-V26 HydrophobicContact CE1-CG2 3.87Å; F22-V26 HydrophobicContact CZ-CG2 4.21Å; F22-V26 WeakPolarHBondContact O-CG2 3.36Å; F22-V26 PolarHBondContact O-N 3.32Å; L23-V26 PolarHBondContact O-N 3.08Å; V26-I28 PolarHBondContact O-N 2.75Å; V26-F29 PolarHBondContact O-N 3.37Å; V26-T30 HydrophobicContact CG1-CG2 4.34Å; V26-T30 WeakPolarHBondContact O-CG2 3.46Å; V26-T30 PolarHBondContact O-N 3.26Å; V26-T30 PolarHBondContact O-OG1 2.9Å; V26-T30 VanDerWaalsContact O-OG1 3.08Å
27	L	87.6	Confident	77.6	Confident	105 Å²	105	103.6 Å²	103.6	55%	0.55	53%	0.533	S	S	.	.	H	α-helix	trans	-61.4	-43.4	178.5	-73.1	169.4	0	0	0	112.4	L23 T24 T30 Y31	L23-L27 WeakPolarHBondContact O-CG 3.3Å; L23-L27 PolarHBondContact O-N 2.94Å; T24-L27 PolarHBondContact O-N 3.44Å; L27-T30 WeakPolarHBondContact CA-OG1 3.32Å; L27-T30 PolarHBondContact O-N 3.46Å; L27-T30 PolarHBondContact O-OG1 3.35Å; L27-Y31 WeakPolarHBondContact O-CB 3.31Å; L27-Y31 PolarHBondContact O-N 3Å
28	I	88.6	Confident	77.6	Confident	103 Å²	103	103.9 Å²	103.9	53%	0.528	55%	0.546	S	S	.	.	H	α-helix	trans	-65.1	-42.1	176.9	-68.4	167.1	0	0	0	110.7	T24 M25 V26 Y31 F32	T24-I28 VanDerWaalsContact O-CG1 3.3Å; T24-I28 WeakPolarHBondContact O-CG1 3.35Å; T24-I28 PolarHBondContact O-N 3.03Å; M25-I28 HydrophobicContact CE-CD1 4.02Å; M25-I28 PolarHBondContact O-N 3.03Å; V26-I28 PolarHBondContact O-N 2.75Å; I28-Y31 PolarHBondContact O-N 2.97Å; I28-F32 WeakPolarHBondContact O-CB 3.24Å; I28-F32 PolarHBondContact O-N 2.97Å
29	F	88	Confident	77.5	Confident	136 Å²	136	100.8 Å²	100.8	60%	0.596	54%	0.538	S	S	*	.	H	α-helix	trans	-64	-45.4	177.5	-126.5	-110.1	0	0	0	111.2	M25 V26 Y31 F32 F33	M25-F29 WeakPolarHBondContact O-CB 3.46Å; M25-F29 PolarHBondContact O-N 3.13Å; V26-F29 PolarHBondContact O-N 3.37Å; F29-Y31 VanDerWaalsContact C-N 3.32Å; F29-Y31 PolarHBondContact O-N 3.47Å; F29-F32 PolarHBondContact O-N 3.47Å; F29-F33 AromaticContact CD1-CD2 3.91Å; F29-F33 HydrophobicContact CD1-CD2 3.91Å; F29-F33 AromaticContact CD1-CE2 3.49Å; F29-F33 HydrophobicContact CD1-CE2 3.49Å; F29-F33 VanDerWaalsContact CD1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CD2 4.36Å; F29-F33 AromaticContact CE1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CE2 3.49Å; F29-F33 VanDerWaalsContact CE1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CZ 4.35Å; F29-F33 HydrophobicContact CG-CE2 4.48Å; F29-F33 HydrophobicContact CZ-CE2 4.46Å; F29-F33 VanDerWaalsContact O-CD2 3.29Å; F29-F33 WeakPolarHBondContact O-CD2 3.33Å; F29-F33 PolarHBondContact O-N 3.42Å
30	T	84.4	Confident	76.7	Confident	80 Å²	80	101 Å²	101	49%	0.491	54%	0.542	S	S	.	.	H	α-helix	trans	-62.8	-38.6	176.6	51.7	0	0	0	0	112.3	V26 L27 F33 Y34	V26-T30 HydrophobicContact CG1-CG2 4.34Å; V26-T30 WeakPolarHBondContact O-CG2 3.46Å; V26-T30 PolarHBondContact O-N 3.26Å; V26-T30 PolarHBondContact O-OG1 2.9Å; V26-T30 VanDerWaalsContact O-OG1 3.08Å; L27-T30 WeakPolarHBondContact CA-OG1 3.32Å; L27-T30 PolarHBondContact O-N 3.46Å; L27-T30 PolarHBondContact O-OG1 3.35Å; T30-F33 PolarHBondContact O-N 3.36Å; T30-Y34 WeakPolarHBondContact O-CB 3.29Å; T30-Y34 PolarHBondContact O-N 3.25Å
31	Y	83.1	Confident	75.5	Confident	158 Å²	158	105.2 Å²	105.2	62%	0.62	56%	0.56	S	S	*	*	H	α-helix	trans	-67.5	-40.3	175.9	-176.2	-101.4	0	0	0	111.7	L27 I28 F29 Y34 C35	L27-Y31 WeakPolarHBondContact O-CB 3.31Å; L27-Y31 PolarHBondContact O-N 3Å; I28-Y31 PolarHBondContact O-N 2.97Å; F29-Y31 VanDerWaalsContact C-N 3.32Å; F29-Y31 PolarHBondContact O-N 3.47Å; Y31-Y34 WeakPolarHBondContact O-CB 3.45Å; Y31-Y34 PolarHBondContact O-N 2.96Å; Y31-C35 PolarHBondContact O-N 3.3Å; Y31-C35 PolarHBondContact O-SG 2.89Å
32	F	83.8	Confident	73.8	Confident	117 Å²	117	107.6 Å²	107.6	51%	0.513	58%	0.58	S	S	.	*	H	α-helix	trans	-62.4	-43.6	175.6	-174.9	-105.1	0	0	0	111.9	I28 F29 C35 L36	I28-F32 WeakPolarHBondContact O-CB 3.24Å; I28-F32 PolarHBondContact O-N 2.97Å; F29-F32 PolarHBondContact O-N 3.47Å; F32-C35 PolarHBondContact O-N 3.36Å; F32-L36 HydrophobicContact CD1-CD1 3.66Å; F32-L36 HydrophobicContact CD1-CG 4.46Å; F32-L36 HydrophobicContact CE1-CD1 3.25Å; F32-L36 HydrophobicContact CE1-CG 4.23Å; F32-L36 HydrophobicContact CE2-CD1 4.43Å; F32-L36 HydrophobicContact CG-CD1 4.42Å; F32-L36 HydrophobicContact CZ-CD1 3.69Å; F32-L36 HydrophobicContact CZ-CG 4.33Å; F32-L36 WeakPolarHBondContact O-CB 3.36Å; F32-L36 VanDerWaalsContact O-CG 3.32Å; F32-L36 WeakPolarHBondContact O-CG 3.32Å; F32-L36 PolarHBondContact O-N 2.88Å
33	F	79	Confident	71.6	Confident	120 Å²	120	105 Å²	105	53%	0.526	59%	0.586	S	S	.	*	H	α-helix	trans	-68.3	-34.8	174.3	-83.9	-76.4	0	0	0	113	F29 T30 L36 A37	F29-F33 AromaticContact CD1-CD2 3.91Å; F29-F33 HydrophobicContact CD1-CD2 3.91Å; F29-F33 AromaticContact CD1-CE2 3.49Å; F29-F33 HydrophobicContact CD1-CE2 3.49Å; F29-F33 VanDerWaalsContact CD1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CD2 4.36Å; F29-F33 AromaticContact CE1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CE2 3.49Å; F29-F33 VanDerWaalsContact CE1-CE2 3.49Å; F29-F33 HydrophobicContact CE1-CZ 4.35Å; F29-F33 HydrophobicContact CG-CE2 4.48Å; F29-F33 HydrophobicContact CZ-CE2 4.46Å; F29-F33 VanDerWaalsContact O-CD2 3.29Å; F29-F33 WeakPolarHBondContact O-CD2 3.33Å; F29-F33 PolarHBondContact O-N 3.42Å; T30-F33 PolarHBondContact O-N 3.36Å; F33-L36 PolarHBondContact O-N 2.86Å; F33-A37 WeakPolarHBondContact O-CB 3.49Å; F33-A37 PolarHBondContact O-N 3.25Å
34	Y	77.6	Confident	69.6	Low	132 Å²	132	106 Å²	106	52%	0.518	60%	0.599	S	S	.	*	H	α-helix	trans	-62	-43.5	172.1	-178.6	-93.9	0	0	0	111.8	T30 Y31 A37	T30-Y34 WeakPolarHBondContact O-CB 3.29Å; T30-Y34 PolarHBondContact O-N 3.25Å; Y31-Y34 WeakPolarHBondContact O-CB 3.45Å; Y31-Y34 PolarHBondContact O-N 2.96Å; Y34-A37 PolarHBondContact O-N 3.42Å
35	C	71	Confident	67.1	Low	52 Å²	52	114.5 Å²	114.5	35%	0.351	62%	0.624	S	S	.	*	H	α-helix	trans	-67.6	-34	175.6	-67.5	0	0	0	0	113.1	Y31 F32	Y31-C35 PolarHBondContact O-N 3.3Å; Y31-C35 PolarHBondContact O-SG 2.89Å; F32-C35 PolarHBondContact O-N 3.36Å
36	L	72.3	Confident	64.5	Low	111 Å²	111	116.1 Å²	116.1	58%	0.581	64%	0.64	S	S	*	*	H	α-helix	trans	-77	-23.3	177.6	-72.6	176.8	0	0	0	113.5	F32 F33 G38	F32-L36 HydrophobicContact CD1-CD1 3.66Å; F32-L36 HydrophobicContact CD1-CG 4.46Å; F32-L36 HydrophobicContact CE1-CD1 3.25Å; F32-L36 HydrophobicContact CE1-CG 4.23Å; F32-L36 HydrophobicContact CE2-CD1 4.43Å; F32-L36 HydrophobicContact CG-CD1 4.42Å; F32-L36 HydrophobicContact CZ-CD1 3.69Å; F32-L36 HydrophobicContact CZ-CG 4.33Å; F32-L36 WeakPolarHBondContact O-CB 3.36Å; F32-L36 VanDerWaalsContact O-CG 3.32Å; F32-L36 WeakPolarHBondContact O-CG 3.32Å; F32-L36 PolarHBondContact O-N 2.88Å; F33-L36 PolarHBondContact O-N 2.86Å; L36-G38 PolarHBondContact O-N 2.98Å
37	A	69.9	Low	61.6	Low	75 Å²	75	120.8 Å²	120.8	62%	0.62	66%	0.662	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.7	6.3	178	0	0	0	0	0	114.3	F33 Y34 L39	F33-A37 WeakPolarHBondContact O-CB 3.49Å; F33-A37 PolarHBondContact O-N 3.25Å; Y34-A37 PolarHBondContact O-N 3.42Å; A37-L39 PolarHBondContact O-N 3.36Å
38	G	57.4	Low	58.7	Low	66 Å²	66	126.8 Å²	126.8	68%	0.68	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	75.4	23.8	162.8	0	0	0	0	0	116.9	L36	L36-G38 PolarHBondContact O-N 2.98Å
39	L	55	Low	55.8	Low	127 Å²	127	126.3 Å²	126.3	67%	0.665	69%	0.685	S	S	*	*			trans	-106.1	46.5	175.6	-83.1	153.7	0	0	0	112.8	A37	A37-L39 PolarHBondContact O-N 3.36Å
40	C	49.3	Very low	52.9	Low	107 Å²	107	128.8 Å²	128.8	72%	0.723	70%	0.698	S	S	*	*			trans	-103.4	73	163.3	-81.3	0	0	0	0	109.4
41	D	43.2	Very low	50.2	Low	151 Å²	151	134.1 Å²	134.1	81%	0.807	72%	0.717	S	S	*	*			trans	-112.9	103.2	159.4	-161.5	13.2	0	0	0	106.8
42	S	40.6	Very low	47.6	Very low	123 Å²	123	131 Å²	131	86%	0.86	73%	0.725	S	S	*	*			trans	173.9	85.5	164.2	-77.4	0	0	0	0	111.3
43	A	34.9	Very low	44.9	Very low	95 Å²	95	130.3 Å²	130.3	79%	0.785	74%	0.741	S	S	*	*			trans	-162.8	141.9	141.9	0	0	0	0	0	110.8
44	P	37.2	Very low	42.3	Very low	128 Å²	128	132.3 Å²	132.3	83%	0.831	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-87.4	144.8	-153.6	30.3	-26.1	0	0	0	114.3
45	R	31	Very low	39.9	Very low	245 Å²	245	129.4 Å²	129.4	93%	0.925	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-75.4	128.6	168.7	-78.4	-175.9	171.2	178.4	-1.6	110.5
46	T	30.5	Very low	37.7	Very low	144 Å²	144	130.5 Å²	130.5	88%	0.883	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-75.7	121.8	163.2	36.7	0	0	0	0	110.1
47	L	30.4	Very low	35.5	Very low	162 Å²	162	136.6 Å²	136.6	85%	0.848	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-66.6	133.3	167.6	-80.5	149.9	0	0	0	110.2
48	Y	26.8	Very low	33.4	Very low	230 Å²	230	140.5 Å²	140.5	90%	0.902	82%	0.815	S	S	*	*			trans	-154.7	111.6	133	-128.9	-92	0	0	0	112.1
49	S	27.2	Very low	32	Very low	93 Å²	93	144.9 Å²	144.9	65%	0.65	82%	0.822	S	S	*	*			trans	52.9	102.3	146.2	-152.3	0	0	0	0	121.1
50	Q	26.4	Very low	30.8	Very low	189 Å²	189	147.3 Å²	147.3	88%	0.883	84%	0.835	S	S	*	*			trans	-76.4	129.3	145.4	-82.5	173.7	-49.4	0	0	109.7
51	Q	27.1	Very low	29.7	Very low	191 Å²	191	149.6 Å²	149.6	89%	0.893	84%	0.84	S	S	*	*			trans	-128.3	120.2	138.2	-106.5	173.5	-29.9	0	0	107.1
52	A	28.8	Very low	29	Very low	94 Å²	94	147.7 Å²	147.7	78%	0.777	83%	0.83	S	S	*	*			trans	-83.7	-179.6	179.8	0	0	0	0	0	111.4
53	A	27.2	Very low	28.4	Very low	102 Å²	102	153.6 Å²	153.6	84%	0.843	83%	0.833	S	S	*	*			trans	92.7	132.6	180	0	0	0	0	0	112
54	D	25.7	Very low	27.9	Very low	161 Å²	161	154.5 Å²	154.5	86%	0.861	83%	0.834	S	S	*	*			cis	-179.4	153.4	1.7	-179.7	20	0	0	0	104.5
55	G	25.9	Very low	27.5	Very low	71 Å²	71	156.9 Å²	156.9	73%	0.732	83%	0.834	S	S	*	*			trans	56	138.7	153.9	0	0	0	0	0	122.5
56	G	25.3	Very low	27.3	Very low	75 Å²	75	151.1 Å²	151.1	77%	0.773	83%	0.826	S	S	*	*			trans	110.1	88.4	144.8	0	0	0	0	0	116.5
57	Y	25.6	Very low	27.3	Very low	239 Å²	239	151.5 Å²	151.5	94%	0.937	82%	0.822	S	S	*	*			trans	-69.4	120.9	148.5	-89.5	-95.1	0	0	0	107.9
58	D	27	Very low	27.3	Very low	158 Å²	158	150.2 Å²	150.2	85%	0.845	82%	0.82	S	S	*	*			trans	-133.3	123.6	159.9	-94.8	-34.6	0	0	0	111.6
59	N	27.3	Very low	27.3	Very low	157 Å²	157	145.9 Å²	145.9	84%	0.84	81%	0.813	S	S	*	*			trans	-62.6	141.5	163.8	-94.9	-45.5	0	0	0	109.4
60	L	28.7	Very low	27.2	Very low	178 Å²	178	148.7 Å²	148.7	93%	0.932	82%	0.819	S	S	*	*			trans	-116.2	99	155.3	-76.7	168.3	0	0	0	107.4
61	D	27.6	Very low	27.3	Very low	155 Å²	155	151.5 Å²	151.5	83%	0.829	82%	0.822	S	S	*	*			trans	-111.5	147.2	154.6	-143	0.8	0	0	0	106.7
62	D	29	Very low	27.7	Very low	112 Å²	112	147.9 Å²	147.9	60%	0.599	82%	0.815	S	S	*	*			trans	136.7	114.4	146.5	-160.2	18.9	0	0	0	114.2	S64	D62-S64 PolarHBondContact OD1-N 3.38Å
63	R	26.4	Very low	28	Very low	247 Å²	247	149.1 Å²	149.1	93%	0.932	82%	0.815	S	S	*	*				-162.6	90.8	120.1	-112.5	179.6	146.8	156.6	-3.7	112.1
64	S	25.4	Very low	28.5	Very low	114 Å²	114	149.9 Å²	149.9	80%	0.797	81%	0.812	S	S	*	*			trans	-144.5	108.2	147.4	41.7	0	0	0	0	110	D62	D62-S64 PolarHBondContact OD1-N 3.38Å
65	Q	28.1	Very low	29	Very low	178 Å²	178	148.2 Å²	148.2	83%	0.832	81%	0.81	S	S	*	*			trans	-120	135.5	172.4	-124.6	179	9.6	0	0	109.2
66	V	28	Very low	29.1	Very low	124 Å²	124	153.4 Å²	153.4	75%	0.752	81%	0.814	S	S	*	*				174.1	114.8	127.6	150.7	0	0	0	0	111.5
67	L	29.3	Very low	29.4	Very low	152 Å²	152	158.8 Å²	158.8	80%	0.796	82%	0.819	S	S	*	*			trans	62.2	140.6	148.2	-83.7	110.2	0	0	0	120.5
68	V	29.7	Very low	29.8	Very low	135 Å²	135	153.2 Å²	153.2	82%	0.818	81%	0.812	S	S	*	*			cis	-151.1	158.6	30.5	178.9	0	0	0	0	110.9
69	D	26.7	Very low	29.7	Very low	139 Å²	139	149.4 Å²	149.4	74%	0.743	81%	0.81	S	S	*	*			trans	-91.4	173.3	-166.5	-152	-5.6	0	0	0	116.6
70	L	25.4	Very low	29.7	Very low	151 Å²	151	147 Å²	147	79%	0.791	81%	0.812	S	S	*	*			trans	101.7	97.5	158.7	-54.6	172	0	0	0	121.1
71	R	30.2	Very low	29.7	Very low	248 Å²	248	147.4 Å²	147.4	94%	0.936	81%	0.809	S	S	*	*				179.5	155.6	119.6	-100.4	-179.2	-170	164.5	5.6	114.7
72	P	35.2	Very low	29.6	Very low	115 Å²	115	151.9 Å²	151.9	75%	0.747	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-89.3	171.4	-158.2	36.8	-36.1	0	0	0	115.8
73	P	34.5	Very low	29.5	Very low	120 Å²	120	154.8 Å²	154.8	78%	0.779	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-91.6	159.7	-164.5	37	-33.3	0	0	0	114
74	P	37.8	Very low	29.5	Very low	119 Å²	119	150.1 Å²	150.1	77%	0.773	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-95.5	160.1	167.2	36.3	-29.2	0	0	0	112.4
75	P	36.6	Very low	29.6	Very low	126 Å²	126	152.6 Å²	152.6	82%	0.818	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-85.3	156.1	-168.1	33.8	-33.7	0	0	0	114.3
76	H	27.2	Very low	29.5	Very low	179 Å²	179	152.8 Å²	152.8	83%	0.829	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-68.1	144.6	169.3	-78.6	-79.4	0	0	0	113
77	H	32.6	Very low	29.4	Very low	189 Å²	189	158.2 Å²	158.2	88%	0.875	82%	0.821	S	S	*	*			trans	-160.6	160.7	133.1	-96	-46.1	0	0	0	111.5
78	P	33	Very low	29.5	Very low	121 Å²	121	156.3 Å²	156.3	79%	0.786	82%	0.816	S	S	*	*			trans	-112	163.9	-141.6	40	-31	0	0	0	114.6
79	G	24.9	Very low	29.7	Very low	79 Å²	79	154.1 Å²	154.1	81%	0.814	81%	0.812	S	S	*	*			trans	105.1	106.8	147.3	0	0	0	0	0	116.6
80	A	28	Very low	30.2	Very low	106 Å²	106	151.9 Å²	151.9	88%	0.876	81%	0.807	S	S	*	*			trans	-167.7	144.8	137.1	0	0	0	0	0	109.7
81	Q	27.5	Very low	30.6	Very low	187 Å²	187	151.2 Å²	151.2	87%	0.874	80%	0.8	S	S	*	*			trans	-69.3	145.1	-157.7	-73.6	140.9	-45.8	0	0	115.6	Q83	Q81-Q83 PolarHBondContact O-N 3.07Å
82	R	25.9	Very low	30.7	Very low	248 Å²	248	144.3 Å²	144.3	94%	0.936	78%	0.782	S	S	*	*			trans	-59.8	118.9	162.4	-76.5	175.3	171.3	-175.2	-3.2	110.3
83	Q	27.4	Very low	30.9	Very low	174 Å²	174	142.5 Å²	142.5	81%	0.813	78%	0.776	S	S	*	*			trans	-102.6	110.8	151.4	-83.6	-172.9	-11.6	0	0	109.2	Q81 H85	Q81-Q83 PolarHBondContact O-N 3.07Å; Q83-H85 PolarHBondContact O-N 3.26Å
84	L	25.4	Very low	31.2	Very low	149 Å²	149	142.6 Å²	142.6	78%	0.78	77%	0.77	S	S	*	*			trans	-77.2	94	176.3	-166.5	84.6	0	0	0	108.8	K86	L84-K86 PolarHBondContact O-N 3.32Å
85	H	27.8	Very low	31.1	Very low	166 Å²	166	142.2 Å²	142.2	77%	0.769	76%	0.757	S	S	*	*			trans	-88.8	99.9	165.1	-92.1	4.2	0	0	0	109.9	Q83 R87	Q83-H85 PolarHBondContact O-N 3.26Å; H85-R87 PolarHBondContact O-N 3.26Å; H85-R87 VanDerWaalsContact O-N 3.1Å
86	K	26.5	Very low	31.1	Very low	181 Å²	181	140 Å²	140	79%	0.787	74%	0.742	S	S	*	*			trans	-63	104.2	163.9	-80.9	179.8	175.6	177.8	0	108.6	L84 T88	L84-K86 PolarHBondContact O-N 3.32Å; K86-T88 PolarHBondContact O-N 2.84Å
87	R	26.7	Very low	31.7	Very low	238 Å²	238	134.4 Å²	134.4	90%	0.898	72%	0.718	S	S	*	*			trans	-88.9	88.3	164.9	-82.1	-177.9	172.9	-179	-1.3	109.2	H85	H85-R87 PolarHBondContact O-N 3.26Å; H85-R87 VanDerWaalsContact O-N 3.1Å
88	T	30.5	Very low	32.2	Very low	113 Å²	113	127.3 Å²	127.3	69%	0.693	69%	0.691	S	S	*	*			trans	-88.9	93.2	158.3	8.5	0	0	0	0	106.9	K86	K86-T88 PolarHBondContact O-N 2.84Å
89	A	33.2	Very low	32.1	Very low	88 Å²	88	126.7 Å²	126.7	73%	0.727	68%	0.678	S	S	*	*			trans	-146.5	63	175.7	0	0	0	0	0	109.3
90	S	38.9	Very low	32.8	Very low	93 Å²	93	132.1 Å²	132.1	65%	0.65	67%	0.674	S	S	*	*	S	Bend	trans	-155.9	-6.5	171	62.6	0	0	0	0	114.9
91	Q	33.6	Very low	33.3	Very low	137 Å²	137	131.7 Å²	131.7	64%	0.64	65%	0.654	S	S	*	*	S	Bend	trans	-96.7	-35.7	175.5	-75.3	177.2	-36.1	0	0	112.7	A93 L94 Q95	Q91-A93 VanDerWaalsContact C-N 3.33Å; Q91-A93 PolarHBondContact O-N 3.33Å; Q91-L94 PolarHBondContact O-N 2.9Å; Q91-L94 VanDerWaalsContact O-N 3.12Å; Q91-Q95 PolarHBondContact O-N 3.06Å
92	D	32.6	Very low	33.9	Very low	103 Å²	103	129.2 Å²	129.2	55%	0.551	64%	0.642	S	S	*	*	H	α-helix	trans	-63.5	-34.4	-174.4	-59.2	-18.8	0	0	0	113.6	L94 Q95 V96	D92-L94 VanDerWaalsContact C-N 3.27Å; D92-L94 PolarHBondContact O-N 2.96Å; D92-Q95 PolarHBondContact O-N 2.7Å; D92-V96 WeakPolarHBondContact O-CG2 3.49Å; D92-V96 PolarHBondContact O-N 3Å; D92-V96 VanDerWaalsContact O-N 3.13Å
93	A	38.4	Very low	34.2	Very low	76 Å²	76	125.1 Å²	125.1	63%	0.628	63%	0.634	S	S	*	*	H	α-helix	trans	-71.1	-20.8	-179.9	0	0	0	0	0	113.8	Q91	Q91-A93 VanDerWaalsContact C-N 3.33Å; Q91-A93 PolarHBondContact O-N 3.33Å
94	L	40.6	Very low	34.4	Very low	123 Å²	123	125 Å²	125	64%	0.644	63%	0.633	S	S	*	*	H	α-helix	trans	-88.1	-32	175.2	-73.8	164.6	0	0	0	111.6	Q91 D92	Q91-L94 PolarHBondContact O-N 2.9Å; Q91-L94 VanDerWaalsContact O-N 3.12Å; D92-L94 VanDerWaalsContact C-N 3.27Å; D92-L94 PolarHBondContact O-N 2.96Å
95	Q	35.6	Very low	34.9	Very low	111 Å²	111	127.8 Å²	127.8	52%	0.519	64%	0.635	S	S	.	*	H	α-helix	trans	-71.2	-41	178.7	-120.7	167.1	-25.4	0	0	112.4	Q91 D92 D97 A98 E99	Q91-Q95 PolarHBondContact O-N 3.06Å; D92-Q95 PolarHBondContact O-N 2.7Å; Q95-D97 PolarHBondContact O-N 3.31Å; Q95-A98 WeakPolarHBondContact O-CB 3.25Å; Q95-A98 PolarHBondContact O-N 2.68Å; Q95-E99 PolarHBondContact O-N 3.45Å; Q95-E99 VanDerWaalsContact O-N 3.11Å
96	V	37.6	Very low	34.9	Very low	80 Å²	80	127.7 Å²	127.7	49%	0.485	64%	0.635	S	S	.	*	H	α-helix	trans	-63.7	-28.5	179.8	176.3	0	0	0	0	112.6	D92	D92-V96 WeakPolarHBondContact O-CG2 3.49Å; D92-V96 PolarHBondContact O-N 3Å; D92-V96 VanDerWaalsContact O-N 3.13Å
97	D	39.8	Very low	35.3	Very low	61 Å²	61	124.9 Å²	124.9	33%	0.326	64%	0.635	S	S	.	*	H	α-helix	trans	-77.7	-20	174.1	-92	-11.4	0	0	0	112.8	Q95 Q101 K234	Q95-D97 PolarHBondContact O-N 3.31Å; D97-Q101 WeakPolarHBondContact O-CG 3.36Å; D97-K234 VanDerWaalsContact CG-NZ 3.31Å; D97-K234 IonicContact OD1-NZ 2.94Å; D97-K234 PolarHBondContact OD1-NZ 3.12Å; D97-K234 IonicContact OD2-NZ 2.59Å; D97-K234 PolarHBondContact OD2-NZ 2.9Å; D97-K234 VanDerWaalsContact OD2-NZ 3.1Å
98	A	41.4	Very low	35.5	Very low	39 Å²	39	116.7 Å²	116.7	32%	0.322	63%	0.625	S	S	.	*	H	α-helix	trans	-83.9	-41.5	176.4	0	0	0	0	0	112.1	Q95 Q101 Q102	Q95-A98 WeakPolarHBondContact O-CB 3.25Å; Q95-A98 PolarHBondContact O-N 2.68Å; A98-Q101 PolarHBondContact O-N 3.41Å; A98-Q102 PolarHBondContact O-N 3.44Å
99	E	32.5	Very low	35.5	Very low	109 Å²	109	116.4 Å²	116.4	51%	0.509	63%	0.627	S	S	.	*	H	α-helix	trans	-67.8	-37.7	-178.4	-68.7	176.2	168.8	0	0	112.5	Q95 Q101 Q102 Q103	Q95-E99 PolarHBondContact O-N 3.45Å; Q95-E99 VanDerWaalsContact O-N 3.11Å; E99-Q101 VanDerWaalsContact C-N 3.33Å; E99-Q101 PolarHBondContact O-N 3.09Å; E99-Q102 PolarHBondContact O-N 3.26Å; E99-Q103 PolarHBondContact O-N 2.89Å
100	R	39.8	Very low	35.5	Very low	193 Å²	193	118.8 Å²	118.8	73%	0.728	63%	0.632	S	S	*	*	H	α-helix	trans	-72.9	-21.4	175.4	-84.4	-173.7	177	-166.3	0.7	114.3
101	Q	38.6	Very low	35.1	Very low	96 Å²	96	123.7 Å²	123.7	45%	0.449	64%	0.642	S	S	.	*	H	α-helix	trans	-83	-26.8	174.5	-74.9	-179	-17.7	0	0	112	D97 A98 E99	D97-Q101 WeakPolarHBondContact O-CG 3.36Å; A98-Q101 PolarHBondContact O-N 3.41Å; E99-Q101 VanDerWaalsContact C-N 3.33Å; E99-Q101 PolarHBondContact O-N 3.09Å
102	Q	39.1	Very low	35.4	Very low	136 Å²	136	125.2 Å²	125.2	64%	0.636	65%	0.649	S	S	*	*	H	α-helix	trans	-68.8	-36.9	172.5	-79.2	173.5	-22.8	0	0	112.7	A98 E99 Q104 Y105	A98-Q102 PolarHBondContact O-N 3.44Å; E99-Q102 PolarHBondContact O-N 3.26Å; Q102-Q104 PolarHBondContact O-N 3.16Å; Q102-Y105 PolarHBondContact O-N 3.15Å
103	Q	31.5	Very low	35.6	Very low	162 Å²	162	126.1 Å²	126.1	76%	0.757	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.8	-8	179.4	-77.9	179	-12.4	0	0	115.1	E99	E99-Q103 PolarHBondContact O-N 2.89Å
104	Q	32.6	Very low	35.6	Very low	172 Å²	172	129.4 Å²	129.4	80%	0.804	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.6	4	178.7	-148.9	171.5	-4	0	0	113.5	Q102	Q102-Q104 PolarHBondContact O-N 3.16Å
105	Y	35.7	Very low	35.5	Very low	206 Å²	206	129 Å²	129	81%	0.808	67%	0.673	S	S	*	*			trans	-141	64.8	-178.7	-130.6	-92.2	0	0	0	112.4	Q102	Q102-Y105 PolarHBondContact O-N 3.15Å
106	E	28.1	Very low	35.8	Very low	165 Å²	165	130.9 Å²	130.9	77%	0.771	69%	0.685	S	S	*	*			trans	-95.7	124.7	160.7	-80.5	-70	153.2	0	0	108.6	G108	E106-G108 VanDerWaalsContact C-N 3.33Å; E106-G108 PolarHBondContact O-N 3.46Å
107	P	35.7	Very low	35.9	Very low	121 Å²	121	131.8 Å²	131.8	79%	0.786	69%	0.693	S	S	*	*			trans	-78.5	83.9	176.9	30.8	-28.7	0	0	0	109.8
108	G	30.9	Very low	36.2	Very low	67 Å²	67	134.8 Å²	134.8	69%	0.691	71%	0.713	S	S	*	*			trans	-78.6	134.6	173.4	0	0	0	0	0	113	E106	E106-G108 VanDerWaalsContact C-N 3.33Å; E106-G108 PolarHBondContact O-N 3.46Å
109	S	29.3	Very low	36.4	Very low	106 Å²	106	137.8 Å²	137.8	74%	0.741	73%	0.731	S	S	*	*			trans	-21.9	125.6	-178.3	66.6	0	0	0	0	118	K111	S109-K111 PolarHBondContact O-N 3.47Å; S109-K111 VanDerWaalsContact O-N 3.12Å
110	V	32.3	Very low	37.3	Very low	138 Å²	138	137.9 Å²	137.9	84%	0.836	74%	0.736	S	S	*	*			trans	-61.2	109	165.5	-179.6	0	0	0	0	109.2
111	K	30.9	Very low	38.3	Very low	197 Å²	197	133.4 Å²	133.4	86%	0.857	73%	0.729	S	S	*	*			trans	-100.3	116.1	152.1	-81.2	-172.3	175.6	-177.6	0	107.3	S109 T113	S109-K111 PolarHBondContact O-N 3.47Å; S109-K111 VanDerWaalsContact O-N 3.12Å; K111-T113 PolarHBondContact O-N 3.47Å
112	E	39.9	Very low	40.4	Very low	169 Å²	169	137 Å²	137	79%	0.79	74%	0.74	S	S	*	*			trans	-55.8	124.1	168.4	-71.4	177.7	140.3	0	0	109.6
113	T	36.8	Very low	42.9	Very low	122 Å²	122	131.8 Å²	131.8	75%	0.748	72%	0.722	S	S	*	*				170.8	138.7	116.4	35.1	0	0	0	0	112	K111	K111-T113 PolarHBondContact O-N 3.47Å
114	N	38.3	Very low	45.9	Very low	145 Å²	145	127.8 Å²	127.8	78%	0.775	71%	0.709	S	S	*	*	S	Bend	trans	87.7	109.3	151.9	-62.3	-15.3	0	0	0	121.3
115	S	39.4	Very low	49	Very low	113 Å²	113	123 Å²	123	79%	0.79	69%	0.686	S	S	*	*			trans	68.5	73.7	152.8	58.5	0	0	0	0	119.7	P117	S115-P117 WeakPolarHBondContact O-CD 3.37Å
116	I	42.4	Very low	52	Low	152 Å²	152	116.2 Å²	116.2	78%	0.779	66%	0.66	S	S	*	*			trans	-64.4	123	152.5	-59	174.1	0	0	0	107.8	V118	I116-V118 PolarHBondContact O-N 3.38Å
117	P	39.8	Very low	55.3	Low	99 Å²	99	110.9 Å²	110.9	64%	0.643	64%	0.637	S	S	*	*			trans	-64.8	124.8	175	24.6	-29.1	0	0	0	109.1	S115 S119	S115-P117 WeakPolarHBondContact O-CD 3.37Å; P117-S119 PolarHBondContact O-N 3.25Å
118	V	44.3	Very low	58.3	Low	123 Å²	123	105.2 Å²	105.2	75%	0.745	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-59.5	2.3	-173.4	179.9	0	0	0	0	114.2	I116 N120	I116-V118 PolarHBondContact O-N 3.38Å; V118-N120 PolarHBondContact O-N 2.92Å
119	S	46.7	Very low	61.3	Low	102 Å²	102	105.5 Å²	105.5	71%	0.713	59%	0.586	S	S	*	*	G	3₁₀ helix	trans	-80.9	-10	-175.7	177.1	0	0	0	0	115.3	P117	P117-S119 PolarHBondContact O-N 3.25Å
120	N	51.7	Low	64.6	Low	112 Å²	112	100.5 Å²	100.5	60%	0.599	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-115.2	15	-163	-137.2	30.4	0	0	0	116	V118	V118-N120 PolarHBondContact O-N 2.92Å
121	T	61.3	Low	67.8	Low	98 Å²	98	94 Å²	94	60%	0.601	51%	0.511	S	S	*	.	S	Bend	trans	-93.1	-17.9	-179.2	41.5	0	0	0	0	114.2
122	Y	80.9	Confident	71	Confident	173 Å²	173	84.6 Å²	84.6	68%	0.678	47%	0.471	S	S	*	.	S	Bend	trans	-82.9	149.2	-177.2	-59.6	-80	0	0	0	112.5
123	G	91.8	Very high	73.8	Confident	25 Å²	25	76.5 Å²	76.5	26%	0.258	43%	0.433	S	S	.	.	S	Bend	trans	87.9	176.7	-179.8	0	0	0	0	0	114.8	R180 T181	G123-R180 PolarHBondContact O-NH1 3.49Å; G123-T181 VanDerWaalsContact CA-O 3.24Å; G123-T181 WeakPolarHBondContact CA-O 3.45Å
124	T	96.3	Very high	76.8	Confident	78 Å²	78	70.7 Å²	70.7	48%	0.479	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	153	-177.3	55.9	0	0	0	0	111	K126 R180 T181	T124-K126 WeakPolarHBondContact OG1-CE 3.42Å; T124-R180 WeakPolarHBondContact O-CA 3.48Å; T124-T181 PolarHBondContact N-O 3.09Å; T124-T181 PolarHBondContact O-N 3.09Å; T124-T181 PolarHBondContact O-OG1 3.26Å
125	K	97.5	Very high	79.6	Confident	72 Å²	72	63.9 Å²	63.9	31%	0.313	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.9	117.6	172.5	-67.1	-171.3	175.2	-177.9	0	108.8	R175 N176 M178 R180	K125-R175 HydrophobicContact CB-CG 4.25Å; K125-N176 PolarHBondContact NZ-O 2.71Å; K125-M178 VanDerWaalsContact CD-O 3.23Å; K125-M178 WeakPolarHBondContact CD-O 3.35Å; K125-M178 VanDerWaalsContact CE-O 3.22Å; K125-M178 WeakPolarHBondContact CE-O 3.19Å; K125-M178 WeakPolarHBondContact CG-O 3.36Å; K125-R180 HydrophobicContact CG-CG 3.97Å
126	K	97	Very high	82.5	Confident	63 Å²	63	61.8 Å²	61.8	27%	0.274	34%	0.337	S	S	.	.			trans	-109.8	151.2	178.9	-60.5	180	-176.6	174.6	0	109.1	T124 M178 D183	T124-K126 WeakPolarHBondContact OG1-CE 3.42Å; K126-M178 WeakPolarHBondContact O-CB 3.49Å; K126-M178 WeakPolarHBondContact O-CG 3.47Å; K126-D183 IonicContact NZ-OD1 3.09Å; K126-D183 PolarHBondContact NZ-OD1 2.9Å
127	L	98.4	Very high	85.1	Confident	54 Å²	54	56.1 Å²	56.1	28%	0.283	31%	0.307	S	S	.	.			trans	-65.2	151.7	168.1	-71.4	171	0	0	0	109.6	N129 Y174 R175 M207	L127-N129 PolarHBondContact O-N 3.47Å; L127-Y174 HydrophobicContact CD2-CD1 3.62Å; L127-Y174 HydrophobicContact CD2-CE1 4.19Å; L127-R175 HydrophobicContact CD2-CB 3.87Å; L127-R175 HydrophobicContact CG-CB 4.41Å; L127-M207 HydrophobicContact CB-SD 4.15Å; L127-M207 HydrophobicContact CD1-CG 3.9Å; L127-M207 HydrophobicContact CD1-SD 4.03Å; L127-M207 HydrophobicContact CD2-SD 4.01Å; L127-M207 HydrophobicContact CG-SD 4.3Å
128	P	98	Very high	87.9	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.013	28%	0.279	C	S	.	.			trans	-68.4	129.6	-175.8	25.1	-31	0	0	0	112	I131 Y174 M178 T187 E189 M207	P128-I131 HydrophobicContact CB-CG1 4.17Å; P128-I131 HydrophobicContact CG-CD1 4.2Å; P128-I131 HydrophobicContact CG-CG1 4.13Å; P128-Y174 HydrophobicContact CG-CE1 3.75Å; P128-Y174 VanDerWaalsContact CG-OH 3.3Å; P128-Y174 WeakPolarHBondContact CG-OH 3.46Å; P128-M178 HydrophobicContact CB-SD 4.48Å; P128-M178 HydrophobicContact CG-SD 4.32Å; P128-T187 CarbonylContact C-O 3.51Å; P128-T187 VanDerWaalsContact CA-O 3.22Å; P128-T187 WeakPolarHBondContact CA-O 3.31Å; P128-T187 WeakPolarHBondContact CB-O 3.44Å; P128-E189 HydrophobicContact CB-CG 4.42Å; P128-E189 HydrophobicContact CG-CG 4.19Å; P128-M207 HydrophobicContact CG-CE 4.43Å
129	N	93.9	Very high	90.5	Very high	73 Å²	73	47 Å²	47	39%	0.39	26%	0.256	S	S	.	.	S	Bend	trans	-80.8	-24.3	174.7	-56.2	91.3	0	0	0	111.8	L127 I186 T187 T211 K212	L127-N129 PolarHBondContact O-N 3.47Å; N129-I186 HydrophobicContact CB-CG2 4.29Å; N129-T187 PolarHBondContact N-O 3.27Å; N129-T187 VanDerWaalsContact N-O 3.09Å; N129-T211 WeakPolarHBondContact O-CA 3.36Å; N129-K212 PolarHBondContact O-N 2.96Å
130	A	98.7	Very high	93	Very high	1 Å²	1	42.6 Å²	42.6	1%	0.008	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	140.1	177.1	0	0	0	0	0	111.3	I186 M188 K212 L305	A130-I186 HydrophobicContact CB-CG2 4.43Å; A130-M188 HydrophobicContact CB-CE 3.92Å; A130-M188 HydrophobicContact CB-CG 4.23Å; A130-M188 HydrophobicContact CB-SD 4.49Å; A130-M188 WeakPolarHBondContact O-CA 3.45Å; A130-K212 CarbonylContact C-O 3.4Å; A130-K212 WeakPolarHBondContact CA-O 3.29Å; A130-K212 HydrophobicContact CB-CB 4Å; A130-L305 HydrophobicContact CB-CD2 3.44Å; A130-L305 VanDerWaalsContact CB-CD2 3.44Å
131	I	98.9	Very high	95.2	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	131.3	-176.1	-54.7	177.6	0	0	0	109.9	P128 I133 F163 E189 Y194 V204 M207 T211 K212 I214	P128-I131 HydrophobicContact CB-CG1 4.17Å; P128-I131 HydrophobicContact CG-CD1 4.2Å; P128-I131 HydrophobicContact CG-CG1 4.13Å; I131-I133 HydrophobicContact CB-CG2 4.01Å; I131-I133 HydrophobicContact CG2-CG2 3.6Å; I131-I133 PolarHBondContact O-N 3.26Å; I131-F163 HydrophobicContact CD1-CE2 3.88Å; I131-E189 HydrophobicContact CG1-CG 4.28Å; I131-E189 HydrophobicContact CG2-CG 4.02Å; I131-Y194 HydrophobicContact CG2-CD2 4.09Å; I131-Y194 HydrophobicContact CG2-CE2 4.14Å; I131-V204 HydrophobicContact CD1-CG1 4.09Å; I131-M207 HydrophobicContact CD1-CE 4.25Å; I131-T211 HydrophobicContact CD1-CG2 3.94Å; I131-T211 HydrophobicContact CG1-CG2 3.93Å; I131-K212 PolarHBondContact N-O 3.23Å; I131-I214 PolarHBondContact O-N 3.18Å
132	I	98.9	Very high	96.9	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	95.8	167.4	-56.6	168	0	0	0	108	T140 L143 L144 L147 M188 E189 K190 T191 I214 V216	I132-T140 HydrophobicContact CG2-CG2 3.71Å; I132-L143 HydrophobicContact CD1-CB 4.43Å; I132-L143 HydrophobicContact CD1-CD2 3.79Å; I132-L143 HydrophobicContact CD1-CG 3.98Å; I132-L143 HydrophobicContact CG1-CD2 4.14Å; I132-L144 HydrophobicContact CD1-CB 4.01Å; I132-L144 HydrophobicContact CD1-CD1 3.95Å; I132-L147 HydrophobicContact CD1-CD1 4.46Å; I132-M188 HydrophobicContact CG1-CE 4.29Å; I132-E189 PolarHBondContact N-O 3.04Å; I132-K190 HydrophobicContact CB-CB 3.66Å; I132-K190 HydrophobicContact CD1-CB 4.3Å; I132-K190 HydrophobicContact CG1-CB 4.48Å; I132-K190 HydrophobicContact CG2-CB 4.16Å; I132-K190 WeakPolarHBondContact O-CA 3.2Å; I132-T191 PolarHBondContact O-N 3.3Å; I132-I214 CarbonylContact C-O 3.57Å; I132-I214 WeakPolarHBondContact CA-O 3.39Å; I132-I214 HydrophobicContact CG1-CB 4.14Å; I132-I214 HydrophobicContact CG1-CD1 4.41Å; I132-I214 HydrophobicContact CG1-CG2 4.5Å; I132-V216 HydrophobicContact CG2-CG2 4.25Å
133	I	98.9	Very high	97.7	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	-14.2	-171.4	59	171.1	0	0	0	113.6	I131 T191 P192 Y194 F195 L213 I214 V215 W273 F282	I131-I133 HydrophobicContact CB-CG2 4.01Å; I131-I133 HydrophobicContact CG2-CG2 3.6Å; I131-I133 PolarHBondContact O-N 3.26Å; I133-T191 CarbonylContact C-O 3.6Å; I133-P192 CarbonylContact O-C 3.55Å; I133-P192 WeakPolarHBondContact O-CA 3.19Å; I133-Y194 HydrophobicContact CG2-CD2 4.25Å; I133-F195 HydrophobicContact CD1-CD2 3.99Å; I133-F195 HydrophobicContact CG1-CD2 4.37Å; I133-F195 WeakPolarHBondContact O-CB 3.25Å; I133-F195 PolarHBondContact O-N 3.44Å; I133-L213 HydrophobicContact CD1-CB 4.12Å; I133-L213 HydrophobicContact CD1-CD2 4.5Å; I133-L213 HydrophobicContact CG2-CD2 3.81Å; I133-I214 PolarHBondContact N-O 3.31Å; I133-V215 HydrophobicContact CD1-CG2 3.87Å; I133-V215 HydrophobicContact CG1-CG2 3.82Å; I133-W273 HydrophobicContact CB-CH2 4.18Å; I133-W273 HydrophobicContact CB-CZ2 4.15Å; I133-W273 HydrophobicContact CD1-CD2 3.77Å; I133-W273 HydrophobicContact CD1-CE3 3.92Å; I133-W273 HydrophobicContact CD1-CH2 3.75Å; I133-W273 HydrophobicContact CD1-CZ2 3.6Å; I133-W273 HydrophobicContact CD1-CZ3 3.9Å; I133-W273 HydrophobicContact CG1-CZ2 4.44Å; I133-W273 HydrophobicContact CG2-CH2 3.77Å; I133-W273 HydrophobicContact CG2-CZ2 4.25Å; I133-W273 HydrophobicContact CG2-CZ3 4.39Å; I133-F282 HydrophobicContact CD1-CE1 4.13Å
134	G	98.8	Very high	98.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	179.5	-179	-173.1	0	0	0	0	0	115	T140 V215 V216	G134-T140 VanDerWaalsContact O-CG2 3.23Å; G134-T140 WeakPolarHBondContact O-CG2 3.45Å; G134-V215 CarbonylContact O-C 3.54Å; G134-V215 WeakPolarHBondContact O-CA 3.41Å; G134-V216 PolarHBondContact O-N 3.46Å
135	V	98.8	Very high	98.1	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.006	13%	0.125	C	C	.	.			cis	-99.1	159.2	-11.3	-55	0	0	0	0	111.4	K137 G138 F195 V215 V216 R223 I263 Y266	V135-K137 PolarHBondContact O-N 3.11Å; V135-K137 VanDerWaalsContact O-N 3.14Å; V135-G138 PolarHBondContact O-N 3.36Å; V135-F195 HydrophobicContact CG1-CB 4.49Å; V135-F195 HydrophobicContact CG1-CD1 3.4Å; V135-F195 HydrophobicContact CG1-CE1 3.68Å; V135-F195 HydrophobicContact CG1-CG 4Å; V135-V215 HydrophobicContact CG1-CG1 3.78Å; V135-V216 WeakPolarHBondContact CG2-O 3.35Å; V135-V216 PolarHBondContact N-O 3.4Å; V135-R223 HydrophobicContact CG2-CG 4.41Å; V135-I263 HydrophobicContact CB-CG2 4.48Å; V135-Y266 HydrophobicContact CB-CE1 4.35Å; V135-Y266 HydrophobicContact CG1-CD1 4.14Å; V135-Y266 HydrophobicContact CG1-CE1 3.98Å; V135-Y266 HydrophobicContact CG2-CE1 3.89Å
136	K	98.8	Very high	98.1	Very high	69 Å²	69	21.6 Å²	21.6	30%	0.3	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	124.1	172.2	-167.5	-168.6	178.7	-166.2	0	109.1	G138 P192 R223 D227 I263	K136-G138 VanDerWaalsContact C-N 3.3Å; K136-G138 PolarHBondContact O-N 3.33Å; K136-P192 HydrophobicContact CB-CB 4.28Å; K136-R223 WeakPolarHBondContact O-CD 3.42Å; K136-R223 WeakPolarHBondContact O-CG 3.35Å; K136-R223 PolarHBondContact O-NH1 3.25Å; K136-R223 VanDerWaalsContact O-NH1 3.14Å; K136-D227 WeakPolarHBondContact CE-OD1 3.38Å; K136-D227 IonicContact NZ-OD1 3.95Å; K136-D227 PolarHBondContact NZ-OD1 3.28Å; K136-D227 IonicContact NZ-OD2 3.66Å; K136-I263 HydrophobicContact CB-CD1 4.49Å; K136-I263 HydrophobicContact CD-CD1 4.11Å
137	K	98.5	Very high	98.2	Very high	33 Å²	33	18.6 Å²	18.6	14%	0.143	10%	0.098	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.8	6.6	-176.9	-42.1	-57.4	-60.2	-170.2	0	116.6	V135 R223 S226 D227	V135-K137 PolarHBondContact O-N 3.11Å; V135-K137 VanDerWaalsContact O-N 3.14Å; K137-R223 HydrophobicContact CB-CG 3.94Å; K137-S226 VanDerWaalsContact CE-O 3.23Å; K137-S226 WeakPolarHBondContact CE-O 3.44Å; K137-S226 WeakPolarHBondContact CE-OG 3.35Å; K137-D227 HydrophobicContact CG-CB 3.89Å
138	G	98.3	Very high	98.1	Very high	5 Å²	5	18.5 Å²	18.5	5%	0.052	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.4	-25.5	177.4	0	0	0	0	0	114.8	V135 K136 V216	V135-G138 PolarHBondContact O-N 3.36Å; K136-G138 VanDerWaalsContact C-N 3.3Å; K136-G138 PolarHBondContact O-N 3.33Å; G138-V216 WeakPolarHBondContact CA-O 3.43Å; G138-V216 WeakPolarHBondContact O-CG1 3.39Å
139	G	98.2	Very high	98	Very high	26 Å²	26	19.9 Å²	19.9	27%	0.268	10%	0.101	S	C	.	.	T	Hydrogen-bonded Turn	trans	127.3	9.1	-176.6	0	0	0	0	0	114.5	R141 A142 L143	G139-R141 VanDerWaalsContact C-N 3.25Å; G139-R141 PolarHBondContact O-N 2.68Å; G139-R141 VanDerWaalsContact O-N 3.07Å; G139-A142 WeakPolarHBondContact O-CA 3.22Å; G139-A142 WeakPolarHBondContact O-CB 3.23Å; G139-A142 PolarHBondContact O-N 2.83Å; G139-L143 PolarHBondContact O-N 3.19Å; G139-L143 VanDerWaalsContact O-N 3.1Å
140	T	98.5	Very high	98.2	Very high	10 Å²	10	16.5 Å²	16.5	6%	0.061	8%	0.083	C	C	.	.	H	α-helix	trans	-49.3	-38	-176.4	60.2	0	0	0	0	115	I132 G134 L144 K190 P192 V216	I132-T140 HydrophobicContact CG2-CG2 3.71Å; G134-T140 VanDerWaalsContact O-CG2 3.23Å; G134-T140 WeakPolarHBondContact O-CG2 3.45Å; T140-L144 WeakPolarHBondContact O-CB 3.4Å; T140-L144 PolarHBondContact O-N 3.04Å; T140-K190 WeakPolarHBondContact O-CD 3.37Å; T140-P192 HydrophobicContact CG2-CB 4.27Å; T140-P192 HydrophobicContact CG2-CG 4.01Å; T140-P192 WeakPolarHBondContact OG1-CG 3.28Å; T140-V216 HydrophobicContact CG2-CB 4.3Å; T140-V216 HydrophobicContact CG2-CG2 4.26Å
141	R	97.8	Very high	98.1	Very high	68 Å²	68	20.1 Å²	20.1	26%	0.257	11%	0.107	S	C	.	.	H	α-helix	trans	-68.4	-40.1	175.2	-178.5	59.8	-179.2	-150.7	7.4	112.4	G139 E145 G157 L339	G139-R141 VanDerWaalsContact C-N 3.25Å; G139-R141 PolarHBondContact O-N 2.68Å; G139-R141 VanDerWaalsContact O-N 3.07Å; R141-E145 HydrophobicContact CG-CG 4.26Å; R141-E145 VanDerWaalsContact CZ-CD 3.43Å; R141-E145 IonicContact CZ-OE1 3.79Å; R141-E145 IonicContact CZ-OE2 3.96Å; R141-E145 VanDerWaalsContact NE-CD 3.29Å; R141-E145 VanDerWaalsContact NE-CG 3.29Å; R141-E145 IonicContact NE-OE1 3.6Å; R141-E145 PolarHBondContact NE-OE1 3.4Å; R141-E145 IonicContact NE-OE2 3.34Å; R141-E145 IonicContact NH1-OE1 3.84Å; R141-E145 IonicContact NH2-OE1 2.92Å; R141-E145 PolarHBondContact NH2-OE1 3.33Å; R141-E145 IonicContact NH2-OE2 2.94Å; R141-E145 PolarHBondContact NH2-OE2 2.8Å; R141-E145 WeakPolarHBondContact O-CG 3.24Å; R141-E145 PolarHBondContact O-N 3.27Å; R141-E145 VanDerWaalsContact O-N 3.12Å; R141-G157 PolarHBondContact NH1-O 3.35Å; R141-L339 HydrophobicContact CG-CD2 4.27Å
142	A	97.9	Very high	98	Very high	16 Å²	16	23.1 Å²	23.1	13%	0.132	12%	0.123	C	C	.	.	H	α-helix	trans	-62	-50.8	177.2	0	0	0	0	0	109.7	G139 L144 E145 F146 L290 L339	G139-A142 WeakPolarHBondContact O-CA 3.22Å; G139-A142 WeakPolarHBondContact O-CB 3.23Å; G139-A142 PolarHBondContact O-N 2.83Å; A142-L144 PolarHBondContact O-N 3.04Å; A142-E145 PolarHBondContact O-N 3.08Å; A142-F146 HydrophobicContact CB-CE2 4.21Å; A142-F146 HydrophobicContact CB-CZ 4.16Å; A142-F146 WeakPolarHBondContact O-CB 3.3Å; A142-F146 VanDerWaalsContact O-CD1 3.25Å; A142-F146 WeakPolarHBondContact O-CD1 3.33Å; A142-F146 WeakPolarHBondContact O-CG 3.38Å; A142-F146 PolarHBondContact O-N 2.92Å; A142-L290 HydrophobicContact CB-CD2 4.14Å; A142-L339 HydrophobicContact CB-CD1 3.72Å
143	L	98.6	Very high	98	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-54.7	-49.6	178.8	178.6	63.5	0	0	0	112.3	I132 G139 E145 F146 L147 I214 V216 V285 L290 M298 V301	I132-L143 HydrophobicContact CD1-CB 4.43Å; I132-L143 HydrophobicContact CD1-CD2 3.79Å; I132-L143 HydrophobicContact CD1-CG 3.98Å; I132-L143 HydrophobicContact CG1-CD2 4.14Å; G139-L143 PolarHBondContact O-N 3.19Å; G139-L143 VanDerWaalsContact O-N 3.1Å; L143-E145 PolarHBondContact O-N 3.49Å; L143-F146 PolarHBondContact O-N 3.25Å; L143-L147 HydrophobicContact CD1-CD1 4.11Å; L143-L147 HydrophobicContact CD1-CG 4.26Å; L143-L147 HydrophobicContact CG-CD1 4.03Å; L143-L147 WeakPolarHBondContact O-CB 3.45Å; L143-L147 PolarHBondContact O-N 3.37Å; L143-I214 HydrophobicContact CD2-CG2 3.63Å; L143-V216 HydrophobicContact CB-CG2 4.06Å; L143-V216 HydrophobicContact CD2-CG2 3.37Å; L143-V216 HydrophobicContact CG-CG2 4.33Å; L143-V285 HydrophobicContact CD2-CG2 4.32Å; L143-L290 HydrophobicContact CB-CD2 4.01Å; L143-L290 HydrophobicContact CD1-CD1 4.44Å; L143-M298 HydrophobicContact CD1-SD 3.75Å; L143-V301 HydrophobicContact CD1-CG1 4.41Å; L143-V301 HydrophobicContact CD1-CG2 3.91Å
144	L	98.4	Very high	97.9	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.4	-42.9	-179.1	-170.2	64.1	0	0	0	112.1	I132 T140 A142 F146 L147 R148 A155 K190	I132-L144 HydrophobicContact CD1-CB 4.01Å; I132-L144 HydrophobicContact CD1-CD1 3.95Å; T140-L144 WeakPolarHBondContact O-CB 3.4Å; T140-L144 PolarHBondContact O-N 3.04Å; A142-L144 PolarHBondContact O-N 3.04Å; L144-F146 VanDerWaalsContact C-N 3.31Å; L144-F146 PolarHBondContact O-N 3.3Å; L144-L147 PolarHBondContact O-N 2.98Å; L144-R148 WeakPolarHBondContact O-CG 3.22Å; L144-R148 PolarHBondContact O-N 3.44Å; L144-R148 VanDerWaalsContact O-N 3.08Å; L144-A155 HydrophobicContact CD1-CB 3.57Å; L144-A155 HydrophobicContact CD2-CB 4.39Å; L144-A155 HydrophobicContact CG-CB 4.17Å; L144-K190 HydrophobicContact CB-CD 4.16Å; L144-K190 HydrophobicContact CD2-CB 4.23Å; L144-K190 HydrophobicContact CD2-CD 3.89Å; L144-K190 HydrophobicContact CD2-CG 3.87Å
145	E	97.6	Very high	97.9	Very high	28 Å²	28	26.6 Å²	26.6	13%	0.131	14%	0.137	C	C	.	.	H	α-helix	trans	-69.5	-31.4	179.9	-62.6	-71.9	109.9	0	0	112	R141 A142 L143 R148 L339	R141-E145 HydrophobicContact CG-CG 4.26Å; R141-E145 VanDerWaalsContact CZ-CD 3.43Å; R141-E145 IonicContact CZ-OE1 3.79Å; R141-E145 IonicContact CZ-OE2 3.96Å; R141-E145 VanDerWaalsContact NE-CD 3.29Å; R141-E145 VanDerWaalsContact NE-CG 3.29Å; R141-E145 IonicContact NE-OE1 3.6Å; R141-E145 PolarHBondContact NE-OE1 3.4Å; R141-E145 IonicContact NE-OE2 3.34Å; R141-E145 IonicContact NH1-OE1 3.84Å; R141-E145 IonicContact NH2-OE1 2.92Å; R141-E145 PolarHBondContact NH2-OE1 3.33Å; R141-E145 IonicContact NH2-OE2 2.94Å; R141-E145 PolarHBondContact NH2-OE2 2.8Å; R141-E145 WeakPolarHBondContact O-CG 3.24Å; R141-E145 PolarHBondContact O-N 3.27Å; R141-E145 VanDerWaalsContact O-N 3.12Å; A142-E145 PolarHBondContact O-N 3.08Å; L143-E145 PolarHBondContact O-N 3.49Å; E145-R148 IonicContact OE1-NH1 2.67Å; E145-R148 PolarHBondContact OE1-NH1 2.91Å; E145-L339 HydrophobicContact CB-CD2 4.4Å; E145-L339 HydrophobicContact CG-CD2 4.08Å
146	F	98.1	Very high	97.8	Very high	5 Å²	5	28.8 Å²	28.8	2%	0.022	15%	0.147	C	C	.	.	H	α-helix	trans	-69.8	-46.7	174.7	-62.1	-7.9	0	0	0	110.5	A142 L143 L144 R148 I149 L290 P294 M298 I311 F316 P325 L327	A142-F146 HydrophobicContact CB-CE2 4.21Å; A142-F146 HydrophobicContact CB-CZ 4.16Å; A142-F146 WeakPolarHBondContact O-CB 3.3Å; A142-F146 VanDerWaalsContact O-CD1 3.25Å; A142-F146 WeakPolarHBondContact O-CD1 3.33Å; A142-F146 WeakPolarHBondContact O-CG 3.38Å; A142-F146 PolarHBondContact O-N 2.92Å; L143-F146 PolarHBondContact O-N 3.25Å; L144-F146 VanDerWaalsContact C-N 3.31Å; L144-F146 PolarHBondContact O-N 3.3Å; F146-R148 VanDerWaalsContact C-N 3.29Å; F146-R148 PolarHBondContact O-N 3.39Å; F146-I149 WeakPolarHBondContact O-CB 3.44Å; F146-I149 PolarHBondContact O-N 2.79Å; F146-L290 HydrophobicContact CD2-CD1 3.95Å; F146-L290 HydrophobicContact CE2-CD1 4.13Å; F146-L290 HydrophobicContact CE2-CG 4.27Å; F146-P294 HydrophobicContact CD2-CB 4.39Å; F146-P294 HydrophobicContact CE2-CB 3.99Å; F146-M298 HydrophobicContact CB-CE 4.37Å; F146-M298 HydrophobicContact CB-CG 4.31Å; F146-M298 HydrophobicContact CB-SD 3.69Å; F146-M298 HydrophobicContact CD2-SD 4.48Å; F146-I311 VanDerWaalsContact O-CD1 3.24Å; F146-I311 WeakPolarHBondContact O-CD1 3.49Å; F146-F316 HydrophobicContact CB-CE1 4.18Å; F146-F316 HydrophobicContact CB-CZ 4.26Å; F146-F316 AromaticContact CD1-CE1 3.84Å; F146-F316 HydrophobicContact CD1-CE1 3.84Å; F146-F316 AromaticContact CD2-CE1 3.68Å; F146-F316 HydrophobicContact CD2-CE1 3.68Å; F146-F316 HydrophobicContact CD2-CZ 4.14Å; F146-F316 HydrophobicContact CE1-CE1 4.06Å; F146-F316 AromaticContact CE2-CE1 3.93Å; F146-F316 HydrophobicContact CE2-CE1 3.93Å; F146-F316 AromaticContact CG-CE1 3.63Å; F146-F316 HydrophobicContact CG-CE1 3.63Å; F146-F316 HydrophobicContact CG-CZ 4.15Å; F146-F316 HydrophobicContact CZ-CD1 4.46Å; F146-F316 HydrophobicContact CZ-CE1 4.1Å; F146-P325 HydrophobicContact CZ-CG 4.35Å; F146-L327 HydrophobicContact CD1-CD1 4.11Å; F146-L327 HydrophobicContact CD1-CD2 3.42Å; F146-L327 VanDerWaalsContact CD1-CD2 3.42Å; F146-L327 HydrophobicContact CD1-CG 3.9Å; F146-L327 HydrophobicContact CE1-CD2 3.75Å; F146-L327 HydrophobicContact CE1-CG 4.04Å; F146-L327 HydrophobicContact CG-CD2 4.27Å
147	L	97.5	Very high	97.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-59.5	-36	177.2	-83.1	170	0	0	0	113.8	I132 L143 L144 I149 H150 V153 M188 M298 V301 L305	I132-L147 HydrophobicContact CD1-CD1 4.46Å; L143-L147 HydrophobicContact CD1-CD1 4.11Å; L143-L147 HydrophobicContact CD1-CG 4.26Å; L143-L147 HydrophobicContact CG-CD1 4.03Å; L143-L147 WeakPolarHBondContact O-CB 3.45Å; L143-L147 PolarHBondContact O-N 3.37Å; L144-L147 PolarHBondContact O-N 2.98Å; L147-I149 PolarHBondContact O-N 3.34Å; L147-H150 VanDerWaalsContact O-CB 3.25Å; L147-H150 WeakPolarHBondContact O-CB 3.24Å; L147-H150 PolarHBondContact O-N 2.95Å; L147-V153 HydrophobicContact CB-CG1 4.33Å; L147-M188 HydrophobicContact CD1-CE 3.94Å; L147-M188 HydrophobicContact CD1-SD 4.2Å; L147-M298 HydrophobicContact CB-CE 4.31Å; L147-M298 HydrophobicContact CD2-CE 3.36Å; L147-M298 HydrophobicContact CG-CE 3.61Å; L147-M298 HydrophobicContact CG-SD 4.32Å; L147-V301 HydrophobicContact CD1-CG1 3.89Å; L147-V301 HydrophobicContact CD2-CB 4.46Å; L147-V301 HydrophobicContact CD2-CG1 3.61Å; L147-V301 HydrophobicContact CG-CG1 4.14Å; L147-L305 HydrophobicContact CD1-CD1 4.49Å; L147-L305 HydrophobicContact CD2-CD1 4.04Å
148	R	96.8	Very high	97.3	Very high	52 Å²	52	27.9 Å²	27.9	20%	0.196	16%	0.161	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-9.6	178.7	-76.1	173.4	69	165.4	11	114.6	L144 E145 F146 H150 A155 E331	L144-R148 WeakPolarHBondContact O-CG 3.22Å; L144-R148 PolarHBondContact O-N 3.44Å; L144-R148 VanDerWaalsContact O-N 3.08Å; E145-R148 IonicContact OE1-NH1 2.67Å; E145-R148 PolarHBondContact OE1-NH1 2.91Å; F146-R148 VanDerWaalsContact C-N 3.29Å; F146-R148 PolarHBondContact O-N 3.39Å; R148-H150 VanDerWaalsContact C-N 3.27Å; R148-A155 HydrophobicContact CG-CB 4.01Å; R148-E331 HydrophobicContact CB-CB 4.34Å; R148-E331 IonicContact CZ-OE2 3.93Å; R148-E331 IonicContact NE-OE2 3.86Å; R148-E331 PolarHBondContact NE-OE2 3.27Å; R148-E331 IonicContact NH2-OE2 3.81Å; R148-E331 PolarHBondContact NH2-OE2 3.32Å; R148-E331 WeakPolarHBondContact O-CB 3.49Å; R148-E331 WeakPolarHBondContact O-CG 3.26Å
149	I	96.3	Very high	97.3	Very high	30 Å²	30	30.9 Å²	30.9	15%	0.154	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-25.8	170.3	-64.2	163.7	0	0	0	111.2	F146 L147 I311 H315 L327	F146-I149 WeakPolarHBondContact O-CB 3.44Å; F146-I149 PolarHBondContact O-N 2.79Å; L147-I149 PolarHBondContact O-N 3.34Å; I149-I311 HydrophobicContact CB-CD1 4.35Å; I149-I311 HydrophobicContact CB-CG1 4.37Å; I149-I311 HydrophobicContact CG2-CG1 4.48Å; I149-H315 HydrophobicContact CD1-CB 4.43Å; I149-L327 HydrophobicContact CD1-CB 4.37Å; I149-L327 HydrophobicContact CD1-CD1 3.63Å; I149-L327 HydrophobicContact CD1-CD2 3.26Å; I149-L327 HydrophobicContact CD1-CG 3.9Å; I149-L327 HydrophobicContact CG1-CD1 4.19Å
150	H	97.6	Very high	97.3	Very high	2 Å²	2	30 Å²	30	1%	0.009	16%	0.163	C	C	.	.	S	Bend	trans	-67.6	129.7	-180	-165.6	-77.9	0	0	0	110.2	L147 R148 D152 V153 Q302 K308 I311	L147-H150 VanDerWaalsContact O-CB 3.25Å; L147-H150 WeakPolarHBondContact O-CB 3.24Å; L147-H150 PolarHBondContact O-N 2.95Å; R148-H150 VanDerWaalsContact C-N 3.27Å; H150-D152 IonicContact CE1-OD2 3.28Å; H150-D152 PolarHBondContact CE1-OD2 3.16Å; H150-D152 PolarHBondContact ND1-N 3.18Å; H150-D152 IonicContact ND1-OD2 2.85Å; H150-D152 PolarHBondContact O-N 2.92Å; H150-D152 VanDerWaalsContact O-N 3.16Å; H150-V153 HydrophobicContact CB-CB 4.15Å; H150-V153 HydrophobicContact CB-CG2 3.81Å; H150-V153 PolarHBondContact O-N 3.17Å; H150-Q302 PolarHBondContact CD2-OE1 3.37Å; H150-K308 PolarHBondContact NE2-O 2.9Å; H150-I311 HydrophobicContact CB-CD1 3.88Å; H150-I311 HydrophobicContact CB-CG1 4.35Å
151	P	96.8	Very high	97.3	Very high	78 Å²	78	29.9 Å²	29.9	51%	0.506	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-29.1	-177.2	24.2	-34.6	0	0	0	113.2	Q185	P151-Q185 PolarHBondContact O-NE2 3.39Å
152	D	97.9	Very high	97.3	Very high	63 Å²	63	26.7 Å²	26.7	34%	0.337	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.5	14.4	179.7	-52.5	-39.3	0	0	0	114.3	H150 Q185 I186 L307	H150-D152 IonicContact CE1-OD2 3.28Å; H150-D152 PolarHBondContact CE1-OD2 3.16Å; H150-D152 PolarHBondContact ND1-N 3.18Å; H150-D152 IonicContact ND1-OD2 2.85Å; H150-D152 PolarHBondContact O-N 2.92Å; H150-D152 VanDerWaalsContact O-N 3.16Å; D152-Q185 CarbonylContact O-C 3.58Å; D152-Q185 WeakPolarHBondContact O-CA 3.17Å; D152-I186 PolarHBondContact O-N 3.17Å; D152-L307 HydrophobicContact CB-CD2 3.91Å
153	V	97.9	Very high	97.4	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	125.9	175.5	175.9	0	0	0	0	110.1	L147 H150 M188 L307	L147-V153 HydrophobicContact CB-CG1 4.33Å; H150-V153 HydrophobicContact CB-CB 4.15Å; H150-V153 HydrophobicContact CB-CG2 3.81Å; H150-V153 PolarHBondContact O-N 3.17Å; V153-M188 HydrophobicContact CG1-CG 4.47Å; V153-M188 HydrophobicContact CG1-SD 3.89Å; V153-L307 HydrophobicContact CG2-CD1 3.43Å; V153-L307 VanDerWaalsContact CG2-CD1 3.43Å
154	R	97.7	Very high	97.4	Very high	64 Å²	64	27.5 Å²	27.5	24%	0.242	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	128.3	171.4	-60.6	-65.5	-70.6	154.5	-5.5	108.7	P179 T181 I186 T187 M188 E331	R154-P179 HydrophobicContact CB-CB 4.38Å; R154-P179 HydrophobicContact CB-CG 3.86Å; R154-T181 HydrophobicContact CB-CG2 3.57Å; R154-T181 HydrophobicContact CG-CG2 3.84Å; R154-I186 PolarHBondContact N-O 3.4Å; R154-T187 CarbonylContact O-C 3.36Å; R154-T187 WeakPolarHBondContact O-CA 3.34Å; R154-M188 PolarHBondContact O-N 3.21Å; R154-E331 IonicContact CZ-OE1 3.7Å; R154-E331 IonicContact NH1-OE1 3.3Å; R154-E331 PolarHBondContact NH1-OE1 3.38Å; R154-E331 IonicContact NH1-OE2 3.67Å
155	A	97.3	Very high	97.4	Very high	8 Å²	8	31.9 Å²	31.9	7%	0.066	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	145.6	-175	0	0	0	0	0	113.1	L144 R148 G157 M188	L144-A155 HydrophobicContact CD1-CB 3.57Å; L144-A155 HydrophobicContact CD2-CB 4.39Å; L144-A155 HydrophobicContact CG-CB 4.17Å; R148-A155 HydrophobicContact CG-CB 4.01Å; A155-G157 PolarHBondContact O-N 3.14Å; A155-M188 CarbonylContact C-O 3.53Å; A155-M188 WeakPolarHBondContact CA-O 3.48Å; A155-M188 HydrophobicContact CB-CB 4.2Å
156	F	96.9	Very high	97.4	Very high	47 Å²	47	34.1 Å²	34.1	21%	0.206	18%	0.178	C	C	.	.			trans	-67.7	127.5	166.4	-172.1	-116.4	0	0	0	110.1	A158 P160 L177 M178 M188 E189	F156-A158 HydrophobicContact CD1-CB 4.27Å; F156-A158 HydrophobicContact CE1-CB 3.7Å; F156-A158 HydrophobicContact CZ-CB 4.15Å; F156-P160 HydrophobicContact CD1-CG 3.55Å; F156-P160 HydrophobicContact CE1-CG 3.98Å; F156-P160 HydrophobicContact CG-CG 4.5Å; F156-L177 HydrophobicContact CD2-CB 4.23Å; F156-L177 WeakPolarHBondContact CD2-O 3.4Å; F156-L177 HydrophobicContact CE1-CB 4.43Å; F156-L177 HydrophobicContact CE1-CD1 4.43Å; F156-L177 HydrophobicContact CE2-CB 3.93Å; F156-L177 VanDerWaalsContact CE2-O 3.26Å; F156-L177 WeakPolarHBondContact CE2-O 3.48Å; F156-L177 HydrophobicContact CZ-CB 4.03Å; F156-L177 HydrophobicContact CZ-CD1 4.43Å; F156-L177 HydrophobicContact CZ-CD2 4.19Å; F156-L177 HydrophobicContact CZ-CG 4.45Å; F156-M178 HydrophobicContact CB-CE 4.29Å; F156-M178 HydrophobicContact CB-SD 4.4Å; F156-M188 PolarHBondContact N-O 3.24Å; F156-E189 HydrophobicContact CB-CB 4.41Å
157	G	90.2	Very high	97.4	Very high	28 Å²	28	36.9 Å²	36.9	29%	0.289	19%	0.189	S	C	.	.	S	Bend	trans	-75.3	-26.6	-168.7	0	0	0	0	0	115	R141 A155	R141-G157 PolarHBondContact NH1-O 3.35Å; A155-G157 PolarHBondContact O-N 3.14Å
158	A	96.1	Very high	97.5	Very high	55 Å²	55	44.4 Å²	44.4	46%	0.455	23%	0.229	S	C	.	.	S	Bend	trans	-95.3	-172.9	177.5	0	0	0	0	0	111.3	F156	F156-A158 HydrophobicContact CD1-CB 4.27Å; F156-A158 HydrophobicContact CE1-CB 3.7Å; F156-A158 HydrophobicContact CZ-CB 4.15Å
159	E	98.5	Very high	97.6	Very high	69 Å²	69	50 Å²	50	32%	0.322	25%	0.25	S	S	.	.			trans	-102.4	110.2	173.5	-59.9	-175	172.6	0	0	107.3	H161 K190 P192	E159-H161 VanDerWaalsContact C-N 3.26Å; E159-H161 PolarHBondContact O-CD2 3.18Å; E159-H161 PolarHBondContact O-N 3.05Å; E159-H161 IonicContact OE2-NE2 3.06Å; E159-K190 WeakPolarHBondContact CA-O 3.35Å; E159-K190 HydrophobicContact CG-CG 4.38Å; E159-K190 WeakPolarHBondContact CG-O 3.41Å; E159-K190 IonicContact OE1-NZ 3.68Å; E159-K190 PolarHBondContact OE1-NZ 3.24Å; E159-P192 VanDerWaalsContact CD-CD 3.44Å; E159-P192 WeakPolarHBondContact OE1-CD 3.47Å; E159-P192 WeakPolarHBondContact OE2-CD 3.38Å
160	P	98.3	Very high	97.7	Very high	6 Å²	6	50.1 Å²	50.1	4%	0.039	26%	0.258	C	S	.	.			trans	-59.8	-33.4	-175.2	-28	33.9	0	0	0	114.6	F156 F162 F166 Y174 L177 M178 E189 T191	F156-P160 HydrophobicContact CD1-CG 3.55Å; F156-P160 HydrophobicContact CE1-CG 3.98Å; F156-P160 HydrophobicContact CG-CG 4.5Å; P160-F162 HydrophobicContact CB-CB 4.38Å; P160-F162 PolarHBondContact O-N 2.92Å; P160-F166 WeakPolarHBondContact O-CD2 3.47Å; P160-Y174 HydrophobicContact CB-CD2 4.16Å; P160-Y174 HydrophobicContact CB-CE2 3.72Å; P160-Y174 HydrophobicContact CG-CE2 3.98Å; P160-L177 HydrophobicContact CB-CD1 4.09Å; P160-M178 HydrophobicContact CG-CE 4.28Å; P160-E189 HydrophobicContact CG-CB 3.92Å; P160-E189 HydrophobicContact CG-CG 4.24Å; P160-T191 WeakPolarHBondContact CD-OG1 3.36Å
161	H	98.8	Very high	97.7	Very high	9 Å²	9	53.4 Å²	53.4	4%	0.042	28%	0.276	C	S	.	.			trans	51.9	34.4	-172.3	-72.5	-73	0	0	0	113.9	E159 D164 R165 F166 T191 S193	E159-H161 VanDerWaalsContact C-N 3.26Å; E159-H161 PolarHBondContact O-CD2 3.18Å; E159-H161 PolarHBondContact O-N 3.05Å; E159-H161 IonicContact OE2-NE2 3.06Å; H161-D164 WeakPolarHBondContact CA-OD1 3.47Å; H161-D164 VanDerWaalsContact CB-OD1 3.25Å; H161-D164 WeakPolarHBondContact CB-OD1 3.47Å; H161-D164 IonicContact CE1-OD2 2.7Å; H161-D164 IonicContact CG-OD1 2.68Å; H161-D164 IonicContact CG-OD2 2.79Å; H161-D164 IonicContact ND1-OD1 3.39Å; H161-D164 PolarHBondContact ND1-OD1 3.23Å; H161-D164 IonicContact ND1-OD2 3.31Å; H161-D164 PolarHBondContact ND1-OD2 3.12Å; H161-R165 HydrophobicContact CB-CB 4.1Å; H161-R165 HydrophobicContact CB-CG 4.07Å; H161-R165 PolarHBondContact O-N 2.78Å; H161-F166 HydrophobicContact CB-CD2 3.87Å; H161-F166 HydrophobicContact CB-CE2 3.92Å; H161-F166 WeakPolarHBondContact O-CD2 3.44Å; H161-F166 PolarHBondContact O-N 3.37Å; H161-T191 WeakPolarHBondContact ND1-CG2 3.39Å; H161-S193 PolarHBondContact CE1-OG 3.03Å; H161-S193 VanDerWaalsContact CE1-OG 3.3Å; H161-S193 PolarHBondContact ND1-OG 2.97Å
162	F	98.9	Very high	97.8	Very high	1 Å²	1	54.2 Å²	54.2	0%	0.004	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.7	-52	-178.2	177.6	-114.6	0	0	0	111.2	P160 D164 F166 Y167 G170 L171 W173 Y174 Y194	P160-F162 HydrophobicContact CB-CB 4.38Å; P160-F162 PolarHBondContact O-N 2.92Å; F162-D164 PolarHBondContact O-N 3.18Å; F162-F166 WeakPolarHBondContact CD2-O 3.47Å; F162-F166 CarbonylContact O-C 3.58Å; F162-F166 PolarHBondContact O-N 3.49Å; F162-Y167 HydrophobicContact CD1-CD2 4.3Å; F162-Y167 AromaticContact CE1-CD2 3.71Å; F162-Y167 HydrophobicContact CE1-CD2 3.71Å; F162-Y167 AromaticContact CE1-CE2 3.88Å; F162-Y167 HydrophobicContact CE1-CE2 3.88Å; F162-Y167 HydrophobicContact CE2-CD2 4.25Å; F162-Y167 WeakPolarHBondContact CE2-O 2.97Å; F162-Y167 AromaticContact CZ-CD2 3.69Å; F162-Y167 HydrophobicContact CZ-CD2 3.69Å; F162-Y167 AromaticContact CZ-CE2 3.99Å; F162-Y167 HydrophobicContact CZ-CE2 3.99Å; F162-Y167 WeakPolarHBondContact O-CA 3.34Å; F162-Y167 WeakPolarHBondContact O-CB 3.49Å; F162-Y167 PolarHBondContact O-N 3.25Å; F162-G170 WeakPolarHBondContact CE2-O 3.5Å; F162-L171 HydrophobicContact CE1-CD2 3.67Å; F162-L171 HydrophobicContact CZ-CD2 3.93Å; F162-L171 HydrophobicContact CZ-CG 4.46Å; F162-W173 HydrophobicContact CB-CZ3 4.19Å; F162-W173 AromaticContact CD2-CE3 3.76Å; F162-W173 HydrophobicContact CD2-CE3 3.76Å; F162-W173 AromaticContact CD2-CZ3 3.73Å; F162-W173 HydrophobicContact CD2-CZ3 3.73Å; F162-W173 HydrophobicContact CE2-CE3 4.29Å; F162-W173 HydrophobicContact CG-CZ3 4.38Å; F162-Y174 HydrophobicContact CB-CD2 3.4Å; F162-Y174 HydrophobicContact CB-CE2 3.62Å; F162-Y174 HydrophobicContact CB-CG 3.99Å; F162-Y174 AromaticContact CD1-CD1 3.64Å; F162-Y174 HydrophobicContact CD1-CD1 3.64Å; F162-Y174 AromaticContact CD1-CD2 3.84Å; F162-Y174 HydrophobicContact CD1-CD2 3.84Å; F162-Y174 HydrophobicContact CD1-CE1 4.02Å; F162-Y174 HydrophobicContact CD1-CE2 4.18Å; F162-Y174 AromaticContact CD1-CG 3.52Å; F162-Y174 HydrophobicContact CD1-CG 3.52Å; F162-Y174 HydrophobicContact CD2-CD2 4.3Å; F162-Y174 HydrophobicContact CD2-CG 4.16Å; F162-Y174 AromaticContact CE1-CD1 3.95Å; F162-Y174 HydrophobicContact CE1-CD1 3.95Å; F162-Y174 HydrophobicContact CE1-CG 4.02Å; F162-Y174 HydrophobicContact CG-CD1 4.2Å; F162-Y174 AromaticContact CG-CD2 3.57Å; F162-Y174 HydrophobicContact CG-CD2 3.57Å; F162-Y174 HydrophobicContact CG-CE2 4.12Å; F162-Y174 AromaticContact CG-CG 3.6Å; F162-Y174 HydrophobicContact CG-CG 3.6Å; F162-Y194 PolarHBondContact N-OH 2.95Å
163	F	98.8	Very high	97.8	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-6	-174.5	-62.6	-67.3	0	0	0	114.8	I131 Y167 Y174 Y194 A200 R203 V204 M207	I131-F163 HydrophobicContact CD1-CE2 3.88Å; F163-Y167 HydrophobicContact CD1-CD2 4.01Å; F163-Y167 AromaticContact CD1-CE2 3.96Å; F163-Y167 HydrophobicContact CD1-CE2 3.96Å; F163-Y167 HydrophobicContact CE1-CE2 4.14Å; F163-Y174 AromaticContact CE2-CE1 3.85Å; F163-Y174 HydrophobicContact CE2-CE1 3.85Å; F163-Y174 AromaticContact CE2-CZ 3.82Å; F163-Y174 WeakPolarHBondContact CE2-OH 3.3Å; F163-Y174 AromaticContact CZ-CE1 3.94Å; F163-Y174 HydrophobicContact CZ-CE1 3.94Å; F163-Y194 HydrophobicContact CB-CD1 3.94Å; F163-Y194 HydrophobicContact CB-CE1 3.65Å; F163-Y194 HydrophobicContact CB-CE2 4.31Å; F163-Y194 HydrophobicContact CB-CG 4.4Å; F163-Y194 HydrophobicContact CD2-CD2 4.21Å; F163-Y194 HydrophobicContact CD2-CE1 4.34Å; F163-Y194 AromaticContact CD2-CE2 3.57Å; F163-Y194 HydrophobicContact CD2-CE2 3.57Å; F163-Y194 AromaticContact CD2-CZ 3.65Å; F163-Y194 HydrophobicContact CE2-CE2 4.47Å; F163-Y194 HydrophobicContact CG-CE1 4.48Å; F163-Y194 HydrophobicContact CG-CE2 4.42Å; F163-Y194 PolarHBondContact N-OH 3.07Å; F163-A200 HydrophobicContact CB-CB 4.24Å; F163-R203 HydrophobicContact CD1-CB 3.6Å; F163-R203 HydrophobicContact CE1-CB 4.2Å; F163-R203 WeakPolarHBondContact O-CD 3.32Å; F163-R203 PolarHBondContact O-NH1 3.03Å; F163-V204 HydrophobicContact CB-CG2 4.37Å; F163-V204 HydrophobicContact CD1-CG2 3.95Å; F163-V204 HydrophobicContact CD2-CG2 3.56Å; F163-V204 HydrophobicContact CE1-CG2 4.03Å; F163-V204 HydrophobicContact CE2-CG2 3.7Å; F163-V204 HydrophobicContact CG-CG2 3.69Å; F163-V204 HydrophobicContact CZ-CG2 3.91Å; F163-M207 HydrophobicContact CE1-CB 4.45Å; F163-M207 HydrophobicContact CE2-CE 4.41Å; F163-M207 HydrophobicContact CZ-CB 4.33Å; F163-M207 HydrophobicContact CZ-CE 3.89Å; F163-M207 HydrophobicContact CZ-SD 3.71Å
164	D	98.4	Very high	97.8	Very high	32 Å²	32	55.2 Å²	55.2	17%	0.171	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	-49.1	176.4	62.3	-17.8	0	0	0	113.3	H161 F162 S193 Y194 T197	H161-D164 WeakPolarHBondContact CA-OD1 3.47Å; H161-D164 VanDerWaalsContact CB-OD1 3.25Å; H161-D164 WeakPolarHBondContact CB-OD1 3.47Å; H161-D164 IonicContact CE1-OD2 2.7Å; H161-D164 IonicContact CG-OD1 2.68Å; H161-D164 IonicContact CG-OD2 2.79Å; H161-D164 IonicContact ND1-OD1 3.39Å; H161-D164 PolarHBondContact ND1-OD1 3.23Å; H161-D164 IonicContact ND1-OD2 3.31Å; H161-D164 PolarHBondContact ND1-OD2 3.12Å; F162-D164 PolarHBondContact O-N 3.18Å; D164-S193 WeakPolarHBondContact OD2-CB 3.37Å; D164-S193 PolarHBondContact OD2-OG 3.41Å; D164-Y194 HydrophobicContact CB-CD1 4.14Å; D164-Y194 HydrophobicContact CB-CE1 4.3Å; D164-Y194 WeakPolarHBondContact OD1-CE1 3.14Å; D164-T197 HydrophobicContact CB-CG2 3.81Å; D164-T197 WeakPolarHBondContact CB-OG1 3.34Å
165	R	98.4	Very high	97.9	Very high	93 Å²	93	56.9 Å²	56.9	35%	0.351	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.3	-34.1	-171.8	-57.3	180	-174.6	-172.6	-7	115	H161	H161-R165 HydrophobicContact CB-CB 4.1Å; H161-R165 HydrophobicContact CB-CG 4.07Å; H161-R165 PolarHBondContact O-N 2.78Å
166	F	98.6	Very high	97.9	Very high	74 Å²	74	60.2 Å²	60.2	33%	0.325	30%	0.295	S	S	.	.			trans	-120.4	25.9	-166.5	-56.4	-57.8	0	0	0	113.5	P160 H161 F162 D168 R169 W173	P160-F166 WeakPolarHBondContact O-CD2 3.47Å; H161-F166 HydrophobicContact CB-CD2 3.87Å; H161-F166 HydrophobicContact CB-CE2 3.92Å; H161-F166 WeakPolarHBondContact O-CD2 3.44Å; H161-F166 PolarHBondContact O-N 3.37Å; F162-F166 WeakPolarHBondContact CD2-O 3.47Å; F162-F166 CarbonylContact O-C 3.58Å; F162-F166 PolarHBondContact O-N 3.49Å; F166-D168 PolarHBondContact O-N 2.94Å; F166-R169 HydrophobicContact CB-CG 4.1Å; F166-R169 VanDerWaalsContact O-CB 3.31Å; F166-R169 WeakPolarHBondContact O-CB 3.26Å; F166-R169 WeakPolarHBondContact O-CG 3.44Å; F166-R169 PolarHBondContact O-N 3.04Å; F166-R169 VanDerWaalsContact O-N 3.09Å; F166-W173 HydrophobicContact CB-CH2 3.8Å; F166-W173 HydrophobicContact CB-CZ3 3.87Å; F166-W173 HydrophobicContact CD2-CH2 4.03Å; F166-W173 HydrophobicContact CG-CH2 4.13Å
167	Y	98.6	Very high	98	Very high	64 Å²	64	60 Å²	60	25%	0.251	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-61.1	-35.6	-174.5	-168.7	-114.7	0	0	0	112.2	F162 F163 R169 G170 R203	F162-Y167 HydrophobicContact CD1-CD2 4.3Å; F162-Y167 AromaticContact CE1-CD2 3.71Å; F162-Y167 HydrophobicContact CE1-CD2 3.71Å; F162-Y167 AromaticContact CE1-CE2 3.88Å; F162-Y167 HydrophobicContact CE1-CE2 3.88Å; F162-Y167 HydrophobicContact CE2-CD2 4.25Å; F162-Y167 WeakPolarHBondContact CE2-O 2.97Å; F162-Y167 AromaticContact CZ-CD2 3.69Å; F162-Y167 HydrophobicContact CZ-CD2 3.69Å; F162-Y167 AromaticContact CZ-CE2 3.99Å; F162-Y167 HydrophobicContact CZ-CE2 3.99Å; F162-Y167 WeakPolarHBondContact O-CA 3.34Å; F162-Y167 WeakPolarHBondContact O-CB 3.49Å; F162-Y167 PolarHBondContact O-N 3.25Å; F163-Y167 HydrophobicContact CD1-CD2 4.01Å; F163-Y167 AromaticContact CD1-CE2 3.96Å; F163-Y167 HydrophobicContact CD1-CE2 3.96Å; F163-Y167 HydrophobicContact CE1-CE2 4.14Å; Y167-R169 PolarHBondContact O-N 3Å; Y167-R169 VanDerWaalsContact O-N 3.09Å; Y167-G170 PolarHBondContact O-N 2.89Å; Y167-R203 HydrophobicContact CD1-CG 4.21Å; Y167-R203 HydrophobicContact CD2-CB 4.2Å; Y167-R203 HydrophobicContact CD2-CG 4.13Å; Y167-R203 HydrophobicContact CE1-CG 3.84Å; Y167-R203 HydrophobicContact CE2-CB 3.64Å; Y167-R203 HydrophobicContact CE2-CG 3.78Å; Y167-R203 HydrophobicContact CG-CG 4.34Å
168	D	98.4	Very high	98.4	Very high	157 Å²	157	58.8 Å²	58.8	84%	0.84	28%	0.282	S	S	*	.	G	3₁₀ helix	trans	-66.9	-10.8	-179.8	-53.2	-37.1	0	0	0	113.5	F166 G170	F166-D168 PolarHBondContact O-N 2.94Å; D168-G170 PolarHBondContact O-N 2.64Å
169	R	98.4	Very high	98.4	Very high	171 Å²	171	57.3 Å²	57.3	65%	0.645	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-72.7	-12	172.5	-61.8	-68.7	-169.8	-161.6	0.5	112.9	F166 Y167 W173	F166-R169 HydrophobicContact CB-CG 4.1Å; F166-R169 VanDerWaalsContact O-CB 3.31Å; F166-R169 WeakPolarHBondContact O-CB 3.26Å; F166-R169 WeakPolarHBondContact O-CG 3.44Å; F166-R169 PolarHBondContact O-N 3.04Å; F166-R169 VanDerWaalsContact O-N 3.09Å; Y167-R169 PolarHBondContact O-N 3Å; Y167-R169 VanDerWaalsContact O-N 3.09Å; R169-W173 HydrophobicContact CB-CB 3.79Å; R169-W173 HydrophobicContact CB-CD2 3.57Å; R169-W173 HydrophobicContact CB-CE3 3.76Å; R169-W173 HydrophobicContact CB-CG 3.59Å; R169-W173 HydrophobicContact CG-CD2 4.03Å; R169-W173 HydrophobicContact CG-CE3 4.32Å; R169-W173 HydrophobicContact CG-CG 4.29Å; R169-W173 VanDerWaalsContact O-CB 3.25Å; R169-W173 WeakPolarHBondContact O-CB 2.97Å
170	G	98.4	Very high	98.3	Very high	31 Å²	31	59.2 Å²	59.2	32%	0.32	27%	0.272	S	S	.	.	H	α-helix	trans	78.7	160.9	178.1	0	0	0	0	0	114.6	F162 Y167 D168 E172 W173 Y174	F162-G170 WeakPolarHBondContact CE2-O 3.5Å; Y167-G170 PolarHBondContact O-N 2.89Å; D168-G170 PolarHBondContact O-N 2.64Å; G170-E172 PolarHBondContact O-N 3.33Å; G170-W173 PolarHBondContact O-N 3Å; G170-Y174 PolarHBondContact O-N 3.09Å
171	L	98.4	Very high	98.3	Very high	72 Å²	72	59 Å²	59	38%	0.377	27%	0.271	S	S	.	.	H	α-helix	trans	-63.8	-27.7	-176	-72.7	174	0	0	0	113.5	F162 Y174 R175 M207	F162-L171 HydrophobicContact CE1-CD2 3.67Å; F162-L171 HydrophobicContact CZ-CD2 3.93Å; F162-L171 HydrophobicContact CZ-CG 4.46Å; L171-Y174 PolarHBondContact O-N 2.94Å; L171-R175 WeakPolarHBondContact O-CB 3.19Å; L171-R175 PolarHBondContact O-N 2.85Å; L171-M207 HydrophobicContact CD2-CB 4.2Å; L171-M207 HydrophobicContact CD2-CG 3.83Å; L171-M207 HydrophobicContact CD2-SD 4.06Å
172	E	98.4	Very high	98.2	Very high	95 Å²	95	63.1 Å²	63.1	44%	0.444	29%	0.293	S	S	.	.	H	α-helix	trans	-66.4	-43	178	-174.8	53.2	-141.6	0	0	111.6	G170 Y174 R175 N176	G170-E172 PolarHBondContact O-N 3.33Å; E172-Y174 VanDerWaalsContact C-N 3.31Å; E172-Y174 PolarHBondContact O-N 3Å; E172-R175 PolarHBondContact O-N 3.08Å; E172-R175 IonicContact OE1-CZ 3.27Å; E172-R175 IonicContact OE1-NE 3.37Å; E172-R175 PolarHBondContact OE1-NE 2.93Å; E172-R175 IonicContact OE1-NH2 3.18Å; E172-R175 PolarHBondContact OE1-NH2 3.29Å; E172-R175 IonicContact OE2-CZ 3.77Å; E172-R175 IonicContact OE2-NE 3.09Å; E172-R175 PolarHBondContact OE2-NE 2.96Å; E172-R175 IonicContact OE2-NH2 2.96Å; E172-R175 PolarHBondContact OE2-NH2 2.78Å; E172-N176 WeakPolarHBondContact O-CB 3.44Å; E172-N176 PolarHBondContact O-N 3.29Å; E172-N176 PolarHBondContact O-ND2 3.29Å; E172-N176 PolarHBondContact OE1-ND2 3.18Å
173	W	98.6	Very high	97.9	Very high	84 Å²	84	69.7 Å²	69.7	32%	0.318	33%	0.328	S	S	.	.	H	α-helix	trans	-58.6	-46.3	172.9	175.4	88	0	0	0	110.8	F162 F166 R169 G170 N176 L177	F162-W173 HydrophobicContact CB-CZ3 4.19Å; F162-W173 AromaticContact CD2-CE3 3.76Å; F162-W173 HydrophobicContact CD2-CE3 3.76Å; F162-W173 AromaticContact CD2-CZ3 3.73Å; F162-W173 HydrophobicContact CD2-CZ3 3.73Å; F162-W173 HydrophobicContact CE2-CE3 4.29Å; F162-W173 HydrophobicContact CG-CZ3 4.38Å; F166-W173 HydrophobicContact CB-CH2 3.8Å; F166-W173 HydrophobicContact CB-CZ3 3.87Å; F166-W173 HydrophobicContact CD2-CH2 4.03Å; F166-W173 HydrophobicContact CG-CH2 4.13Å; R169-W173 HydrophobicContact CB-CB 3.79Å; R169-W173 HydrophobicContact CB-CD2 3.57Å; R169-W173 HydrophobicContact CB-CE3 3.76Å; R169-W173 HydrophobicContact CB-CG 3.59Å; R169-W173 HydrophobicContact CG-CD2 4.03Å; R169-W173 HydrophobicContact CG-CE3 4.32Å; R169-W173 HydrophobicContact CG-CG 4.29Å; R169-W173 VanDerWaalsContact O-CB 3.25Å; R169-W173 WeakPolarHBondContact O-CB 2.97Å; G170-W173 PolarHBondContact O-N 3Å; W173-N176 PolarHBondContact O-N 2.93Å; W173-L177 HydrophobicContact CE3-CD1 4.23Å; W173-L177 HydrophobicContact CH2-CD1 3.63Å; W173-L177 HydrophobicContact CZ2-CD1 4.01Å; W173-L177 HydrophobicContact CZ2-CD2 4.49Å; W173-L177 HydrophobicContact CZ3-CD1 3.74Å; W173-L177 PolarHBondContact O-N 3.14Å
174	Y	98.7	Very high	97.7	Very high	0 Å²	0	72.9 Å²	72.9	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-62.9	-45.3	179.3	-178.3	-128.9	0	0	0	112.7	L127 P128 P160 F162 F163 G170 L171 E172 N176 L177 M178 E189 M207	L127-Y174 HydrophobicContact CD2-CD1 3.62Å; L127-Y174 HydrophobicContact CD2-CE1 4.19Å; P128-Y174 HydrophobicContact CG-CE1 3.75Å; P128-Y174 VanDerWaalsContact CG-OH 3.3Å; P128-Y174 WeakPolarHBondContact CG-OH 3.46Å; P160-Y174 HydrophobicContact CB-CD2 4.16Å; P160-Y174 HydrophobicContact CB-CE2 3.72Å; P160-Y174 HydrophobicContact CG-CE2 3.98Å; F162-Y174 HydrophobicContact CB-CD2 3.4Å; F162-Y174 HydrophobicContact CB-CE2 3.62Å; F162-Y174 HydrophobicContact CB-CG 3.99Å; F162-Y174 AromaticContact CD1-CD1 3.64Å; F162-Y174 HydrophobicContact CD1-CD1 3.64Å; F162-Y174 AromaticContact CD1-CD2 3.84Å; F162-Y174 HydrophobicContact CD1-CD2 3.84Å; F162-Y174 HydrophobicContact CD1-CE1 4.02Å; F162-Y174 HydrophobicContact CD1-CE2 4.18Å; F162-Y174 AromaticContact CD1-CG 3.52Å; F162-Y174 HydrophobicContact CD1-CG 3.52Å; F162-Y174 HydrophobicContact CD2-CD2 4.3Å; F162-Y174 HydrophobicContact CD2-CG 4.16Å; F162-Y174 AromaticContact CE1-CD1 3.95Å; F162-Y174 HydrophobicContact CE1-CD1 3.95Å; F162-Y174 HydrophobicContact CE1-CG 4.02Å; F162-Y174 HydrophobicContact CG-CD1 4.2Å; F162-Y174 AromaticContact CG-CD2 3.57Å; F162-Y174 HydrophobicContact CG-CD2 3.57Å; F162-Y174 HydrophobicContact CG-CE2 4.12Å; F162-Y174 AromaticContact CG-CG 3.6Å; F162-Y174 HydrophobicContact CG-CG 3.6Å; F163-Y174 AromaticContact CE2-CE1 3.85Å; F163-Y174 HydrophobicContact CE2-CE1 3.85Å; F163-Y174 AromaticContact CE2-CZ 3.82Å; F163-Y174 WeakPolarHBondContact CE2-OH 3.3Å; F163-Y174 AromaticContact CZ-CE1 3.94Å; F163-Y174 HydrophobicContact CZ-CE1 3.94Å; G170-Y174 PolarHBondContact O-N 3.09Å; L171-Y174 PolarHBondContact O-N 2.94Å; E172-Y174 VanDerWaalsContact C-N 3.31Å; E172-Y174 PolarHBondContact O-N 3Å; Y174-N176 PolarHBondContact O-N 2.81Å; Y174-L177 HydrophobicContact CD2-CD1 4.49Å; Y174-L177 WeakPolarHBondContact O-CB 3.28Å; Y174-L177 PolarHBondContact O-N 2.96Å; Y174-L177 VanDerWaalsContact O-N 3.11Å; Y174-M178 HydrophobicContact CD2-CE 3.88Å; Y174-M178 HydrophobicContact CE2-CE 3.55Å; Y174-E189 VanDerWaalsContact OH-CG 3.28Å; Y174-E189 WeakPolarHBondContact OH-CG 3.49Å; Y174-E189 PolarHBondContact OH-OE1 2.8Å; Y174-M207 HydrophobicContact CD1-SD 4.2Å; Y174-M207 HydrophobicContact CE1-SD 3.83Å
175	R	98.4	Very high	97.7	Very high	98 Å²	98	73.1 Å²	73.1	37%	0.37	36%	0.361	S	S	.	.	H	α-helix	trans	-57.9	-38.5	174.4	-175	179.6	70.1	151.5	-0.6	111.6	K125 L127 L171 E172 L177 M178	K125-R175 HydrophobicContact CB-CG 4.25Å; L127-R175 HydrophobicContact CD2-CB 3.87Å; L127-R175 HydrophobicContact CG-CB 4.41Å; L171-R175 WeakPolarHBondContact O-CB 3.19Å; L171-R175 PolarHBondContact O-N 2.85Å; E172-R175 PolarHBondContact O-N 3.08Å; E172-R175 IonicContact OE1-CZ 3.27Å; E172-R175 IonicContact OE1-NE 3.37Å; E172-R175 PolarHBondContact OE1-NE 2.93Å; E172-R175 IonicContact OE1-NH2 3.18Å; E172-R175 PolarHBondContact OE1-NH2 3.29Å; E172-R175 IonicContact OE2-CZ 3.77Å; E172-R175 IonicContact OE2-NE 3.09Å; E172-R175 PolarHBondContact OE2-NE 2.96Å; E172-R175 IonicContact OE2-NH2 2.96Å; E172-R175 PolarHBondContact OE2-NH2 2.78Å; R175-L177 PolarHBondContact O-N 3.11Å; R175-M178 WeakPolarHBondContact O-CB 3.43Å; R175-M178 PolarHBondContact O-N 2.87Å
176	N	98.1	Very high	97.6	Very high	79 Å²	79	69.8 Å²	69.8	42%	0.422	35%	0.349	S	S	.	.	H	α-helix	trans	-69.9	-16.7	179.8	-77.4	-43.4	0	0	0	114.1	K125 E172 W173 Y174	K125-N176 PolarHBondContact NZ-O 2.71Å; E172-N176 WeakPolarHBondContact O-CB 3.44Å; E172-N176 PolarHBondContact O-N 3.29Å; E172-N176 PolarHBondContact O-ND2 3.29Å; E172-N176 PolarHBondContact OE1-ND2 3.18Å; W173-N176 PolarHBondContact O-N 2.93Å; Y174-N176 PolarHBondContact O-N 2.81Å
177	L	98.1	Very high	97.6	Very high	43 Å²	43	66.2 Å²	66.2	23%	0.225	33%	0.334	C	S	.	.	H	α-helix	trans	-73.9	-29.2	168.6	-59.8	178.9	0	0	0	112.3	F156 P160 W173 Y174 R175	F156-L177 HydrophobicContact CD2-CB 4.23Å; F156-L177 WeakPolarHBondContact CD2-O 3.4Å; F156-L177 HydrophobicContact CE1-CB 4.43Å; F156-L177 HydrophobicContact CE1-CD1 4.43Å; F156-L177 HydrophobicContact CE2-CB 3.93Å; F156-L177 VanDerWaalsContact CE2-O 3.26Å; F156-L177 WeakPolarHBondContact CE2-O 3.48Å; F156-L177 HydrophobicContact CZ-CB 4.03Å; F156-L177 HydrophobicContact CZ-CD1 4.43Å; F156-L177 HydrophobicContact CZ-CD2 4.19Å; F156-L177 HydrophobicContact CZ-CG 4.45Å; P160-L177 HydrophobicContact CB-CD1 4.09Å; W173-L177 HydrophobicContact CE3-CD1 4.23Å; W173-L177 HydrophobicContact CH2-CD1 3.63Å; W173-L177 HydrophobicContact CZ2-CD1 4.01Å; W173-L177 HydrophobicContact CZ2-CD2 4.49Å; W173-L177 HydrophobicContact CZ3-CD1 3.74Å; W173-L177 PolarHBondContact O-N 3.14Å; Y174-L177 HydrophobicContact CD2-CD1 4.49Å; Y174-L177 WeakPolarHBondContact O-CB 3.28Å; Y174-L177 PolarHBondContact O-N 2.96Å; Y174-L177 VanDerWaalsContact O-N 3.11Å; R175-L177 PolarHBondContact O-N 3.11Å
178	M	98.4	Very high	97.6	Very high	1 Å²	1	63.2 Å²	63.2	1%	0.005	32%	0.322	C	S	.	.	S	Bend	trans	-66.3	145.7	-171.3	-61.1	-60.6	122.4	0	0	112.3	K125 K126 P128 F156 P160 Y174 R175 T187 E189	K125-M178 VanDerWaalsContact CD-O 3.23Å; K125-M178 WeakPolarHBondContact CD-O 3.35Å; K125-M178 VanDerWaalsContact CE-O 3.22Å; K125-M178 WeakPolarHBondContact CE-O 3.19Å; K125-M178 WeakPolarHBondContact CG-O 3.36Å; K126-M178 WeakPolarHBondContact O-CB 3.49Å; K126-M178 WeakPolarHBondContact O-CG 3.47Å; P128-M178 HydrophobicContact CB-SD 4.48Å; P128-M178 HydrophobicContact CG-SD 4.32Å; F156-M178 HydrophobicContact CB-CE 4.29Å; F156-M178 HydrophobicContact CB-SD 4.4Å; P160-M178 HydrophobicContact CG-CE 4.28Å; Y174-M178 HydrophobicContact CD2-CE 3.88Å; Y174-M178 HydrophobicContact CE2-CE 3.55Å; R175-M178 WeakPolarHBondContact O-CB 3.43Å; R175-M178 PolarHBondContact O-N 2.87Å; M178-T187 HydrophobicContact CB-CG2 3.9Å; M178-T187 HydrophobicContact CG-CG2 4.06Å; M178-T187 HydrophobicContact SD-CG2 3.9Å; M178-E189 HydrophobicContact CE-CB 4.45Å
179	P	97.1	Very high	97.6	Very high	25 Å²	25	55.7 Å²	55.7	16%	0.162	28%	0.282	C	S	.	.	P	Polyproline II helix	trans	-64.4	153	171.2	29.5	-34.9	0	0	0	110.5	R154 T187	R154-P179 HydrophobicContact CB-CB 4.38Å; R154-P179 HydrophobicContact CB-CG 3.86Å; P179-T187 HydrophobicContact CG-CG2 4.47Å
180	R	96.6	Very high	97.6	Very high	109 Å²	109	47.9 Å²	47.9	41%	0.411	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	138.4	167.3	-70.2	-178.8	180	-85.3	-1.3	109.4	G123 T124 K125	G123-R180 PolarHBondContact O-NH1 3.49Å; T124-R180 WeakPolarHBondContact O-CA 3.48Å; K125-R180 HydrophobicContact CG-CG 3.97Å
181	T	97.1	Very high	97.7	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	148.1	177.9	48.6	0	0	0	0	111.1	G123 T124 R154 Q185 T187	G123-T181 VanDerWaalsContact CA-O 3.24Å; G123-T181 WeakPolarHBondContact CA-O 3.45Å; T124-T181 PolarHBondContact N-O 3.09Å; T124-T181 PolarHBondContact O-N 3.09Å; T124-T181 PolarHBondContact O-OG1 3.26Å; R154-T181 HydrophobicContact CB-CG2 3.57Å; R154-T181 HydrophobicContact CG-CG2 3.84Å; T181-Q185 HydrophobicContact CG2-CB 4.3Å; T181-T187 WeakPolarHBondContact CG2-OG1 3.35Å; T181-T187 PolarHBondContact OG1-OG1 2.91Å
182	L	96.8	Very high	97.7	Very high	94 Å²	94	43.4 Å²	43.4	49%	0.492	22%	0.223	S	C	.	.			trans	-84.1	169.1	166.5	-57.7	178.9	0	0	0	109.7	Q185	L182-Q185 HydrophobicContact CB-CG 4.26Å; L182-Q185 PolarHBondContact O-N 3.36Å
183	D	94.4	Very high	97.7	Very high	140 Å²	140	40.4 Å²	40.4	75%	0.749	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	143.5	173.2	-66.1	-28.6	0	0	0	110.9	K126 Q185	K126-D183 IonicContact NZ-OD1 3.09Å; K126-D183 PolarHBondContact NZ-OD1 2.9Å; D183-Q185 VanDerWaalsContact C-N 3.26Å; D183-Q185 PolarHBondContact O-N 3.11Å
184	G	93.8	Very high	97.7	Very high	66 Å²	66	36.4 Å²	36.4	68%	0.68	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	85.3	-23.8	-170.2	0	0	0	0	0	114.8
185	Q	97.3	Very high	97.7	Very high	37 Å²	37	36.4 Å²	36.4	17%	0.173	20%	0.197	C	C	.	.	P	Polyproline II helix	trans	-79	141	178.5	-56.1	-170.4	-57.3	0	0	112.4	P151 D152 T181 L182 D183	P151-Q185 PolarHBondContact O-NE2 3.39Å; D152-Q185 CarbonylContact O-C 3.58Å; D152-Q185 WeakPolarHBondContact O-CA 3.17Å; T181-Q185 HydrophobicContact CG2-CB 4.3Å; L182-Q185 HydrophobicContact CB-CG 4.26Å; L182-Q185 PolarHBondContact O-N 3.36Å; D183-Q185 VanDerWaalsContact C-N 3.26Å; D183-Q185 PolarHBondContact O-N 3.11Å
186	I	97.6	Very high	97.8	Very high	23 Å²	23	34.2 Å²	34.2	12%	0.118	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	129.6	175.3	-58.3	-178	0	0	0	109.4	N129 A130 D152 R154 M188 L305 L307	N129-I186 HydrophobicContact CB-CG2 4.29Å; A130-I186 HydrophobicContact CB-CG2 4.43Å; D152-I186 PolarHBondContact O-N 3.17Å; R154-I186 PolarHBondContact N-O 3.4Å; I186-M188 HydrophobicContact CG2-CG 3.77Å; I186-M188 HydrophobicContact CG2-SD 4.39Å; I186-L305 HydrophobicContact CD1-CB 3.95Å; I186-L307 HydrophobicContact CD1-CD1 4.19Å; I186-L307 HydrophobicContact CD1-CD2 3.6Å; I186-L307 HydrophobicContact CD1-CG 3.82Å; I186-L307 HydrophobicContact CG1-CD2 4.13Å
187	T	98.4	Very high	97.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	130.6	170.4	-52.2	0	0	0	0	109.8	P128 N129 R154 M178 P179 T181	P128-T187 CarbonylContact C-O 3.51Å; P128-T187 VanDerWaalsContact CA-O 3.22Å; P128-T187 WeakPolarHBondContact CA-O 3.31Å; P128-T187 WeakPolarHBondContact CB-O 3.44Å; N129-T187 PolarHBondContact N-O 3.27Å; N129-T187 VanDerWaalsContact N-O 3.09Å; R154-T187 CarbonylContact O-C 3.36Å; R154-T187 WeakPolarHBondContact O-CA 3.34Å; M178-T187 HydrophobicContact CB-CG2 3.9Å; M178-T187 HydrophobicContact CG-CG2 4.06Å; M178-T187 HydrophobicContact SD-CG2 3.9Å; P179-T187 HydrophobicContact CG-CG2 4.47Å; T181-T187 WeakPolarHBondContact CG2-OG1 3.35Å; T181-T187 PolarHBondContact OG1-OG1 2.91Å
188	M	98.6	Very high	97.8	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	160.6	-177.7	-60	-173.7	70.4	0	0	113.5	A130 I132 L147 V153 R154 A155 F156 I186 I214 L305	A130-M188 HydrophobicContact CB-CE 3.92Å; A130-M188 HydrophobicContact CB-CG 4.23Å; A130-M188 HydrophobicContact CB-SD 4.49Å; A130-M188 WeakPolarHBondContact O-CA 3.45Å; I132-M188 HydrophobicContact CG1-CE 4.29Å; L147-M188 HydrophobicContact CD1-CE 3.94Å; L147-M188 HydrophobicContact CD1-SD 4.2Å; V153-M188 HydrophobicContact CG1-CG 4.47Å; V153-M188 HydrophobicContact CG1-SD 3.89Å; R154-M188 PolarHBondContact O-N 3.21Å; A155-M188 CarbonylContact C-O 3.53Å; A155-M188 WeakPolarHBondContact CA-O 3.48Å; A155-M188 HydrophobicContact CB-CB 4.2Å; F156-M188 PolarHBondContact N-O 3.24Å; I186-M188 HydrophobicContact CG2-CG 3.77Å; I186-M188 HydrophobicContact CG2-SD 4.39Å; M188-I214 HydrophobicContact CE-CD1 3.91Å; M188-L305 HydrophobicContact CE-CD1 4.18Å; M188-L305 HydrophobicContact SD-CD1 3.95Å
189	E	98.7	Very high	97.8	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143	169.9	165.6	64.4	108.6	116.2	0	0	110.7	P128 I131 I132 F156 P160 Y174 M178 T191 Y194	P128-E189 HydrophobicContact CB-CG 4.42Å; P128-E189 HydrophobicContact CG-CG 4.19Å; I131-E189 HydrophobicContact CG1-CG 4.28Å; I131-E189 HydrophobicContact CG2-CG 4.02Å; I132-E189 PolarHBondContact N-O 3.04Å; F156-E189 HydrophobicContact CB-CB 4.41Å; P160-E189 HydrophobicContact CG-CB 3.92Å; P160-E189 HydrophobicContact CG-CG 4.24Å; Y174-E189 VanDerWaalsContact OH-CG 3.28Å; Y174-E189 WeakPolarHBondContact OH-CG 3.49Å; Y174-E189 PolarHBondContact OH-OE1 2.8Å; M178-E189 HydrophobicContact CE-CB 4.45Å; E189-T191 PolarHBondContact OE2-N 3.3Å; E189-T191 PolarHBondContact OE2-OG1 3.37Å; E189-T191 VanDerWaalsContact OE2-OG1 3.07Å; E189-Y194 WeakPolarHBondContact OE1-CE2 3.49Å; E189-Y194 PolarHBondContact OE1-OH 3.07Å
190	K	98.8	Very high	97.9	Very high	6 Å²	6	41.8 Å²	41.8	3%	0.026	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	139.9	164.2	81	177	165.9	44.5	0	110.6	I132 T140 L144 E159	I132-K190 HydrophobicContact CB-CB 3.66Å; I132-K190 HydrophobicContact CD1-CB 4.3Å; I132-K190 HydrophobicContact CG1-CB 4.48Å; I132-K190 HydrophobicContact CG2-CB 4.16Å; I132-K190 WeakPolarHBondContact O-CA 3.2Å; T140-K190 WeakPolarHBondContact O-CD 3.37Å; L144-K190 HydrophobicContact CB-CD 4.16Å; L144-K190 HydrophobicContact CD2-CB 4.23Å; L144-K190 HydrophobicContact CD2-CD 3.89Å; L144-K190 HydrophobicContact CD2-CG 3.87Å; E159-K190 WeakPolarHBondContact CA-O 3.35Å; E159-K190 HydrophobicContact CG-CG 4.38Å; E159-K190 WeakPolarHBondContact CG-O 3.41Å; E159-K190 IonicContact OE1-NZ 3.68Å; E159-K190 PolarHBondContact OE1-NZ 3.24Å
191	T	98.9	Very high	98	Very high	0 Å²	0	36.6 Å²	36.6	0%	0	20%	0.197	C	C	.	.			trans	-147.7	98.3	167.3	-53.8	0	0	0	0	108.6	I132 I133 P160 H161 E189 S193 Y194	I132-T191 PolarHBondContact O-N 3.3Å; I133-T191 CarbonylContact C-O 3.6Å; P160-T191 WeakPolarHBondContact CD-OG1 3.36Å; H161-T191 WeakPolarHBondContact ND1-CG2 3.39Å; E189-T191 PolarHBondContact OE2-N 3.3Å; E189-T191 PolarHBondContact OE2-OG1 3.37Å; E189-T191 VanDerWaalsContact OE2-OG1 3.07Å; T191-S193 WeakPolarHBondContact CG2-OG 3.38Å; T191-S193 PolarHBondContact O-N 2.85Å; T191-S193 VanDerWaalsContact O-N 3.07Å; T191-Y194 HydrophobicContact CG2-CD1 3.67Å; T191-Y194 HydrophobicContact CG2-CD2 4.43Å; T191-Y194 HydrophobicContact CG2-CE1 3.41Å; T191-Y194 VanDerWaalsContact CG2-CE1 3.41Å; T191-Y194 HydrophobicContact CG2-CE2 4.22Å; T191-Y194 HydrophobicContact CG2-CG 4.18Å; T191-Y194 PolarHBondContact O-N 3.31Å; T191-Y194 VanDerWaalsContact O-N 3.11Å; T191-Y194 WeakPolarHBondContact OG1-CE2 3.38Å; T191-Y194 VanDerWaalsContact OG1-CZ 3.28Å; T191-Y194 PolarHBondContact OG1-OH 3.07Å
192	P	98.9	Very high	98.1	Very high	10 Å²	10	38.6 Å²	38.6	7%	0.065	21%	0.211	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-15.5	-169.2	-23.9	34.8	0	0	0	115.9	I133 K136 T140 E159	I133-P192 CarbonylContact O-C 3.55Å; I133-P192 WeakPolarHBondContact O-CA 3.19Å; K136-P192 HydrophobicContact CB-CB 4.28Å; T140-P192 HydrophobicContact CG2-CB 4.27Å; T140-P192 HydrophobicContact CG2-CG 4.01Å; T140-P192 WeakPolarHBondContact OG1-CG 3.28Å; E159-P192 VanDerWaalsContact CD-CD 3.44Å; E159-P192 WeakPolarHBondContact OE1-CD 3.47Å; E159-P192 WeakPolarHBondContact OE2-CD 3.38Å
193	S	98.8	Very high	98.2	Very high	31 Å²	31	36.7 Å²	36.7	22%	0.217	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-19.2	176.7	43.1	0	0	0	0	113.2	H161 D164 T191 F195 V196 T197	H161-S193 PolarHBondContact CE1-OG 3.03Å; H161-S193 VanDerWaalsContact CE1-OG 3.3Å; H161-S193 PolarHBondContact ND1-OG 2.97Å; D164-S193 WeakPolarHBondContact OD2-CB 3.37Å; D164-S193 PolarHBondContact OD2-OG 3.41Å; T191-S193 WeakPolarHBondContact CG2-OG 3.38Å; T191-S193 PolarHBondContact O-N 2.85Å; T191-S193 VanDerWaalsContact O-N 3.07Å; S193-F195 PolarHBondContact O-N 2.96Å; S193-V196 WeakPolarHBondContact O-CG2 3.4Å; S193-V196 PolarHBondContact O-N 3.18Å; S193-T197 PolarHBondContact O-N 3.21Å; S193-T197 PolarHBondContact O-OG1 2.96Å
194	Y	98.9	Very high	98.4	Very high	0 Å²	0	30 Å²	30	0%	0	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-57.5	-40.6	179.3	-67.7	-14.4	0	0	0	111.6	I131 I133 F162 F163 D164 E189 T191 V196 T197 W273	I131-Y194 HydrophobicContact CG2-CD2 4.09Å; I131-Y194 HydrophobicContact CG2-CE2 4.14Å; I133-Y194 HydrophobicContact CG2-CD2 4.25Å; F162-Y194 PolarHBondContact N-OH 2.95Å; F163-Y194 HydrophobicContact CB-CD1 3.94Å; F163-Y194 HydrophobicContact CB-CE1 3.65Å; F163-Y194 HydrophobicContact CB-CE2 4.31Å; F163-Y194 HydrophobicContact CB-CG 4.4Å; F163-Y194 HydrophobicContact CD2-CD2 4.21Å; F163-Y194 HydrophobicContact CD2-CE1 4.34Å; F163-Y194 AromaticContact CD2-CE2 3.57Å; F163-Y194 HydrophobicContact CD2-CE2 3.57Å; F163-Y194 AromaticContact CD2-CZ 3.65Å; F163-Y194 HydrophobicContact CE2-CE2 4.47Å; F163-Y194 HydrophobicContact CG-CE1 4.48Å; F163-Y194 HydrophobicContact CG-CE2 4.42Å; F163-Y194 PolarHBondContact N-OH 3.07Å; D164-Y194 HydrophobicContact CB-CD1 4.14Å; D164-Y194 HydrophobicContact CB-CE1 4.3Å; D164-Y194 WeakPolarHBondContact OD1-CE1 3.14Å; E189-Y194 WeakPolarHBondContact OE1-CE2 3.49Å; E189-Y194 PolarHBondContact OE1-OH 3.07Å; T191-Y194 HydrophobicContact CG2-CD1 3.67Å; T191-Y194 HydrophobicContact CG2-CD2 4.43Å; T191-Y194 HydrophobicContact CG2-CE1 3.41Å; T191-Y194 VanDerWaalsContact CG2-CE1 3.41Å; T191-Y194 HydrophobicContact CG2-CE2 4.22Å; T191-Y194 HydrophobicContact CG2-CG 4.18Å; T191-Y194 PolarHBondContact O-N 3.31Å; T191-Y194 VanDerWaalsContact O-N 3.11Å; T191-Y194 WeakPolarHBondContact OG1-CE2 3.38Å; T191-Y194 VanDerWaalsContact OG1-CZ 3.28Å; T191-Y194 PolarHBondContact OG1-OH 3.07Å; Y194-V196 PolarHBondContact O-N 2.58Å; Y194-T197 PolarHBondContact O-N 3.07Å; Y194-W273 WeakPolarHBondContact O-CZ2 3.35Å
195	F	98.9	Very high	98.6	Very high	1 Å²	1	27.3 Å²	27.3	0%	0.004	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-53.5	-33.5	-177.9	-172.8	-112.5	0	0	0	113.6	I133 V135 S193 V215 Y266 H269 W273	I133-F195 HydrophobicContact CD1-CD2 3.99Å; I133-F195 HydrophobicContact CG1-CD2 4.37Å; I133-F195 WeakPolarHBondContact O-CB 3.25Å; I133-F195 PolarHBondContact O-N 3.44Å; V135-F195 HydrophobicContact CG1-CB 4.49Å; V135-F195 HydrophobicContact CG1-CD1 3.4Å; V135-F195 HydrophobicContact CG1-CE1 3.68Å; V135-F195 HydrophobicContact CG1-CG 4Å; S193-F195 PolarHBondContact O-N 2.96Å; F195-V215 HydrophobicContact CD2-CG1 4.11Å; F195-V215 HydrophobicContact CD2-CG2 4.08Å; F195-V215 HydrophobicContact CE2-CG1 3.99Å; F195-V215 HydrophobicContact CE2-CG2 4.02Å; F195-V215 HydrophobicContact CZ-CG1 4.27Å; F195-Y266 HydrophobicContact CE1-CD1 4.13Å; F195-H269 HydrophobicContact CD1-CB 3.84Å; F195-H269 HydrophobicContact CE1-CB 3.41Å; F195-H269 VanDerWaalsContact CE1-CB 3.41Å; F195-H269 HydrophobicContact CE2-CB 4.35Å; F195-H269 HydrophobicContact CZ-CB 3.69Å; F195-W273 AromaticContact CD2-CD1 3.97Å; F195-W273 AromaticContact CD2-NE1 3.79Å; F195-W273 PolarHBondContact O-NE1 2.6Å
196	V	98.8	Very high	98.7	Very high	52 Å²	52	30.5 Å²	30.5	32%	0.315	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-106	1.1	-178.6	-56.2	0	0	0	0	113.6	S193 Y194 I263	S193-V196 WeakPolarHBondContact O-CG2 3.4Å; S193-V196 PolarHBondContact O-N 3.18Å; Y194-V196 PolarHBondContact O-N 2.58Å; V196-I263 HydrophobicContact CG1-CB 4.41Å; V196-I263 HydrophobicContact CG1-CG1 4.09Å; V196-I263 HydrophobicContact CG1-CG2 4.27Å; V196-I263 HydrophobicContact CG2-CG1 4.47Å
197	T	98.8	Very high	98.7	Very high	22 Å²	22	30.7 Å²	30.7	14%	0.135	16%	0.155	C	C	.	.			trans	-82.5	120.8	177.3	-61.3	0	0	0	0	108.4	D164 S193 Y194 E199 A200 P201	D164-T197 HydrophobicContact CB-CG2 3.81Å; D164-T197 WeakPolarHBondContact CB-OG1 3.34Å; S193-T197 PolarHBondContact O-N 3.21Å; S193-T197 PolarHBondContact O-OG1 2.96Å; Y194-T197 PolarHBondContact O-N 3.07Å; T197-E199 VanDerWaalsContact C-N 3.31Å; T197-E199 PolarHBondContact O-N 2.9Å; T197-A200 HydrophobicContact CG2-CB 3.95Å; T197-A200 PolarHBondContact O-N 3.11Å; T197-P201 WeakPolarHBondContact O-CD 3.4Å
198	R	98.5	Very high	98.7	Very high	195 Å²	195	33.3 Å²	33.3	74%	0.736	17%	0.169	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-42.3	-171.9	-178.8	-176.2	-179.4	-173.6	-0.7	112.3	P201 N272	R198-P201 WeakPolarHBondContact O-CD 3.4Å; R198-N272 PolarHBondContact O-ND2 3.27Å
199	E	98.8	Very high	98.7	Very high	89 Å²	89	42 Å²	42	42%	0.416	20%	0.202	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84	-16.3	-174.5	-56.5	71.7	-155	0	0	112.9	T197 S202 R203	T197-E199 VanDerWaalsContact C-N 3.31Å; T197-E199 PolarHBondContact O-N 2.9Å; E199-S202 PolarHBondContact O-N 2.99Å; E199-R203 HydrophobicContact CB-CG 4.49Å; E199-R203 VanDerWaalsContact O-CG 3.3Å; E199-R203 WeakPolarHBondContact O-CG 3.49Å; E199-R203 PolarHBondContact O-N 2.88Å; E199-R203 VanDerWaalsContact O-N 3.08Å
200	A	98.9	Very high	98.6	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-59.3	-43.3	-172.9	0	0	0	0	0	114	F163 T197 S202 R203 V204 W273	F163-A200 HydrophobicContact CB-CB 4.24Å; T197-A200 HydrophobicContact CG2-CB 3.95Å; T197-A200 PolarHBondContact O-N 3.11Å; A200-S202 PolarHBondContact O-N 3.37Å; A200-R203 PolarHBondContact O-N 2.9Å; A200-V204 VanDerWaalsContact O-CG2 3.24Å; A200-V204 WeakPolarHBondContact O-CG2 3.47Å; A200-V204 PolarHBondContact O-N 3.02Å; A200-W273 HydrophobicContact CB-CH2 4.33Å; A200-W273 HydrophobicContact CB-CZ2 4.12Å
201	P	98.9	Very high	98.6	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-57.6	-47.7	178.4	-23.2	32.2	0	0	0	112.8	T197 R198 R203 V204 C205 N272 W273 Y276 F277	T197-P201 WeakPolarHBondContact O-CD 3.4Å; R198-P201 WeakPolarHBondContact O-CD 3.4Å; P201-R203 PolarHBondContact O-N 3.07Å; P201-V204 PolarHBondContact O-N 3.16Å; P201-C205 WeakPolarHBondContact O-CB 3.38Å; P201-C205 PolarHBondContact O-N 3.31Å; P201-N272 WeakPolarHBondContact CG-ND2 3.35Å; P201-W273 HydrophobicContact CB-CD2 4.01Å; P201-W273 HydrophobicContact CB-CE3 3.87Å; P201-W273 HydrophobicContact CB-CG 4.43Å; P201-W273 HydrophobicContact CB-CZ3 4.25Å; P201-W273 HydrophobicContact CG-CD2 3.6Å; P201-W273 HydrophobicContact CG-CE3 3.95Å; P201-W273 HydrophobicContact CG-CG 3.86Å; P201-W273 HydrophobicContact CG-CH2 4.48Å; P201-W273 HydrophobicContact CG-CZ2 4.15Å; P201-W273 HydrophobicContact CG-CZ3 4.39Å; P201-Y276 HydrophobicContact CB-CD2 3.48Å; P201-Y276 VanDerWaalsContact CB-CD2 3.48Å; P201-Y276 HydrophobicContact CB-CE2 4.11Å; P201-Y276 HydrophobicContact CB-CG 4Å; P201-F277 WeakPolarHBondContact O-CE2 3.41Å
202	S	98.8	Very high	98.6	Very high	44 Å²	44	52 Å²	52	31%	0.308	25%	0.247	S	C	.	.	H	α-helix	trans	-60	-48.1	177.8	-177.5	0	0	0	0	111.2	E199 A200 V204 C205 T206 Y276	E199-S202 PolarHBondContact O-N 2.99Å; A200-S202 PolarHBondContact O-N 3.37Å; S202-V204 PolarHBondContact O-N 3.29Å; S202-C205 WeakPolarHBondContact O-CB 3.33Å; S202-C205 PolarHBondContact O-N 3.4Å; S202-T206 PolarHBondContact O-N 3.22Å; S202-T206 PolarHBondContact O-OG1 2.89Å; S202-T206 VanDerWaalsContact O-OG1 3.09Å; S202-Y276 VanDerWaalsContact CB-CE1 3.46Å
203	R	98.8	Very high	98.6	Very high	55 Å²	55	51.5 Å²	51.5	21%	0.208	24%	0.244	C	C	.	.	H	α-helix	trans	-64.1	-40.4	-178.4	-66	171.3	171.8	170.1	-2.4	112.9	F163 Y167 E199 A200 P201 M207	F163-R203 HydrophobicContact CD1-CB 3.6Å; F163-R203 HydrophobicContact CE1-CB 4.2Å; F163-R203 WeakPolarHBondContact O-CD 3.32Å; F163-R203 PolarHBondContact O-NH1 3.03Å; Y167-R203 HydrophobicContact CD1-CG 4.21Å; Y167-R203 HydrophobicContact CD2-CB 4.2Å; Y167-R203 HydrophobicContact CD2-CG 4.13Å; Y167-R203 HydrophobicContact CE1-CG 3.84Å; Y167-R203 HydrophobicContact CE2-CB 3.64Å; Y167-R203 HydrophobicContact CE2-CG 3.78Å; Y167-R203 HydrophobicContact CG-CG 4.34Å; E199-R203 HydrophobicContact CB-CG 4.49Å; E199-R203 VanDerWaalsContact O-CG 3.3Å; E199-R203 WeakPolarHBondContact O-CG 3.49Å; E199-R203 PolarHBondContact O-N 2.88Å; E199-R203 VanDerWaalsContact O-N 3.08Å; A200-R203 PolarHBondContact O-N 2.9Å; P201-R203 PolarHBondContact O-N 3.07Å; R203-M207 PolarHBondContact O-N 3.01Å; R203-M207 VanDerWaalsContact O-N 3.16Å
204	V	98.9	Very high	98.6	Very high	0 Å²	0	50 Å²	50	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-68.5	-41.5	176.2	179.9	0	0	0	0	110.4	I131 F163 A200 P201 S202 T206 M207 N208 T211 L213 W273 F277	I131-V204 HydrophobicContact CD1-CG1 4.09Å; F163-V204 HydrophobicContact CB-CG2 4.37Å; F163-V204 HydrophobicContact CD1-CG2 3.95Å; F163-V204 HydrophobicContact CD2-CG2 3.56Å; F163-V204 HydrophobicContact CE1-CG2 4.03Å; F163-V204 HydrophobicContact CE2-CG2 3.7Å; F163-V204 HydrophobicContact CG-CG2 3.69Å; F163-V204 HydrophobicContact CZ-CG2 3.91Å; A200-V204 VanDerWaalsContact O-CG2 3.24Å; A200-V204 WeakPolarHBondContact O-CG2 3.47Å; A200-V204 PolarHBondContact O-N 3.02Å; P201-V204 PolarHBondContact O-N 3.16Å; S202-V204 PolarHBondContact O-N 3.29Å; V204-T206 PolarHBondContact O-N 3.39Å; V204-M207 WeakPolarHBondContact O-CB 3.2Å; V204-M207 PolarHBondContact O-N 3.28Å; V204-M207 VanDerWaalsContact O-N 3.15Å; V204-N208 PolarHBondContact O-N 2.59Å; V204-T211 HydrophobicContact CG1-CG2 3.95Å; V204-L213 HydrophobicContact CG1-CD2 4.25Å; V204-W273 HydrophobicContact CG2-CH2 4.28Å; V204-F277 HydrophobicContact CB-CE2 4.27Å; V204-F277 HydrophobicContact CB-CZ 4.22Å; V204-F277 HydrophobicContact CG1-CE2 4.27Å; V204-F277 HydrophobicContact CG1-CZ 3.83Å
205	C	98.7	Very high	98.6	Very high	9 Å²	9	50 Å²	50	6%	0.061	23%	0.234	C	C	.	.	H	α-helix	trans	-61.3	-42.3	177	-173.4	0	0	0	0	111.8	P201 S202 M207 N208 R209 Y276 F277	P201-C205 WeakPolarHBondContact O-CB 3.38Å; P201-C205 PolarHBondContact O-N 3.31Å; S202-C205 WeakPolarHBondContact O-CB 3.33Å; S202-C205 PolarHBondContact O-N 3.4Å; C205-M207 VanDerWaalsContact C-N 3.32Å; C205-M207 PolarHBondContact O-N 3.21Å; C205-N208 CarbonylContact O-C 3.37Å; C205-N208 PolarHBondContact O-N 2.94Å; C205-R209 WeakPolarHBondContact O-CG 3.46Å; C205-R209 PolarHBondContact O-N 3.23Å; C205-Y276 HydrophobicContact CB-CD1 4.25Å; C205-Y276 PolarHBondContact SG-O 2.86Å; C205-F277 VanDerWaalsContact CA-CZ 3.46Å; C205-F277 HydrophobicContact CB-CE2 3.7Å; C205-F277 HydrophobicContact CB-CZ 3.77Å
206	T	98.5	Very high	98.6	Very high	104 Å²	104	50 Å²	50	64%	0.638	23%	0.234	S	C	*	.	H	α-helix	trans	-63	-36.4	174.1	-63.1	0	0	0	0	112.3	S202 V204	S202-T206 PolarHBondContact O-N 3.22Å; S202-T206 PolarHBondContact O-OG1 2.89Å; S202-T206 VanDerWaalsContact O-OG1 3.09Å; V204-T206 PolarHBondContact O-N 3.39Å
207	M	98.4	Very high	98.6	Very high	26 Å²	26	47.5 Å²	47.5	13%	0.128	22%	0.219	C	C	.	.	H	α-helix	trans	-66.3	-52.2	174.1	-179.3	-171.7	67.3	0	0	111.1	L127 P128 I131 F163 L171 Y174 R203 V204 C205	L127-M207 HydrophobicContact CB-SD 4.15Å; L127-M207 HydrophobicContact CD1-CG 3.9Å; L127-M207 HydrophobicContact CD1-SD 4.03Å; L127-M207 HydrophobicContact CD2-SD 4.01Å; L127-M207 HydrophobicContact CG-SD 4.3Å; P128-M207 HydrophobicContact CG-CE 4.43Å; I131-M207 HydrophobicContact CD1-CE 4.25Å; F163-M207 HydrophobicContact CE1-CB 4.45Å; F163-M207 HydrophobicContact CE2-CE 4.41Å; F163-M207 HydrophobicContact CZ-CB 4.33Å; F163-M207 HydrophobicContact CZ-CE 3.89Å; F163-M207 HydrophobicContact CZ-SD 3.71Å; L171-M207 HydrophobicContact CD2-CB 4.2Å; L171-M207 HydrophobicContact CD2-CG 3.83Å; L171-M207 HydrophobicContact CD2-SD 4.06Å; Y174-M207 HydrophobicContact CD1-SD 4.2Å; Y174-M207 HydrophobicContact CE1-SD 3.83Å; R203-M207 PolarHBondContact O-N 3.01Å; R203-M207 VanDerWaalsContact O-N 3.16Å; V204-M207 WeakPolarHBondContact O-CB 3.2Å; V204-M207 PolarHBondContact O-N 3.28Å; V204-M207 VanDerWaalsContact O-N 3.15Å; C205-M207 VanDerWaalsContact C-N 3.32Å; C205-M207 PolarHBondContact O-N 3.21Å
208	N	97.9	Very high	98.6	Very high	56 Å²	56	49.4 Å²	49.4	30%	0.299	22%	0.223	S	C	.	.			trans	-161.8	117	176.7	-179.1	4.2	0	0	0	110.9	V204 C205 H210 T211	V204-N208 PolarHBondContact O-N 2.59Å; C205-N208 CarbonylContact O-C 3.37Å; C205-N208 PolarHBondContact O-N 2.94Å; N208-H210 PolarHBondContact O-N 3.45Å; N208-H210 WeakPolarHBondContact OD1-CB 3.47Å; N208-H210 PolarHBondContact OD1-N 2.86Å; N208-T211 WeakPolarHBondContact O-CB 3.46Å; N208-T211 PolarHBondContact O-N 3.03Å; N208-T211 VanDerWaalsContact O-N 3.16Å; N208-T211 PolarHBondContact O-OG1 3.47Å
209	R	97.8	Very high	98.7	Very high	183 Å²	183	40.9 Å²	40.9	69%	0.691	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.6	178.3	-62.5	-166.1	157.3	167.1	-5.1	114.1	C205 F277 H281	C205-R209 WeakPolarHBondContact O-CG 3.46Å; C205-R209 PolarHBondContact O-N 3.23Å; R209-F277 WeakPolarHBondContact O-CE1 3.18Å; R209-H281 PolarHBondContact O-CE1 3.48Å; R209-H281 PolarHBondContact O-ND1 3.4Å
210	H	97.8	Very high	98.7	Very high	143 Å²	143	36.7 Å²	36.7	66%	0.662	17%	0.173	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.6	7.1	179.3	-53.9	96.3	0	0	0	113.5	N208 K212	N208-H210 PolarHBondContact O-N 3.45Å; N208-H210 WeakPolarHBondContact OD1-CB 3.47Å; N208-H210 PolarHBondContact OD1-N 2.86Å; H210-K212 PolarHBondContact O-N 2.85Å
211	T	98.7	Very high	98.7	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	17%	0.173	C	C	.	.			trans	-59.6	128.2	175.9	-68.8	0	0	0	0	110.4	N129 I131 V204 N208 L213	N129-T211 WeakPolarHBondContact O-CA 3.36Å; I131-T211 HydrophobicContact CD1-CG2 3.94Å; I131-T211 HydrophobicContact CG1-CG2 3.93Å; V204-T211 HydrophobicContact CG1-CG2 3.95Å; N208-T211 WeakPolarHBondContact O-CB 3.46Å; N208-T211 PolarHBondContact O-N 3.03Å; N208-T211 VanDerWaalsContact O-N 3.16Å; N208-T211 PolarHBondContact O-OG1 3.47Å; T211-L213 HydrophobicContact CG2-CD2 3.91Å
212	K	98.9	Very high	98.6	Very high	71 Å²	71	38.4 Å²	38.4	31%	0.309	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.5	173.2	-69.5	-175.7	-178.7	179.4	0	110.2	N129 A130 I131 H210 F304 L305	N129-K212 PolarHBondContact O-N 2.96Å; A130-K212 CarbonylContact C-O 3.4Å; A130-K212 WeakPolarHBondContact CA-O 3.29Å; A130-K212 HydrophobicContact CB-CB 4Å; I131-K212 PolarHBondContact N-O 3.23Å; H210-K212 PolarHBondContact O-N 2.85Å; K212-F304 HydrophobicContact CB-CE1 3.73Å; K212-F304 HydrophobicContact CB-CZ 3.79Å; K212-F304 HydrophobicContact CD-CE1 4.19Å; K212-F304 HydrophobicContact CD-CZ 4.26Å; K212-F304 WeakPolarHBondContact CD-O 3.44Å; K212-F304 WeakPolarHBondContact CE-O 3.21Å; K212-F304 HydrophobicContact CG-CE1 4.3Å; K212-F304 HydrophobicContact CG-CZ 4.09Å; K212-F304 PolarHBondContact NZ-O 3.34Å; K212-L305 HydrophobicContact CD-CD2 4.33Å; K212-L305 PolarHBondContact NZ-O 2.93Å
213	L	98.9	Very high	98.6	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.7	-171.7	-58.6	172.1	0	0	0	109.7	I133 V204 T211 W273 F277 H281 F282 L283	I133-L213 HydrophobicContact CD1-CB 4.12Å; I133-L213 HydrophobicContact CD1-CD2 4.5Å; I133-L213 HydrophobicContact CG2-CD2 3.81Å; V204-L213 HydrophobicContact CG1-CD2 4.25Å; T211-L213 HydrophobicContact CG2-CD2 3.91Å; L213-W273 HydrophobicContact CD1-CE3 3.56Å; L213-W273 HydrophobicContact CD1-CZ3 3.6Å; L213-W273 HydrophobicContact CD2-CZ3 3.97Å; L213-W273 HydrophobicContact CG-CZ3 4.42Å; L213-F277 HydrophobicContact CD1-CB 4.21Å; L213-F277 HydrophobicContact CD1-CD1 4.08Å; L213-F277 HydrophobicContact CD1-CD2 3.74Å; L213-F277 HydrophobicContact CD1-CE1 4.38Å; L213-F277 HydrophobicContact CD1-CE2 4.07Å; L213-F277 HydrophobicContact CD1-CG 3.74Å; L213-F277 HydrophobicContact CD1-CZ 4.37Å; L213-H281 PolarHBondContact N-O 2.95Å; L213-F282 HydrophobicContact CB-CD1 3.79Å; L213-F282 HydrophobicContact CB-CE1 3.82Å; L213-F282 HydrophobicContact CB-CG 4.39Å; L213-F282 HydrophobicContact CB-CZ 4.43Å; L213-F282 HydrophobicContact CD1-CD1 4.21Å; L213-F282 HydrophobicContact CD1-CE1 3.43Å; L213-F282 VanDerWaalsContact CD1-CE1 3.43Å; L213-F282 HydrophobicContact CD1-CE2 4.07Å; L213-F282 HydrophobicContact CD1-CZ 3.32Å; L213-F282 HydrophobicContact CG-CE1 4.28Å; L213-F282 HydrophobicContact CG-CZ 4.49Å; L213-F282 CarbonylContact O-C 3.54Å; L213-F282 VanDerWaalsContact O-CA 3.28Å; L213-F282 WeakPolarHBondContact O-CA 3.5Å; L213-L283 PolarHBondContact O-N 3.04Å
214	I	98.9	Very high	98.6	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	130.2	178.4	-57.1	169.3	0	0	0	109.5	I131 I132 I133 L143 M188 L283 V285 V301 F304 L305	I131-I214 PolarHBondContact O-N 3.18Å; I132-I214 CarbonylContact C-O 3.57Å; I132-I214 WeakPolarHBondContact CA-O 3.39Å; I132-I214 HydrophobicContact CG1-CB 4.14Å; I132-I214 HydrophobicContact CG1-CD1 4.41Å; I132-I214 HydrophobicContact CG1-CG2 4.5Å; I133-I214 PolarHBondContact N-O 3.31Å; L143-I214 HydrophobicContact CD2-CG2 3.63Å; M188-I214 HydrophobicContact CE-CD1 3.91Å; I214-L283 WeakPolarHBondContact CA-O 3.48Å; I214-L283 HydrophobicContact CG1-CB 4.39Å; I214-V285 HydrophobicContact CG2-CG2 3.75Å; I214-V301 HydrophobicContact CD1-CG1 4.01Å; I214-F304 HydrophobicContact CD1-CD1 4.46Å; I214-F304 HydrophobicContact CD1-CE1 4.49Å; I214-F304 HydrophobicContact CG1-CD1 4.14Å; I214-F304 HydrophobicContact CG1-CE1 3.82Å; I214-L305 HydrophobicContact CD1-CD1 4.5Å; I214-L305 HydrophobicContact CD1-CD2 4.23Å
215	V	98.9	Very high	98.6	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	110.2	177.1	-168.3	0	0	0	0	108.7	I133 G134 V135 F195 V217 F282 L283 F284 V285	I133-V215 HydrophobicContact CD1-CG2 3.87Å; I133-V215 HydrophobicContact CG1-CG2 3.82Å; G134-V215 CarbonylContact O-C 3.54Å; G134-V215 WeakPolarHBondContact O-CA 3.41Å; V135-V215 HydrophobicContact CG1-CG1 3.78Å; F195-V215 HydrophobicContact CD2-CG1 4.11Å; F195-V215 HydrophobicContact CD2-CG2 4.08Å; F195-V215 HydrophobicContact CE2-CG1 3.99Å; F195-V215 HydrophobicContact CE2-CG2 4.02Å; F195-V215 HydrophobicContact CZ-CG1 4.27Å; V215-V217 HydrophobicContact CG1-CG1 3.78Å; V215-V217 PolarHBondContact O-N 3.02Å; V215-F282 HydrophobicContact CG2-CD1 4.33Å; V215-L283 PolarHBondContact N-O 2.9Å; V215-F284 HydrophobicContact CB-CD1 3.84Å; V215-F284 HydrophobicContact CB-CE1 4.15Å; V215-F284 HydrophobicContact CG1-CD1 4.43Å; V215-F284 HydrophobicContact CG2-CD1 4.21Å; V215-F284 HydrophobicContact CG2-CE1 4.03Å; V215-F284 WeakPolarHBondContact O-CA 3.32Å; V215-V285 PolarHBondContact O-N 2.85Å
216	V	98.9	Very high	98.6	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	102.6	171.2	-166.2	0	0	0	0	108.1	I132 G134 V135 G138 T140 L143 V285 L290	I132-V216 HydrophobicContact CG2-CG2 4.25Å; G134-V216 PolarHBondContact O-N 3.46Å; V135-V216 WeakPolarHBondContact CG2-O 3.35Å; V135-V216 PolarHBondContact N-O 3.4Å; G138-V216 WeakPolarHBondContact CA-O 3.43Å; G138-V216 WeakPolarHBondContact O-CG1 3.39Å; T140-V216 HydrophobicContact CG2-CB 4.3Å; T140-V216 HydrophobicContact CG2-CG2 4.26Å; L143-V216 HydrophobicContact CB-CG2 4.06Å; L143-V216 HydrophobicContact CD2-CG2 3.37Å; L143-V216 HydrophobicContact CG-CG2 4.33Å; V216-V285 WeakPolarHBondContact CA-O 3.35Å; V216-V285 HydrophobicContact CG1-CB 4.4Å; V216-V285 HydrophobicContact CG1-CG1 4.25Å; V216-V285 HydrophobicContact CG2-CB 4.27Å; V216-L290 HydrophobicContact CG1-CD2 4.21Å
217	V	98.9	Very high	98.6	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	166.1	179.2	-65.7	0	0	0	0	111.1	V215 Y266 V285 G287 F369 F377 W379	V215-V217 HydrophobicContact CG1-CG1 3.78Å; V215-V217 PolarHBondContact O-N 3.02Å; V217-Y266 HydrophobicContact CB-CD2 4.49Å; V217-Y266 HydrophobicContact CB-CE2 4.2Å; V217-Y266 HydrophobicContact CG1-CD2 4.28Å; V217-Y266 HydrophobicContact CG1-CE2 4.39Å; V217-V285 WeakPolarHBondContact CG2-O 3.24Å; V217-V285 PolarHBondContact N-O 2.76Å; V217-G287 VanDerWaalsContact O-CA 3.24Å; V217-G287 WeakPolarHBondContact O-CA 3.34Å; V217-G287 PolarHBondContact O-N 3.15Å; V217-F369 HydrophobicContact CG1-CE1 4.01Å; V217-F369 HydrophobicContact CG1-CZ 3.8Å; V217-F369 HydrophobicContact CG2-CE1 4.4Å; V217-F377 HydrophobicContact CG2-CD1 3.63Å; V217-F377 HydrophobicContact CG2-CE1 3.36Å; V217-F377 HydrophobicContact CG2-CE2 4.3Å; V217-F377 HydrophobicContact CG2-CG 4.22Å; V217-F377 HydrophobicContact CG2-CZ 3.75Å; V217-W379 HydrophobicContact CB-CH2 3.8Å; V217-W379 HydrophobicContact CB-CZ2 3.9Å; V217-W379 HydrophobicContact CG2-CH2 3.81Å; V217-W379 HydrophobicContact CG2-CZ2 3.71Å
218	R	98.8	Very high	98.6	Very high	62 Å²	62	28.8 Å²	28.8	23%	0.234	13%	0.129	C	C	.	.			trans	-157	156.5	-177.5	179.4	-179	176.2	163.9	7.7	107.8	P220 T222 R223 Y266 E288	R218-P220 VanDerWaalsContact O-CD 3.32Å; R218-P220 WeakPolarHBondContact O-CD 3.41Å; R218-T222 PolarHBondContact NE-OG1 3.24Å; R218-R223 HydrophobicContact CB-CB 4.32Å; R218-R223 HydrophobicContact CG-CB 4.34Å; R218-Y266 VanDerWaalsContact O-CE2 3.28Å; R218-Y266 WeakPolarHBondContact O-CE2 3.41Å; R218-Y266 PolarHBondContact O-OH 2.79Å; R218-E288 WeakPolarHBondContact CA-OE1 3.22Å; R218-E288 WeakPolarHBondContact CG-OE1 3.5Å
219	D	98.8	Very high	98.6	Very high	17 Å²	17	26.5 Å²	26.5	9%	0.091	12%	0.117	C	C	.	.			trans	-43.8	115.7	169.8	169.8	-7	0	0	0	109.1	V221 T222 R223 E288 R359 W379	D219-V221 PolarHBondContact O-N 2.94Å; D219-V221 VanDerWaalsContact O-N 3.11Å; D219-V221 WeakPolarHBondContact OD1-CB 3.32Å; D219-V221 PolarHBondContact OD1-N 3.23Å; D219-T222 HydrophobicContact CB-CG2 4.24Å; D219-T222 PolarHBondContact O-N 3.34Å; D219-T222 VanDerWaalsContact O-N 3.11Å; D219-T222 PolarHBondContact O-OG1 3.32Å; D219-T222 VanDerWaalsContact O-OG1 3.12Å; D219-T222 WeakPolarHBondContact OD2-CG2 3.5Å; D219-R223 WeakPolarHBondContact O-CB 3.42Å; D219-R223 PolarHBondContact O-N 3.12Å; D219-E288 PolarHBondContact N-OE1 3.4Å; D219-R359 IonicContact OD1-NH1 3.46Å; D219-R359 PolarHBondContact OD1-NH1 2.87Å; D219-R359 IonicContact OD2-CZ 3.32Å; D219-R359 IonicContact OD2-NH1 3.04Å; D219-R359 PolarHBondContact OD2-NH1 3.34Å; D219-R359 IonicContact OD2-NH2 2.74Å; D219-R359 PolarHBondContact OD2-NH2 3.13Å; D219-W379 HydrophobicContact CB-CB 4.27Å; D219-W379 HydrophobicContact CB-CG 3.91Å; D219-W379 VanDerWaalsContact N-NE1 3.19Å
220	P	98.9	Very high	98.6	Very high	0 Å²	0	19.7 Å²	19.7	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-53.7	-32.2	-175.9	-28	33.5	0	0	0	114	R218 A224 Y266 Y362 N366 W379	R218-P220 VanDerWaalsContact O-CD 3.32Å; R218-P220 WeakPolarHBondContact O-CD 3.41Å; P220-A224 VanDerWaalsContact O-CB 3.29Å; P220-A224 WeakPolarHBondContact O-CB 3.21Å; P220-A224 PolarHBondContact O-N 3.17Å; P220-Y266 HydrophobicContact CG-CD2 4.33Å; P220-Y266 HydrophobicContact CG-CE2 3.69Å; P220-Y362 HydrophobicContact CB-CD1 3.74Å; P220-Y362 HydrophobicContact CB-CD2 3.6Å; P220-Y362 HydrophobicContact CB-CE1 3.76Å; P220-Y362 HydrophobicContact CB-CE2 3.61Å; P220-Y362 HydrophobicContact CB-CG 3.65Å; P220-Y362 HydrophobicContact CG-CD1 4.28Å; P220-Y362 HydrophobicContact CG-CG 4.21Å; P220-N366 WeakPolarHBondContact CG-OD1 3.2Å; P220-W379 HydrophobicContact CG-CE3 4.21Å; P220-W379 HydrophobicContact CG-CZ3 4.38Å
221	V	98.7	Very high	98.6	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	8%	0.076	C	C	.	.	H	α-helix	trans	-68.8	-54.1	177.3	-177.2	0	0	0	0	110.1	D219 R223 A224 V225 L355 L358 R359 Y362	D219-V221 PolarHBondContact O-N 2.94Å; D219-V221 VanDerWaalsContact O-N 3.11Å; D219-V221 WeakPolarHBondContact OD1-CB 3.32Å; D219-V221 PolarHBondContact OD1-N 3.23Å; V221-R223 PolarHBondContact O-N 3.45Å; V221-A224 WeakPolarHBondContact O-CB 3.46Å; V221-A224 PolarHBondContact O-N 2.65Å; V221-A224 VanDerWaalsContact O-N 3.16Å; V221-V225 WeakPolarHBondContact O-CG2 3.4Å; V221-V225 PolarHBondContact O-N 3.48Å; V221-L355 HydrophobicContact CG1-CB 4.5Å; V221-L355 HydrophobicContact CG1-CD2 3.72Å; V221-L358 HydrophobicContact CG1-CB 4.35Å; V221-L358 HydrophobicContact CG2-CB 3.95Å; V221-R359 HydrophobicContact CG2-CG 3.72Å; V221-Y362 HydrophobicContact CG2-CD2 3.82Å; V221-Y362 HydrophobicContact CG2-CE2 4.21Å
222	T	98.6	Very high	98.5	Very high	36 Å²	36	17.6 Å²	17.6	22%	0.221	9%	0.088	C	C	.	.	H	α-helix	trans	-65.7	-31.3	179.8	69.8	0	0	0	0	111.8	R218 D219 S226	R218-T222 PolarHBondContact NE-OG1 3.24Å; D219-T222 HydrophobicContact CB-CG2 4.24Å; D219-T222 PolarHBondContact O-N 3.34Å; D219-T222 VanDerWaalsContact O-N 3.11Å; D219-T222 PolarHBondContact O-OG1 3.32Å; D219-T222 VanDerWaalsContact O-OG1 3.12Å; D219-T222 WeakPolarHBondContact OD2-CG2 3.5Å; T222-S226 WeakPolarHBondContact O-CB 3.48Å; T222-S226 PolarHBondContact O-N 2.82Å
223	R	98.8	Very high	98.2	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.1	-46.8	172.4	-169	-139.2	65.6	77.7	4.1	111.2	V135 K136 K137 R218 D219 V221 S226 D227 A260 Y266	V135-R223 HydrophobicContact CG2-CG 4.41Å; K136-R223 WeakPolarHBondContact O-CD 3.42Å; K136-R223 WeakPolarHBondContact O-CG 3.35Å; K136-R223 PolarHBondContact O-NH1 3.25Å; K136-R223 VanDerWaalsContact O-NH1 3.14Å; K137-R223 HydrophobicContact CB-CG 3.94Å; R218-R223 HydrophobicContact CB-CB 4.32Å; R218-R223 HydrophobicContact CG-CB 4.34Å; D219-R223 WeakPolarHBondContact O-CB 3.42Å; D219-R223 PolarHBondContact O-N 3.12Å; V221-R223 PolarHBondContact O-N 3.45Å; R223-S226 WeakPolarHBondContact O-CB 3.21Å; R223-S226 PolarHBondContact O-N 2.96Å; R223-D227 IonicContact CZ-OD2 3.67Å; R223-D227 IonicContact NH1-OD2 2.79Å; R223-D227 PolarHBondContact NH1-OD2 2.95Å; R223-D227 IonicContact NH2-OD2 2.91Å; R223-D227 PolarHBondContact O-N 3.37Å; R223-A260 VanDerWaalsContact NH2-C 3.3Å; R223-A260 PolarHBondContact NH2-O 3.13Å; R223-Y266 WeakPolarHBondContact CD-OH 3.35Å
224	A	98.8	Very high	98	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-59.6	-47	176.3	0	0	0	0	0	111.7	P220 V221 S226 D227 Y228 F241 A260 L358	P220-A224 VanDerWaalsContact O-CB 3.29Å; P220-A224 WeakPolarHBondContact O-CB 3.21Å; P220-A224 PolarHBondContact O-N 3.17Å; V221-A224 WeakPolarHBondContact O-CB 3.46Å; V221-A224 PolarHBondContact O-N 2.65Å; V221-A224 VanDerWaalsContact O-N 3.16Å; A224-S226 VanDerWaalsContact C-N 3.3Å; A224-S226 PolarHBondContact O-N 2.7Å; A224-D227 WeakPolarHBondContact O-CB 3.37Å; A224-D227 PolarHBondContact O-N 2.75Å; A224-D227 VanDerWaalsContact O-N 3.16Å; A224-Y228 PolarHBondContact O-N 3.23Å; A224-F241 HydrophobicContact CB-CE2 4.21Å; A224-F241 HydrophobicContact CB-CZ 4.11Å; A224-A260 WeakPolarHBondContact CB-O 3.41Å; A224-L358 HydrophobicContact CB-CD2 4.46Å
225	V	98.6	Very high	97.8	Very high	9 Å²	9	28.2 Å²	28.2	6%	0.055	15%	0.146	C	C	.	.	H	α-helix	trans	-60.4	-40.8	175.3	175.9	0	0	0	0	111.1	V221 D227 Y228 T229 F241 H347 I350 L355	V221-V225 WeakPolarHBondContact O-CG2 3.4Å; V221-V225 PolarHBondContact O-N 3.48Å; V225-D227 VanDerWaalsContact C-N 3.31Å; V225-D227 PolarHBondContact O-N 2.75Å; V225-Y228 PolarHBondContact O-N 3.08Å; V225-T229 WeakPolarHBondContact O-CB 3.23Å; V225-T229 PolarHBondContact O-N 3.21Å; V225-T229 PolarHBondContact O-OG1 2.65Å; V225-F241 HydrophobicContact CB-CE2 4.45Å; V225-F241 HydrophobicContact CG2-CD2 4.39Å; V225-F241 HydrophobicContact CG2-CE1 4.37Å; V225-F241 HydrophobicContact CG2-CE2 3.89Å; V225-F241 HydrophobicContact CG2-CZ 3.87Å; V225-H347 HydrophobicContact CG1-CB 3.85Å; V225-I350 HydrophobicContact CG1-CG1 4.29Å; V225-I350 HydrophobicContact CG2-CG1 4.26Å; V225-L355 HydrophobicContact CG2-CD2 3.96Å
226	S	98.4	Very high	97.5	Very high	11 Å²	11	33.6 Å²	33.6	8%	0.077	18%	0.181	C	C	.	.	H	α-helix	trans	-66.3	-34.1	177.4	-161.2	0	0	0	0	112.9	K137 T222 R223 A224 Q230 H347	K137-S226 VanDerWaalsContact CE-O 3.23Å; K137-S226 WeakPolarHBondContact CE-O 3.44Å; K137-S226 WeakPolarHBondContact CE-OG 3.35Å; T222-S226 WeakPolarHBondContact O-CB 3.48Å; T222-S226 PolarHBondContact O-N 2.82Å; R223-S226 WeakPolarHBondContact O-CB 3.21Å; R223-S226 PolarHBondContact O-N 2.96Å; A224-S226 VanDerWaalsContact C-N 3.3Å; A224-S226 PolarHBondContact O-N 2.7Å; S226-Q230 PolarHBondContact O-N 3.14Å; S226-H347 WeakPolarHBondContact CB-NE2 3.45Å; S226-H347 PolarHBondContact OG-NE2 3.27Å
227	D	98.6	Very high	97.2	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.011	21%	0.214	C	C	.	.	H	α-helix	trans	-67.4	-51.9	176.1	-155.4	-17.5	0	0	0	110.3	K136 K137 R223 A224 V225 T229 Q230 T231 A260	K136-D227 WeakPolarHBondContact CE-OD1 3.38Å; K136-D227 IonicContact NZ-OD1 3.95Å; K136-D227 PolarHBondContact NZ-OD1 3.28Å; K136-D227 IonicContact NZ-OD2 3.66Å; K137-D227 HydrophobicContact CG-CB 3.89Å; R223-D227 IonicContact CZ-OD2 3.67Å; R223-D227 IonicContact NH1-OD2 2.79Å; R223-D227 PolarHBondContact NH1-OD2 2.95Å; R223-D227 IonicContact NH2-OD2 2.91Å; R223-D227 PolarHBondContact O-N 3.37Å; A224-D227 WeakPolarHBondContact O-CB 3.37Å; A224-D227 PolarHBondContact O-N 2.75Å; A224-D227 VanDerWaalsContact O-N 3.16Å; V225-D227 VanDerWaalsContact C-N 3.31Å; V225-D227 PolarHBondContact O-N 2.75Å; D227-T229 VanDerWaalsContact C-N 3.34Å; D227-T229 PolarHBondContact O-N 2.93Å; D227-Q230 WeakPolarHBondContact O-CB 3.49Å; D227-Q230 PolarHBondContact O-N 3.07Å; D227-Q230 VanDerWaalsContact O-N 3.11Å; D227-T231 PolarHBondContact O-N 3.12Å; D227-T231 VanDerWaalsContact O-N 3.09Å; D227-T231 PolarHBondContact O-OG1 3.35Å; D227-A260 HydrophobicContact CB-CB 4.06Å
228	Y	98.4	Very high	97	Very high	13 Å²	13	38.5 Å²	38.5	5%	0.051	22%	0.223	C	C	.	.	H	α-helix	trans	-52.5	-49.3	172.4	171	-102.3	0	0	0	112.3	A224 V225 Q230 T231 L232 L238 P239 F241 L244 W258 P348	A224-Y228 PolarHBondContact O-N 3.23Å; V225-Y228 PolarHBondContact O-N 3.08Å; Y228-Q230 VanDerWaalsContact C-N 3.25Å; Y228-Q230 PolarHBondContact O-N 3.1Å; Y228-T231 CarbonylContact O-C 3.55Å; Y228-T231 WeakPolarHBondContact O-CB 3.45Å; Y228-T231 PolarHBondContact O-N 3.29Å; Y228-L232 HydrophobicContact CE1-CD2 4.01Å; Y228-L232 WeakPolarHBondContact O-CB 3.46Å; Y228-L232 PolarHBondContact O-N 3.08Å; Y228-L238 HydrophobicContact CD2-CD2 3.64Å; Y228-L238 HydrophobicContact CE2-CD2 3.45Å; Y228-L238 VanDerWaalsContact CE2-CD2 3.45Å; Y228-L238 HydrophobicContact CE2-CG 4.06Å; Y228-P239 VanDerWaalsContact CE2-O 3.29Å; Y228-P239 WeakPolarHBondContact CE2-O 3.24Å; Y228-P239 PolarHBondContact OH-O 2.92Å; Y228-F241 HydrophobicContact CD1-CB 4.06Å; Y228-F241 AromaticContact CD1-CD2 3.91Å; Y228-F241 HydrophobicContact CD1-CD2 3.91Å; Y228-F241 HydrophobicContact CD1-CG 4.47Å; Y228-F241 HydrophobicContact CD2-CB 4.41Å; Y228-F241 HydrophobicContact CD2-CD2 4.17Å; Y228-F241 HydrophobicContact CE1-CB 3.97Å; Y228-F241 HydrophobicContact CE2-CB 4.32Å; Y228-F241 HydrophobicContact CG-CB 4.28Å; Y228-F241 AromaticContact CG-CD2 3.64Å; Y228-F241 HydrophobicContact CG-CD2 3.64Å; Y228-F241 HydrophobicContact CG-CG 4.47Å; Y228-F241 PolarHBondContact OH-N 2.83Å; Y228-L244 HydrophobicContact CD2-CD1 4.18Å; Y228-L244 HydrophobicContact CE2-CD1 4.04Å; Y228-W258 HydrophobicContact CD2-CH2 4.09Å; Y228-W258 HydrophobicContact CD2-CZ2 4.1Å; Y228-W258 HydrophobicContact CG-CH2 4.42Å; Y228-P348 HydrophobicContact CD1-CG 4.05Å; Y228-P348 HydrophobicContact CE1-CG 3.78Å
229	T	98.2	Very high	96.9	Very high	8 Å²	8	38.7 Å²	38.7	5%	0.049	23%	0.232	C	C	.	.	H	α-helix	trans	-57.5	-39.1	179.6	-57.5	0	0	0	0	111.8	V225 D227 T233 R345 P346 P348	V225-T229 WeakPolarHBondContact O-CB 3.23Å; V225-T229 PolarHBondContact O-N 3.21Å; V225-T229 PolarHBondContact O-OG1 2.65Å; D227-T229 VanDerWaalsContact C-N 3.34Å; D227-T229 PolarHBondContact O-N 2.93Å; T229-T233 PolarHBondContact O-N 3.33Å; T229-T233 PolarHBondContact O-OG1 3.47Å; T229-R345 HydrophobicContact CG2-CB 3.95Å; T229-P346 WeakPolarHBondContact CG2-O 3.35Å; T229-P348 WeakPolarHBondContact OG1-CD 3.21Å
230	Q	97.6	Very high	96.7	Very high	41 Å²	41	39.9 Å²	39.9	19%	0.192	24%	0.242	C	C	.	.	H	α-helix	trans	-66.7	-42.4	176	174.5	174.8	-38.4	0	0	111.7	S226 D227 Y228 T233 K234	S226-Q230 PolarHBondContact O-N 3.14Å; D227-Q230 WeakPolarHBondContact O-CB 3.49Å; D227-Q230 PolarHBondContact O-N 3.07Å; D227-Q230 VanDerWaalsContact O-N 3.11Å; Y228-Q230 VanDerWaalsContact C-N 3.25Å; Y228-Q230 PolarHBondContact O-N 3.1Å; Q230-T233 PolarHBondContact O-N 3.2Å; Q230-K234 PolarHBondContact O-N 3.43Å
231	T	96.9	Very high	96.5	Very high	50 Å²	50	40 Å²	40	31%	0.307	24%	0.242	S	C	.	.	H	α-helix	trans	-65.2	-43.9	177.1	-52.9	0	0	0	0	110.9	D227 Y228 T233 K234 N235 L238	D227-T231 PolarHBondContact O-N 3.12Å; D227-T231 VanDerWaalsContact O-N 3.09Å; D227-T231 PolarHBondContact O-OG1 3.35Å; Y228-T231 CarbonylContact O-C 3.55Å; Y228-T231 WeakPolarHBondContact O-CB 3.45Å; Y228-T231 PolarHBondContact O-N 3.29Å; T231-T233 VanDerWaalsContact C-N 3.3Å; T231-T233 PolarHBondContact O-N 3.44Å; T231-K234 CarbonylContact O-C 3Å; T231-K234 WeakPolarHBondContact O-CA 3.48Å; T231-K234 PolarHBondContact O-N 3.18Å; T231-N235 PolarHBondContact O-N 3.32Å; T231-L238 HydrophobicContact CG2-CD1 4.26Å; T231-L238 HydrophobicContact CG2-CD2 3.75Å
232	L	96.3	Very high	96.3	Very high	48 Å²	48	42 Å²	42	25%	0.251	25%	0.252	S	S	.	.	H	α-helix	trans	-59	-39	176.3	-176.7	66.2	0	0	0	112.3	Y228 K234 N235 L238	Y228-L232 HydrophobicContact CE1-CD2 4.01Å; Y228-L232 WeakPolarHBondContact O-CB 3.46Å; Y228-L232 PolarHBondContact O-N 3.08Å; L232-K234 PolarHBondContact O-N 3.06Å; L232-N235 CarbonylContact O-C 3.15Å; L232-N235 PolarHBondContact O-N 3.16Å; L232-L238 HydrophobicContact CB-CD2 4.39Å; L232-L238 HydrophobicContact CD1-CB 4Å
233	T	93.6	Very high	96.1	Very high	91 Å²	91	42.1 Å²	42.1	56%	0.558	25%	0.254	S	S	*	.	H	α-helix	trans	-62.3	-31.3	175.4	-51.5	0	0	0	0	112.1	T229 Q230 T231	T229-T233 PolarHBondContact O-N 3.33Å; T229-T233 PolarHBondContact O-OG1 3.47Å; Q230-T233 PolarHBondContact O-N 3.2Å; T231-T233 VanDerWaalsContact C-N 3.3Å; T231-T233 PolarHBondContact O-N 3.44Å
234	K	94.3	Very high	96	Very high	121 Å²	121	44 Å²	44	53%	0.526	26%	0.264	S	S	.	.	H	α-helix	trans	-87.8	-29.3	178.6	-66.9	-177.2	175.2	-171.9	0	112.5	D97 Q230 T231 L232	D97-K234 VanDerWaalsContact CG-NZ 3.31Å; D97-K234 IonicContact OD1-NZ 2.94Å; D97-K234 PolarHBondContact OD1-NZ 3.12Å; D97-K234 IonicContact OD2-NZ 2.59Å; D97-K234 PolarHBondContact OD2-NZ 2.9Å; D97-K234 VanDerWaalsContact OD2-NZ 3.1Å; Q230-K234 PolarHBondContact O-N 3.43Å; T231-K234 CarbonylContact O-C 3Å; T231-K234 WeakPolarHBondContact O-CA 3.48Å; T231-K234 PolarHBondContact O-N 3.18Å; L232-K234 PolarHBondContact O-N 3.06Å
235	N	95	Very high	95.8	Very high	83 Å²	83	44 Å²	44	44%	0.444	26%	0.264	S	S	.	.			trans	-134.3	90.5	-178.7	-178.6	3.2	0	0	0	109.6	T231 L232 G237 L238	T231-N235 PolarHBondContact O-N 3.32Å; L232-N235 CarbonylContact O-C 3.15Å; L232-N235 PolarHBondContact O-N 3.16Å; N235-G237 PolarHBondContact O-N 2.97Å; N235-G237 PolarHBondContact OD1-N 3.36Å; N235-L238 WeakPolarHBondContact O-CB 3.47Å; N235-L238 PolarHBondContact O-N 2.77Å
236	P	91.8	Very high	95.6	Very high	113 Å²	113	43.7 Å²	43.7	73%	0.734	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-20.8	-178.8	-25.4	35.8	0	0	0	114.8	L238	P236-L238 VanDerWaalsContact C-N 3.25Å; P236-L238 PolarHBondContact O-N 2.92Å
237	G	93.6	Very high	95.2	Very high	67 Å²	67	47.7 Å²	47.7	69%	0.691	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	10.3	178	0	0	0	0	0	114.4	N235	N235-G237 PolarHBondContact O-N 2.97Å; N235-G237 PolarHBondContact OD1-N 3.36Å
238	L	95	Very high	94.4	Very high	35 Å²	35	54.5 Å²	54.5	18%	0.183	32%	0.315	C	S	.	.	P	Polyproline II helix	trans	-63.9	135.6	-179.5	-168.8	70.2	0	0	0	110.6	Y228 T231 L232 N235 P236 L244	Y228-L238 HydrophobicContact CD2-CD2 3.64Å; Y228-L238 HydrophobicContact CE2-CD2 3.45Å; Y228-L238 VanDerWaalsContact CE2-CD2 3.45Å; Y228-L238 HydrophobicContact CE2-CG 4.06Å; T231-L238 HydrophobicContact CG2-CD1 4.26Å; T231-L238 HydrophobicContact CG2-CD2 3.75Å; L232-L238 HydrophobicContact CB-CD2 4.39Å; L232-L238 HydrophobicContact CD1-CB 4Å; N235-L238 WeakPolarHBondContact O-CB 3.47Å; N235-L238 PolarHBondContact O-N 2.77Å; P236-L238 VanDerWaalsContact C-N 3.25Å; P236-L238 PolarHBondContact O-N 2.92Å; L238-L244 HydrophobicContact CD1-CD1 4.1Å; L238-L244 HydrophobicContact CD2-CD1 4.22Å; L238-L244 HydrophobicContact CG-CD1 3.94Å
239	P	94.9	Very high	92.8	Very high	67 Å²	67	58.3 Å²	58.3	44%	0.435	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-56.7	157.8	173	-24.5	34.7	0	0	0	111.8	Y228 S243 L244	Y228-P239 VanDerWaalsContact CE2-O 3.29Å; Y228-P239 WeakPolarHBondContact CE2-O 3.24Å; Y228-P239 PolarHBondContact OH-O 2.92Å; P239-S243 WeakPolarHBondContact CB-OG 3.4Å; P239-L244 HydrophobicContact CB-CD2 4.06Å; P239-L244 HydrophobicContact CB-CG 4.15Å; P239-L244 HydrophobicContact CG-CD2 4.16Å
240	S	95.1	Very high	91.2	Very high	42 Å²	42	60.7 Å²	60.7	29%	0.294	36%	0.36	S	S	.	.	P	Polyproline II helix	trans	-58.4	153.8	-178.4	68.3	0	0	0	0	112.5	Q242 S243 L244	S240-Q242 VanDerWaalsContact C-N 3.31Å; S240-Q242 VanDerWaalsContact CB-NE2 3.25Å; S240-Q242 PolarHBondContact O-N 2.98Å; S240-Q242 PolarHBondContact OG-NE2 2.86Å; S240-Q242 PolarHBondContact OG-OE1 3.35Å; S240-S243 PolarHBondContact N-OG 3.37Å; S240-S243 PolarHBondContact O-N 3.4Å; S240-S243 PolarHBondContact O-OG 3.48Å; S240-S243 WeakPolarHBondContact OG-CB 3.38Å; S240-S243 PolarHBondContact OG-N 3.44Å; S240-S243 PolarHBondContact OG-OG 2.95Å; S240-L244 PolarHBondContact O-N 3.18Å
241	F	96.1	Very high	89.8	Confident	1 Å²	1	63.3 Å²	63.3	0%	0.004	38%	0.379	C	S	.	.	H	α-helix	trans	-51.4	-49.4	179.5	-178.6	-91.5	0	0	0	112.2	A224 V225 Y228 S243 L244 A245 W258 I350 L358	A224-F241 HydrophobicContact CB-CE2 4.21Å; A224-F241 HydrophobicContact CB-CZ 4.11Å; V225-F241 HydrophobicContact CB-CE2 4.45Å; V225-F241 HydrophobicContact CG2-CD2 4.39Å; V225-F241 HydrophobicContact CG2-CE1 4.37Å; V225-F241 HydrophobicContact CG2-CE2 3.89Å; V225-F241 HydrophobicContact CG2-CZ 3.87Å; Y228-F241 HydrophobicContact CD1-CB 4.06Å; Y228-F241 AromaticContact CD1-CD2 3.91Å; Y228-F241 HydrophobicContact CD1-CD2 3.91Å; Y228-F241 HydrophobicContact CD1-CG 4.47Å; Y228-F241 HydrophobicContact CD2-CB 4.41Å; Y228-F241 HydrophobicContact CD2-CD2 4.17Å; Y228-F241 HydrophobicContact CE1-CB 3.97Å; Y228-F241 HydrophobicContact CE2-CB 4.32Å; Y228-F241 HydrophobicContact CG-CB 4.28Å; Y228-F241 AromaticContact CG-CD2 3.64Å; Y228-F241 HydrophobicContact CG-CD2 3.64Å; Y228-F241 HydrophobicContact CG-CG 4.47Å; Y228-F241 PolarHBondContact OH-N 2.83Å; F241-S243 VanDerWaalsContact C-N 3.29Å; F241-S243 PolarHBondContact O-N 3.19Å; F241-L244 PolarHBondContact O-N 3.18Å; F241-A245 HydrophobicContact CD1-CB 4.1Å; F241-A245 HydrophobicContact CE1-CB 3.8Å; F241-A245 HydrophobicContact CZ-CB 4.2Å; F241-A245 WeakPolarHBondContact O-CB 3.25Å; F241-A245 PolarHBondContact O-N 2.82Å; F241-W258 AromaticContact CD2-CH2 3.71Å; F241-W258 HydrophobicContact CD2-CH2 3.71Å; F241-W258 HydrophobicContact CD2-CZ3 4.08Å; F241-W258 AromaticContact CE2-CH2 3.68Å; F241-W258 HydrophobicContact CE2-CH2 3.68Å; F241-W258 AromaticContact CE2-CZ3 3.73Å; F241-W258 HydrophobicContact CE2-CZ3 3.73Å; F241-W258 HydrophobicContact CZ-CZ3 4.14Å; F241-I350 HydrophobicContact CB-CD1 3.47Å; F241-I350 VanDerWaalsContact CB-CD1 3.47Å; F241-I350 HydrophobicContact CB-CG1 4.29Å; F241-I350 HydrophobicContact CB-CG2 4.45Å; F241-I350 HydrophobicContact CD1-CD1 4.46Å; F241-I350 HydrophobicContact CD1-CG1 4.41Å; F241-I350 HydrophobicContact CD1-CG2 3.64Å; F241-I350 HydrophobicContact CE1-CG2 4.29Å; F241-I350 HydrophobicContact CG-CD1 4Å; F241-I350 HydrophobicContact CG-CG1 4.31Å; F241-I350 HydrophobicContact CG-CG2 4.28Å; F241-L358 HydrophobicContact CE1-CD1 4.3Å; F241-L358 HydrophobicContact CE1-CD2 3.86Å; F241-L358 HydrophobicContact CZ-CD2 3.66Å
242	Q	94.6	Very high	89.1	Confident	43 Å²	43	61.5 Å²	61.5	20%	0.201	37%	0.37	C	S	.	.	H	α-helix	trans	-63.6	-33.4	-178.6	67.8	-78.9	-0.2	0	0	112.9	S240 L244 A245 L246 A354	S240-Q242 VanDerWaalsContact C-N 3.31Å; S240-Q242 VanDerWaalsContact CB-NE2 3.25Å; S240-Q242 PolarHBondContact O-N 2.98Å; S240-Q242 PolarHBondContact OG-NE2 2.86Å; S240-Q242 PolarHBondContact OG-OE1 3.35Å; Q242-L244 VanDerWaalsContact C-N 3.28Å; Q242-L244 PolarHBondContact O-N 3.34Å; Q242-A245 PolarHBondContact O-N 3.31Å; Q242-L246 HydrophobicContact CB-CD1 4.4Å; Q242-L246 WeakPolarHBondContact O-CB 3.39Å; Q242-L246 PolarHBondContact O-N 3.06Å; Q242-A354 HydrophobicContact CB-CB 3.91Å
243	S	93.9	Very high	88.9	Confident	40 Å²	40	63.5 Å²	63.5	28%	0.28	39%	0.386	S	S	.	.	H	α-helix	trans	-69.8	-27.2	178.4	72.6	0	0	0	0	113	P239 S240 F241	P239-S243 WeakPolarHBondContact CB-OG 3.4Å; S240-S243 PolarHBondContact N-OG 3.37Å; S240-S243 PolarHBondContact O-N 3.4Å; S240-S243 PolarHBondContact O-OG 3.48Å; S240-S243 WeakPolarHBondContact OG-CB 3.38Å; S240-S243 PolarHBondContact OG-N 3.44Å; S240-S243 PolarHBondContact OG-OG 2.95Å; F241-S243 VanDerWaalsContact C-N 3.29Å; F241-S243 PolarHBondContact O-N 3.19Å
244	L	95.4	Very high	89	Confident	40 Å²	40	60 Å²	60	21%	0.209	37%	0.365	C	S	.	.	H	α-helix	trans	-90	-32.3	176.3	-62.1	175.8	0	0	0	112.2	Y228 L238 P239 S240 F241 Q242 W258	Y228-L244 HydrophobicContact CD2-CD1 4.18Å; Y228-L244 HydrophobicContact CE2-CD1 4.04Å; L238-L244 HydrophobicContact CD1-CD1 4.1Å; L238-L244 HydrophobicContact CD2-CD1 4.22Å; L238-L244 HydrophobicContact CG-CD1 3.94Å; P239-L244 HydrophobicContact CB-CD2 4.06Å; P239-L244 HydrophobicContact CB-CG 4.15Å; P239-L244 HydrophobicContact CG-CD2 4.16Å; S240-L244 PolarHBondContact O-N 3.18Å; F241-L244 PolarHBondContact O-N 3.18Å; Q242-L244 VanDerWaalsContact C-N 3.28Å; Q242-L244 PolarHBondContact O-N 3.34Å; L244-W258 HydrophobicContact CB-CD2 3.98Å; L244-W258 HydrophobicContact CB-CE3 4.17Å; L244-W258 HydrophobicContact CB-CH2 4.03Å; L244-W258 HydrophobicContact CB-CZ2 3.83Å; L244-W258 HydrophobicContact CB-CZ3 4.22Å; L244-W258 HydrophobicContact CD1-CH2 4.48Å; L244-W258 HydrophobicContact CD1-CZ2 3.81Å; L244-W258 HydrophobicContact CG-CZ2 4.49Å
245	A	95.9	Very high	89.1	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-84.3	-23.5	-175.6	0	0	0	0	0	113.4	F241 Q242 V254 D255 W258 L358	F241-A245 HydrophobicContact CD1-CB 4.1Å; F241-A245 HydrophobicContact CE1-CB 3.8Å; F241-A245 HydrophobicContact CZ-CB 4.2Å; F241-A245 WeakPolarHBondContact O-CB 3.25Å; F241-A245 PolarHBondContact O-N 2.82Å; Q242-A245 PolarHBondContact O-N 3.31Å; A245-V254 CarbonylContact O-C 3.59Å; A245-V254 WeakPolarHBondContact O-CA 3.47Å; A245-D255 PolarHBondContact O-N 3.1Å; A245-W258 HydrophobicContact CB-CE3 3.98Å; A245-W258 HydrophobicContact CB-CZ3 3.69Å; A245-L358 HydrophobicContact CB-CD1 4.02Å
246	L	94.6	Very high	89.2	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.01	34%	0.343	C	S	.	.	B	Isolated β-bridge	trans	-121.5	134.9	-176.2	-53.5	177.4	0	0	0	109.9	Q242 S250 V254 A354 R357 L358	Q242-L246 HydrophobicContact CB-CD1 4.4Å; Q242-L246 WeakPolarHBondContact O-CB 3.39Å; Q242-L246 PolarHBondContact O-N 3.06Å; L246-S250 VanDerWaalsContact CD1-O 3.24Å; L246-S250 WeakPolarHBondContact CD1-O 3.5Å; L246-V254 HydrophobicContact CD2-CG2 3.87Å; L246-A354 HydrophobicContact CD1-CB 4.24Å; L246-R357 HydrophobicContact CD2-CB 4.4Å; L246-L358 HydrophobicContact CD2-CD1 4.16Å
247	K	89.8	Confident	89.4	Confident	94 Å²	94	53.1 Å²	53.1	41%	0.409	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	148	172.1	-63.6	-175.1	177.7	178.4	0	109.7	S249 G252 P253 D255	K247-S249 VanDerWaalsContact C-N 3.34Å; K247-S249 PolarHBondContact O-N 2.98Å; K247-G252 WeakPolarHBondContact O-CA 3.27Å; K247-G252 PolarHBondContact O-N 2.92Å; K247-P253 HydrophobicContact CB-CG 4.35Å; K247-P253 HydrophobicContact CD-CG 4.38Å; K247-P253 PolarHBondContact N-O 3.37Å; K247-D255 HydrophobicContact CG-CB 3.88Å
248	N	80.8	Confident	89.5	Confident	146 Å²	146	52 Å²	52	78%	0.781	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	40.3	176.9	-56.3	-24.1	0	0	0	114.9	S250	N248-S250 PolarHBondContact O-N 3.47Å
249	S	64.8	Low	89.7	Confident	92 Å²	92	52.8 Å²	52.8	64%	0.643	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.8	50.3	157.2	-52.9	0	0	0	0	116.9	K247	K247-S249 VanDerWaalsContact C-N 3.34Å; K247-S249 PolarHBondContact O-N 2.98Å
250	S	64.4	Low	89.8	Confident	58 Å²	58	49.7 Å²	49.7	41%	0.406	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	140.9	-20.9	145.5	-60.8	0	0	0	0	113.9	L246 N248	L246-S250 VanDerWaalsContact CD1-O 3.24Å; L246-S250 WeakPolarHBondContact CD1-O 3.5Å; N248-S250 PolarHBondContact O-N 3.47Å
251	T	69.2	Low	90	Very high	96 Å²	96	47.7 Å²	47.7	59%	0.589	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.4	5	-175.9	58	0	0	0	0	114.3	R357	T251-R357 PolarHBondContact O-NH1 2.69Å; T251-R357 PolarHBondContact O-NH2 3.24Å
252	G	82	Confident	90.1	Very high	12 Å²	12	52.7 Å²	52.7	12%	0.124	30%	0.303	C	S	.	.	S	Bend	trans	-81.6	179.9	175.3	0	0	0	0	0	113.8	K247 R357	K247-G252 WeakPolarHBondContact O-CA 3.27Å; K247-G252 PolarHBondContact O-N 2.92Å; G252-R357 PolarHBondContact O-NH1 3.39Å
253	P	92.1	Very high	90.3	Very high	90 Å²	90	51.3 Å²	51.3	58%	0.584	30%	0.297	S	S	*	.			trans	-65.5	157.3	176.9	28.7	-35.4	0	0	0	111.5	K247 D255	K247-P253 HydrophobicContact CB-CG 4.35Å; K247-P253 HydrophobicContact CD-CG 4.38Å; K247-P253 PolarHBondContact N-O 3.37Å; P253-D255 PolarHBondContact O-N 3.47Å
254	V	96.5	Very high	90.5	Very high	18 Å²	18	49.4 Å²	49.4	11%	0.109	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	-60.6	130.5	176.5	175.2	0	0	0	0	110.6	A245 L246 S256 V261 L358 F361	A245-V254 CarbonylContact O-C 3.59Å; A245-V254 WeakPolarHBondContact O-CA 3.47Å; L246-V254 HydrophobicContact CD2-CG2 3.87Å; V254-S256 PolarHBondContact O-N 3.41Å; V254-V261 HydrophobicContact CG1-CG1 3.68Å; V254-V261 HydrophobicContact CG1-CG2 4.09Å; V254-L358 HydrophobicContact CG1-CG 4.47Å; V254-L358 HydrophobicContact CG2-CD1 4.05Å; V254-L358 HydrophobicContact CG2-CG 4.27Å; V254-F361 HydrophobicContact CB-CB 4.07Å; V254-F361 HydrophobicContact CB-CD1 4.19Å; V254-F361 HydrophobicContact CB-CD2 3.81Å; V254-F361 HydrophobicContact CB-CE2 4.31Å; V254-F361 HydrophobicContact CB-CG 3.74Å; V254-F361 HydrophobicContact CG1-CB 4.44Å; V254-F361 HydrophobicContact CG1-CD1 3.72Å; V254-F361 HydrophobicContact CG1-CD2 4.13Å; V254-F361 HydrophobicContact CG1-CE1 3.94Å; V254-F361 HydrophobicContact CG1-CE2 4.33Å; V254-F361 HydrophobicContact CG1-CG 3.82Å; V254-F361 HydrophobicContact CG1-CZ 4.24Å; V254-F361 HydrophobicContact CG2-CB 3.66Å; V254-F361 HydrophobicContact CG2-CD1 4.46Å; V254-F361 HydrophobicContact CG2-CD2 4.34Å; V254-F361 HydrophobicContact CG2-CG 3.91Å
255	D	96.3	Very high	90.7	Very high	31 Å²	31	48 Å²	48	17%	0.166	28%	0.276	C	S	.	.			trans	-83.6	93.1	175.8	-172.7	8.1	0	0	0	111.4	A245 K247 P253 T257 W258 V261	A245-D255 PolarHBondContact O-N 3.1Å; K247-D255 HydrophobicContact CG-CB 3.88Å; P253-D255 PolarHBondContact O-N 3.47Å; D255-T257 VanDerWaalsContact CG-OG1 3.27Å; D255-T257 PolarHBondContact O-N 3.4Å; D255-T257 VanDerWaalsContact OD1-CB 3.32Å; D255-T257 WeakPolarHBondContact OD1-CB 3.39Å; D255-T257 WeakPolarHBondContact OD1-CG2 3.36Å; D255-T257 PolarHBondContact OD1-N 3.29Å; D255-T257 PolarHBondContact OD1-OG1 3.33Å; D255-T257 PolarHBondContact OD2-OG1 3.35Å; D255-W258 PolarHBondContact O-N 3.24Å; D255-V261 WeakPolarHBondContact O-CB 3.26Å
256	S	95.8	Very high	90.8	Very high	50 Å²	50	48 Å²	48	35%	0.35	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-7.4	175.7	65	0	0	0	0	114.3	V254 R262	V254-S256 PolarHBondContact O-N 3.41Å; S256-R262 WeakPolarHBondContact O-CB 3.47Å
257	T	95.8	Very high	91	Very high	91 Å²	91	48 Å²	48	56%	0.558	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-20.8	174.3	76.6	0	0	0	0	112.2	D255 S259 R262	D255-T257 VanDerWaalsContact CG-OG1 3.27Å; D255-T257 PolarHBondContact O-N 3.4Å; D255-T257 VanDerWaalsContact OD1-CB 3.32Å; D255-T257 WeakPolarHBondContact OD1-CB 3.39Å; D255-T257 WeakPolarHBondContact OD1-CG2 3.36Å; D255-T257 PolarHBondContact OD1-N 3.29Å; D255-T257 PolarHBondContact OD1-OG1 3.33Å; D255-T257 PolarHBondContact OD2-OG1 3.35Å; T257-S259 PolarHBondContact O-N 3.08Å; T257-R262 PolarHBondContact O-NH1 3.25Å
258	W	97.4	Very high	91.4	Very high	45 Å²	45	49.4 Å²	49.4	17%	0.17	28%	0.282	C	S	.	.	S	Bend	trans	-69.6	131.4	173.6	-176.8	45	0	0	0	110.7	Y228 F241 L244 A245 D255 A260 V261 R262	Y228-W258 HydrophobicContact CD2-CH2 4.09Å; Y228-W258 HydrophobicContact CD2-CZ2 4.1Å; Y228-W258 HydrophobicContact CG-CH2 4.42Å; F241-W258 AromaticContact CD2-CH2 3.71Å; F241-W258 HydrophobicContact CD2-CH2 3.71Å; F241-W258 HydrophobicContact CD2-CZ3 4.08Å; F241-W258 AromaticContact CE2-CH2 3.68Å; F241-W258 HydrophobicContact CE2-CH2 3.68Å; F241-W258 AromaticContact CE2-CZ3 3.73Å; F241-W258 HydrophobicContact CE2-CZ3 3.73Å; F241-W258 HydrophobicContact CZ-CZ3 4.14Å; L244-W258 HydrophobicContact CB-CD2 3.98Å; L244-W258 HydrophobicContact CB-CE3 4.17Å; L244-W258 HydrophobicContact CB-CH2 4.03Å; L244-W258 HydrophobicContact CB-CZ2 3.83Å; L244-W258 HydrophobicContact CB-CZ3 4.22Å; L244-W258 HydrophobicContact CD1-CH2 4.48Å; L244-W258 HydrophobicContact CD1-CZ2 3.81Å; L244-W258 HydrophobicContact CG-CZ2 4.49Å; A245-W258 HydrophobicContact CB-CE3 3.98Å; A245-W258 HydrophobicContact CB-CZ3 3.69Å; D255-W258 PolarHBondContact O-N 3.24Å; W258-A260 VanDerWaalsContact C-N 3.29Å; W258-A260 HydrophobicContact CD2-CB 3.82Å; W258-A260 HydrophobicContact CE3-CB 3.91Å; W258-A260 HydrophobicContact CH2-CB 3.63Å; W258-A260 HydrophobicContact CZ2-CB 3.53Å; W258-A260 HydrophobicContact CZ3-CB 3.8Å; W258-A260 PolarHBondContact O-N 3.04Å; W258-V261 HydrophobicContact CE3-CG2 3.7Å; W258-V261 HydrophobicContact CZ3-CG2 4.28Å; W258-V261 PolarHBondContact O-N 2.6Å; W258-R262 PolarHBondContact O-N 3.46Å
259	S	97.4	Very high	92.3	Very high	50 Å²	50	43.5 Å²	43.5	35%	0.35	25%	0.25	S	C	.	.	H	α-helix	trans	-60.2	-36.9	-172.9	60.7	0	0	0	0	113	T257 V261 R262 I263	T257-S259 PolarHBondContact O-N 3.08Å; S259-V261 PolarHBondContact O-N 3.38Å; S259-R262 PolarHBondContact O-N 3.1Å; S259-I263 WeakPolarHBondContact O-CD1 3.31Å; S259-I263 WeakPolarHBondContact O-CG1 3.43Å; S259-I263 PolarHBondContact O-N 2.92Å; S259-I263 VanDerWaalsContact O-N 3.08Å
260	A	97.9	Very high	93.9	Very high	3 Å²	3	39.1 Å²	39.1	3%	0.025	22%	0.219	C	C	.	.	H	α-helix	trans	-70.1	-15.2	176.6	0	0	0	0	0	113.2	R223 A224 D227 W258	R223-A260 VanDerWaalsContact NH2-C 3.3Å; R223-A260 PolarHBondContact NH2-O 3.13Å; A224-A260 WeakPolarHBondContact CB-O 3.41Å; D227-A260 HydrophobicContact CB-CB 4.06Å; W258-A260 VanDerWaalsContact C-N 3.29Å; W258-A260 HydrophobicContact CD2-CB 3.82Å; W258-A260 HydrophobicContact CE3-CB 3.91Å; W258-A260 HydrophobicContact CH2-CB 3.63Å; W258-A260 HydrophobicContact CZ2-CB 3.53Å; W258-A260 HydrophobicContact CZ3-CB 3.8Å; W258-A260 PolarHBondContact O-N 3.04Å
261	V	98.6	Very high	95.6	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-91.6	-50.6	167.1	171.2	0	0	0	0	110	V254 D255 W258 S259 I263 G264 L358 F361 Y362	V254-V261 HydrophobicContact CG1-CG1 3.68Å; V254-V261 HydrophobicContact CG1-CG2 4.09Å; D255-V261 WeakPolarHBondContact O-CB 3.26Å; W258-V261 HydrophobicContact CE3-CG2 3.7Å; W258-V261 HydrophobicContact CZ3-CG2 4.28Å; W258-V261 PolarHBondContact O-N 2.6Å; S259-V261 PolarHBondContact O-N 3.38Å; V261-I263 VanDerWaalsContact C-N 3.27Å; V261-I263 PolarHBondContact O-N 2.67Å; V261-I263 VanDerWaalsContact O-N 3.1Å; V261-G264 PolarHBondContact O-N 3.2Å; V261-L358 HydrophobicContact CG2-CD2 4.41Å; V261-F361 HydrophobicContact CG1-CD1 4.39Å; V261-F361 HydrophobicContact CG1-CE1 3.65Å; V261-F361 HydrophobicContact CG1-CZ 4.21Å; V261-Y362 VanDerWaalsContact CA-OH 3.24Å; V261-Y362 WeakPolarHBondContact CA-OH 3.4Å; V261-Y362 PolarHBondContact O-OH 3.49Å
262	R	98.6	Very high	97	Very high	105 Å²	105	36.7 Å²	36.7	40%	0.396	20%	0.196	S	C	.	.	H	α-helix	trans	-52.3	-40.3	-175.7	-172.4	171.6	57.9	-113.7	2.5	114	S256 T257 W258 S259 G264 L265 H269	S256-R262 WeakPolarHBondContact O-CB 3.47Å; T257-R262 PolarHBondContact O-NH1 3.25Å; W258-R262 PolarHBondContact O-N 3.46Å; S259-R262 PolarHBondContact O-N 3.1Å; R262-G264 PolarHBondContact O-N 2.65Å; R262-L265 WeakPolarHBondContact O-CB 3.28Å; R262-L265 PolarHBondContact O-N 3.1Å; R262-H269 PolarHBondContact O-NE2 3.26Å
263	I	98.8	Very high	97.8	Very high	15 Å²	15	36.1 Å²	36.1	8%	0.077	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-29.4	-179.7	-67.6	162.6	0	0	0	111.9	V135 K136 V196 S259 V261 L265 Y266	V135-I263 HydrophobicContact CB-CG2 4.48Å; K136-I263 HydrophobicContact CB-CD1 4.49Å; K136-I263 HydrophobicContact CD-CD1 4.11Å; V196-I263 HydrophobicContact CG1-CB 4.41Å; V196-I263 HydrophobicContact CG1-CG1 4.09Å; V196-I263 HydrophobicContact CG1-CG2 4.27Å; V196-I263 HydrophobicContact CG2-CG1 4.47Å; S259-I263 WeakPolarHBondContact O-CD1 3.31Å; S259-I263 WeakPolarHBondContact O-CG1 3.43Å; S259-I263 PolarHBondContact O-N 2.92Å; S259-I263 VanDerWaalsContact O-N 3.08Å; V261-I263 VanDerWaalsContact C-N 3.27Å; V261-I263 PolarHBondContact O-N 2.67Å; V261-I263 VanDerWaalsContact O-N 3.1Å; I263-L265 PolarHBondContact O-N 2.98Å; I263-Y266 WeakPolarHBondContact O-CD1 3.4Å; I263-Y266 WeakPolarHBondContact O-CE1 3.44Å
264	G	98.7	Very high	98.1	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-10.2	179.4	0	0	0	0	0	114.7	V261 R262 Y266	V261-G264 PolarHBondContact O-N 3.2Å; R262-G264 PolarHBondContact O-N 2.65Å; G264-Y266 PolarHBondContact O-N 3.24Å
265	L	98.8	Very high	98.2	Very high	9 Å²	9	40.3 Å²	40.3	5%	0.047	20%	0.202	C	C	.	.			trans	-78.9	63.6	178	-60.1	175.4	0	0	0	110.9	R262 I263 A267 K268 H269 F361 Y362 F365	R262-L265 WeakPolarHBondContact O-CB 3.28Å; R262-L265 PolarHBondContact O-N 3.1Å; I263-L265 PolarHBondContact O-N 2.98Å; L265-A267 PolarHBondContact O-N 3.31Å; L265-K268 HydrophobicContact CB-CB 4.21Å; L265-K268 WeakPolarHBondContact O-CB 3.37Å; L265-K268 PolarHBondContact O-N 3.14Å; L265-K268 VanDerWaalsContact O-N 3.16Å; L265-H269 PolarHBondContact O-CD2 2.93Å; L265-H269 PolarHBondContact O-N 2.86Å; L265-F361 HydrophobicContact CD2-CE1 3.82Å; L265-F361 HydrophobicContact CD2-CZ 3.96Å; L265-Y362 HydrophobicContact CD2-CD1 4.11Å; L265-Y362 HydrophobicContact CD2-CE1 4Å; L265-Y362 HydrophobicContact CG-CE1 4.48Å; L265-F365 HydrophobicContact CD2-CB 4.36Å; L265-F365 HydrophobicContact CD2-CD1 4.17Å; L265-F365 HydrophobicContact CD2-CD2 3.64Å; L265-F365 HydrophobicContact CD2-CE1 4.39Å; L265-F365 HydrophobicContact CD2-CE2 3.89Å; L265-F365 HydrophobicContact CD2-CG 3.79Å; L265-F365 HydrophobicContact CD2-CZ 4.26Å
266	Y	98.9	Very high	98.3	Very high	2 Å²	2	43.1 Å²	43.1	1%	0.008	21%	0.211	C	C	.	.	H	α-helix	trans	-59	-41.7	-168.8	-54.3	-36.7	0	0	0	113.7	V135 F195 V217 R218 P220 R223 I263 G264 K268 H269 L270 F369 W379	V135-Y266 HydrophobicContact CB-CE1 4.35Å; V135-Y266 HydrophobicContact CG1-CD1 4.14Å; V135-Y266 HydrophobicContact CG1-CE1 3.98Å; V135-Y266 HydrophobicContact CG2-CE1 3.89Å; F195-Y266 HydrophobicContact CE1-CD1 4.13Å; V217-Y266 HydrophobicContact CB-CD2 4.49Å; V217-Y266 HydrophobicContact CB-CE2 4.2Å; V217-Y266 HydrophobicContact CG1-CD2 4.28Å; V217-Y266 HydrophobicContact CG1-CE2 4.39Å; R218-Y266 VanDerWaalsContact O-CE2 3.28Å; R218-Y266 WeakPolarHBondContact O-CE2 3.41Å; R218-Y266 PolarHBondContact O-OH 2.79Å; P220-Y266 HydrophobicContact CG-CD2 4.33Å; P220-Y266 HydrophobicContact CG-CE2 3.69Å; R223-Y266 WeakPolarHBondContact CD-OH 3.35Å; I263-Y266 WeakPolarHBondContact O-CD1 3.4Å; I263-Y266 WeakPolarHBondContact O-CE1 3.44Å; G264-Y266 PolarHBondContact O-N 3.24Å; Y266-K268 VanDerWaalsContact C-N 3.33Å; Y266-K268 PolarHBondContact O-N 3.4Å; Y266-H269 PolarHBondContact O-N 3.41Å; Y266-L270 WeakPolarHBondContact O-CB 3.19Å; Y266-L270 PolarHBondContact O-N 3.31Å; Y266-F369 HydrophobicContact CD2-CD1 4.3Å; Y266-F369 HydrophobicContact CD2-CE1 4.3Å; Y266-W379 AromaticContact CD2-CH2 3.7Å; Y266-W379 HydrophobicContact CD2-CH2 3.7Å; Y266-W379 AromaticContact CD2-CZ3 3.69Å; Y266-W379 HydrophobicContact CD2-CZ3 3.69Å; Y266-W379 AromaticContact CE2-CH2 3.48Å; Y266-W379 HydrophobicContact CE2-CH2 3.48Å; Y266-W379 VanDerWaalsContact CE2-CH2 3.48Å; Y266-W379 HydrophobicContact CE2-CZ2 4.29Å; Y266-W379 AromaticContact CE2-CZ3 3.63Å; Y266-W379 HydrophobicContact CE2-CZ3 3.63Å
267	A	98.8	Very high	98.4	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.008	20%	0.195	C	C	.	.	H	α-helix	trans	-54.9	-47.1	176.4	0	0	0	0	0	112.1	L265 H269 L270 E271 R368 F369 M372	L265-A267 PolarHBondContact O-N 3.31Å; A267-H269 VanDerWaalsContact C-N 3.34Å; A267-H269 PolarHBondContact O-N 2.87Å; A267-L270 PolarHBondContact O-N 2.57Å; A267-E271 WeakPolarHBondContact O-CG 3.46Å; A267-E271 PolarHBondContact O-N 3.48Å; A267-R368 HydrophobicContact CB-CB 4.19Å; A267-R368 HydrophobicContact CB-CG 3.96Å; A267-F369 HydrophobicContact CB-CB 4.15Å; A267-M372 HydrophobicContact CB-SD 3.77Å
268	K	98.6	Very high	98.6	Very high	124 Å²	124	39.7 Å²	39.7	54%	0.539	19%	0.189	S	C	.	.	H	α-helix	trans	-61.1	-41.6	179.2	179	174.8	-179.3	169.3	0	112.4	L265 Y266	L265-K268 HydrophobicContact CB-CB 4.21Å; L265-K268 WeakPolarHBondContact O-CB 3.37Å; L265-K268 PolarHBondContact O-N 3.14Å; L265-K268 VanDerWaalsContact O-N 3.16Å; Y266-K268 VanDerWaalsContact C-N 3.33Å; Y266-K268 PolarHBondContact O-N 3.4Å
269	H	98.9	Very high	98.6	Very high	21 Å²	21	40.8 Å²	40.8	10%	0.097	20%	0.198	C	C	.	.	H	α-helix	trans	-71.8	-40.2	178.1	-62.6	-56.1	0	0	0	110.9	F195 R262 L265 Y266 A267 E271 N272 W273	F195-H269 HydrophobicContact CD1-CB 3.84Å; F195-H269 HydrophobicContact CE1-CB 3.41Å; F195-H269 VanDerWaalsContact CE1-CB 3.41Å; F195-H269 HydrophobicContact CE2-CB 4.35Å; F195-H269 HydrophobicContact CZ-CB 3.69Å; R262-H269 PolarHBondContact O-NE2 3.26Å; L265-H269 PolarHBondContact O-CD2 2.93Å; L265-H269 PolarHBondContact O-N 2.86Å; Y266-H269 PolarHBondContact O-N 3.41Å; A267-H269 VanDerWaalsContact C-N 3.34Å; A267-H269 PolarHBondContact O-N 2.87Å; H269-E271 VanDerWaalsContact C-N 3.29Å; H269-E271 PolarHBondContact O-N 2.9Å; H269-N272 WeakPolarHBondContact O-CB 3.24Å; H269-N272 PolarHBondContact O-N 3.1Å; H269-N272 VanDerWaalsContact O-N 3.08Å; H269-W273 VanDerWaalsContact O-CD1 3.3Å; H269-W273 PolarHBondContact O-N 3.27Å
270	L	98.9	Very high	98.7	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.5	-37.7	177.8	-179.7	57.5	0	0	0	112	Y266 A267 N272 W273 L274 F282 F284 F369 M372 T373	Y266-L270 WeakPolarHBondContact O-CB 3.19Å; Y266-L270 PolarHBondContact O-N 3.31Å; A267-L270 PolarHBondContact O-N 2.57Å; L270-N272 VanDerWaalsContact C-N 3.25Å; L270-N272 PolarHBondContact O-N 2.93Å; L270-W273 HydrophobicContact CD1-CB 4.45Å; L270-W273 WeakPolarHBondContact O-CA 3.35Å; L270-W273 WeakPolarHBondContact O-CB 3.38Å; L270-W273 PolarHBondContact O-N 2.59Å; L270-L274 HydrophobicContact CD1-CD1 4.25Å; L270-L274 HydrophobicContact CD1-CD2 4.19Å; L270-L274 HydrophobicContact CD1-CG 3.89Å; L270-L274 HydrophobicContact CD2-CD1 4.36Å; L270-L274 HydrophobicContact CG-CD1 3.86Å; L270-L274 HydrophobicContact CG-CG 4Å; L270-L274 WeakPolarHBondContact O-CG 3.38Å; L270-L274 PolarHBondContact O-N 3.14Å; L270-F282 HydrophobicContact CD1-CD1 4.38Å; L270-F282 HydrophobicContact CD1-CE1 4.37Å; L270-F284 HydrophobicContact CD1-CE1 4.12Å; L270-F284 HydrophobicContact CD1-CZ 3.67Å; L270-F284 HydrophobicContact CD2-CE1 4.14Å; L270-F284 HydrophobicContact CD2-CZ 3.7Å; L270-F284 HydrophobicContact CG-CZ 4.34Å; L270-F369 HydrophobicContact CB-CE2 4.49Å; L270-F369 HydrophobicContact CD2-CD2 4.14Å; L270-F369 HydrophobicContact CD2-CE2 3.88Å; L270-M372 HydrophobicContact CB-CE 3.96Å; L270-M372 HydrophobicContact CD2-CB 4.05Å; L270-M372 HydrophobicContact CD2-CE 3.75Å; L270-M372 HydrophobicContact CD2-SD 4.46Å; L270-M372 HydrophobicContact CG-CE 3.72Å; L270-T373 HydrophobicContact CD2-CG2 3.92Å
271	E	98.8	Very high	98.7	Very high	66 Å²	66	44.6 Å²	44.6	31%	0.308	22%	0.22	S	C	.	.	H	α-helix	trans	-56	-38.2	173.1	-74.8	161.1	-169.6	0	0	113.3	A267 H269 W273 Q275 R368 M372	A267-E271 WeakPolarHBondContact O-CG 3.46Å; A267-E271 PolarHBondContact O-N 3.48Å; H269-E271 VanDerWaalsContact C-N 3.29Å; H269-E271 PolarHBondContact O-N 2.9Å; E271-W273 VanDerWaalsContact C-N 3.31Å; E271-Q275 PolarHBondContact O-NE2 2.92Å; E271-R368 IonicContact OE1-CZ 2.75Å; E271-R368 IonicContact OE1-NE 3.24Å; E271-R368 PolarHBondContact OE1-NE 2.85Å; E271-R368 IonicContact OE1-NH1 3.33Å; E271-R368 IonicContact OE1-NH2 2.75Å; E271-R368 PolarHBondContact OE1-NH2 3.07Å; E271-M372 HydrophobicContact CG-CE 3.78Å
272	N	98.8	Very high	98.7	Very high	37 Å²	37	45.2 Å²	45.2	20%	0.198	22%	0.223	C	C	.	.	H	α-helix	trans	-66.2	-37	175.7	-170.6	51.7	0	0	0	111.7	R198 P201 H269 L270 Y276	R198-N272 PolarHBondContact O-ND2 3.27Å; P201-N272 WeakPolarHBondContact CG-ND2 3.35Å; H269-N272 WeakPolarHBondContact O-CB 3.24Å; H269-N272 PolarHBondContact O-N 3.1Å; H269-N272 VanDerWaalsContact O-N 3.08Å; L270-N272 VanDerWaalsContact C-N 3.25Å; L270-N272 PolarHBondContact O-N 2.93Å; N272-Y276 WeakPolarHBondContact O-CD2 3.08Å
273	W	98.9	Very high	98.8	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-73.1	-39	178.6	-81.1	91.8	0	0	0	112.9	I133 Y194 F195 A200 P201 V204 L213 H269 L270 E271 Q275 Y276 F277 F282	I133-W273 HydrophobicContact CB-CH2 4.18Å; I133-W273 HydrophobicContact CB-CZ2 4.15Å; I133-W273 HydrophobicContact CD1-CD2 3.77Å; I133-W273 HydrophobicContact CD1-CE3 3.92Å; I133-W273 HydrophobicContact CD1-CH2 3.75Å; I133-W273 HydrophobicContact CD1-CZ2 3.6Å; I133-W273 HydrophobicContact CD1-CZ3 3.9Å; I133-W273 HydrophobicContact CG1-CZ2 4.44Å; I133-W273 HydrophobicContact CG2-CH2 3.77Å; I133-W273 HydrophobicContact CG2-CZ2 4.25Å; I133-W273 HydrophobicContact CG2-CZ3 4.39Å; Y194-W273 WeakPolarHBondContact O-CZ2 3.35Å; F195-W273 AromaticContact CD2-CD1 3.97Å; F195-W273 AromaticContact CD2-NE1 3.79Å; F195-W273 PolarHBondContact O-NE1 2.6Å; A200-W273 HydrophobicContact CB-CH2 4.33Å; A200-W273 HydrophobicContact CB-CZ2 4.12Å; P201-W273 HydrophobicContact CB-CD2 4.01Å; P201-W273 HydrophobicContact CB-CE3 3.87Å; P201-W273 HydrophobicContact CB-CG 4.43Å; P201-W273 HydrophobicContact CB-CZ3 4.25Å; P201-W273 HydrophobicContact CG-CD2 3.6Å; P201-W273 HydrophobicContact CG-CE3 3.95Å; P201-W273 HydrophobicContact CG-CG 3.86Å; P201-W273 HydrophobicContact CG-CH2 4.48Å; P201-W273 HydrophobicContact CG-CZ2 4.15Å; P201-W273 HydrophobicContact CG-CZ3 4.39Å; V204-W273 HydrophobicContact CG2-CH2 4.28Å; L213-W273 HydrophobicContact CD1-CE3 3.56Å; L213-W273 HydrophobicContact CD1-CZ3 3.6Å; L213-W273 HydrophobicContact CD2-CZ3 3.97Å; L213-W273 HydrophobicContact CG-CZ3 4.42Å; H269-W273 VanDerWaalsContact O-CD1 3.3Å; H269-W273 PolarHBondContact O-N 3.27Å; L270-W273 HydrophobicContact CD1-CB 4.45Å; L270-W273 WeakPolarHBondContact O-CA 3.35Å; L270-W273 WeakPolarHBondContact O-CB 3.38Å; L270-W273 PolarHBondContact O-N 2.59Å; E271-W273 VanDerWaalsContact C-N 3.31Å; W273-Q275 PolarHBondContact O-N 2.75Å; W273-Y276 PolarHBondContact O-N 3.38Å; W273-F277 HydrophobicContact CE3-CD2 4.17Å; W273-F277 HydrophobicContact CE3-CE2 4.43Å; W273-F277 HydrophobicContact CZ3-CD2 4.46Å; W273-F277 HydrophobicContact CZ3-CE2 4.28Å; W273-F277 PolarHBondContact O-N 2.84Å; W273-F277 VanDerWaalsContact O-N 3.14Å; W273-F282 HydrophobicContact CB-CE1 3.92Å; W273-F282 HydrophobicContact CB-CZ 3.68Å; W273-F282 HydrophobicContact CD2-CE1 4.26Å; W273-F282 HydrophobicContact CD2-CZ 4.44Å; W273-F282 HydrophobicContact CE3-CE1 4.12Å; W273-F282 HydrophobicContact CE3-CZ 4.08Å; W273-F282 HydrophobicContact CG-CE1 4.2Å; W273-F282 HydrophobicContact CG-CZ 4.32Å
274	L	98.8	Very high	98.8	Very high	61 Å²	61	40.8 Å²	40.8	32%	0.319	21%	0.206	S	C	.	.	H	α-helix	trans	-69.1	-14.1	-178.6	-69.2	178	0	0	0	113.9	L270 Y276 F277 L279 F282 M372	L270-L274 HydrophobicContact CD1-CD1 4.25Å; L270-L274 HydrophobicContact CD1-CD2 4.19Å; L270-L274 HydrophobicContact CD1-CG 3.89Å; L270-L274 HydrophobicContact CD2-CD1 4.36Å; L270-L274 HydrophobicContact CG-CD1 3.86Å; L270-L274 HydrophobicContact CG-CG 4Å; L270-L274 WeakPolarHBondContact O-CG 3.38Å; L270-L274 PolarHBondContact O-N 3.14Å; L274-Y276 PolarHBondContact O-N 2.91Å; L274-F277 WeakPolarHBondContact CA-O 3.47Å; L274-L279 HydrophobicContact CD2-CB 4.09Å; L274-L279 HydrophobicContact CD2-CD1 4.04Å; L274-F282 HydrophobicContact CD2-CD2 4.37Å; L274-F282 HydrophobicContact CD2-CE2 4.07Å; L274-M372 HydrophobicContact CD1-CE 3.75Å
275	Q	98.6	Very high	98.8	Very high	135 Å²	135	40.8 Å²	40.8	63%	0.631	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66	-20.5	168.9	-71.5	170.1	57.6	0	0	113.1	E271 W273	E271-Q275 PolarHBondContact O-NE2 2.92Å; W273-Q275 PolarHBondContact O-N 2.75Å
276	Y	98.8	Very high	98.8	Very high	91 Å²	91	40.6 Å²	40.6	36%	0.357	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.4	-22.4	-172.2	-63.7	-88.3	0	0	0	114.2	P201 S202 C205 N272 W273 L274	P201-Y276 HydrophobicContact CB-CD2 3.48Å; P201-Y276 VanDerWaalsContact CB-CD2 3.48Å; P201-Y276 HydrophobicContact CB-CE2 4.11Å; P201-Y276 HydrophobicContact CB-CG 4Å; S202-Y276 VanDerWaalsContact CB-CE1 3.46Å; C205-Y276 HydrophobicContact CB-CD1 4.25Å; C205-Y276 PolarHBondContact SG-O 2.86Å; N272-Y276 WeakPolarHBondContact O-CD2 3.08Å; W273-Y276 PolarHBondContact O-N 3.38Å; L274-Y276 PolarHBondContact O-N 2.91Å
277	F	98.8	Very high	98.7	Very high	3 Å²	3	41 Å²	41	1%	0.013	21%	0.21	C	C	.	.	S	Bend	trans	-134.3	137.8	-176.9	-71.5	-85.8	0	0	0	110.5	P201 V204 C205 R209 L213 W273 L274 H281 F282	P201-F277 WeakPolarHBondContact O-CE2 3.41Å; V204-F277 HydrophobicContact CB-CE2 4.27Å; V204-F277 HydrophobicContact CB-CZ 4.22Å; V204-F277 HydrophobicContact CG1-CE2 4.27Å; V204-F277 HydrophobicContact CG1-CZ 3.83Å; C205-F277 VanDerWaalsContact CA-CZ 3.46Å; C205-F277 HydrophobicContact CB-CE2 3.7Å; C205-F277 HydrophobicContact CB-CZ 3.77Å; R209-F277 WeakPolarHBondContact O-CE1 3.18Å; L213-F277 HydrophobicContact CD1-CB 4.21Å; L213-F277 HydrophobicContact CD1-CD1 4.08Å; L213-F277 HydrophobicContact CD1-CD2 3.74Å; L213-F277 HydrophobicContact CD1-CE1 4.38Å; L213-F277 HydrophobicContact CD1-CE2 4.07Å; L213-F277 HydrophobicContact CD1-CG 3.74Å; L213-F277 HydrophobicContact CD1-CZ 4.37Å; W273-F277 HydrophobicContact CE3-CD2 4.17Å; W273-F277 HydrophobicContact CE3-CE2 4.43Å; W273-F277 HydrophobicContact CZ3-CD2 4.46Å; W273-F277 HydrophobicContact CZ3-CE2 4.28Å; W273-F277 PolarHBondContact O-N 2.84Å; W273-F277 VanDerWaalsContact O-N 3.14Å; L274-F277 WeakPolarHBondContact CA-O 3.47Å; F277-H281 HydrophobicContact CD1-CB 4.39Å; F277-H281 AromaticContact CD1-ND1 3.72Å; F277-F282 HydrophobicContact CB-CE2 3.5Å; F277-F282 HydrophobicContact CB-CZ 3.8Å; F277-F282 HydrophobicContact CG-CZ 4.49Å
278	P	98.5	Very high	98.7	Very high	66 Å²	66	43.8 Å²	43.8	43%	0.429	22%	0.223	S	C	.	.			trans	-67.9	152.9	171.9	31.2	-35.3	0	0	0	110.4	S280 H281 F282	P278-S280 PolarHBondContact O-N 2.84Å; P278-S280 VanDerWaalsContact O-N 3.11Å; P278-H281 HydrophobicContact CG-CB 4.46Å; P278-H281 WeakPolarHBondContact O-CB 3.25Å; P278-H281 PolarHBondContact O-N 3.16Å; P278-F282 WeakPolarHBondContact O-CD2 3.28Å
279	L	98.5	Very high	98.7	Very high	68 Å²	68	42.9 Å²	42.9	36%	0.356	22%	0.216	S	C	.	.	G	3₁₀ helix	trans	-56.3	-30.7	179.6	-171.6	69.4	0	0	0	112.7	L274 H281 F282 F284 M372	L274-L279 HydrophobicContact CD2-CB 4.09Å; L274-L279 HydrophobicContact CD2-CD1 4.04Å; L279-H281 PolarHBondContact O-N 3.15Å; L279-H281 VanDerWaalsContact O-N 3.14Å; L279-F282 WeakPolarHBondContact O-CB 3.33Å; L279-F282 PolarHBondContact O-N 3.45Å; L279-F284 HydrophobicContact CD1-CE2 3.81Å; L279-F284 HydrophobicContact CD1-CZ 4.18Å; L279-M372 WeakPolarHBondContact CD2-O 3.12Å
280	S	98.4	Very high	98.7	Very high	92 Å²	92	42 Å²	42	64%	0.643	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-62.1	-17.6	176.6	57.6	0	0	0	0	114.3	P278 F282	P278-S280 PolarHBondContact O-N 2.84Å; P278-S280 VanDerWaalsContact O-N 3.11Å; S280-F282 VanDerWaalsContact C-N 3.28Å
281	H	98.7	Very high	98.6	Very high	40 Å²	40	44.4 Å²	44.4	19%	0.185	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-86	0.7	173.5	-71.3	-161.4	0	0	0	112.6	R209 L213 F277 P278 L279 F304	R209-H281 PolarHBondContact O-CE1 3.48Å; R209-H281 PolarHBondContact O-ND1 3.4Å; L213-H281 PolarHBondContact N-O 2.95Å; F277-H281 HydrophobicContact CD1-CB 4.39Å; F277-H281 AromaticContact CD1-ND1 3.72Å; P278-H281 HydrophobicContact CG-CB 4.46Å; P278-H281 WeakPolarHBondContact O-CB 3.25Å; P278-H281 PolarHBondContact O-N 3.16Å; L279-H281 PolarHBondContact O-N 3.15Å; L279-H281 VanDerWaalsContact O-N 3.14Å; H281-F304 WeakPolarHBondContact O-CZ 2.99Å
282	F	98.9	Very high	98.6	Very high	14 Å²	14	46 Å²	46	6%	0.061	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	141.3	178.6	-64.9	-97.4	0	0	0	111.7	I133 L213 V215 L270 W273 L274 F277 P278 L279 S280 F284	I133-F282 HydrophobicContact CD1-CE1 4.13Å; L213-F282 HydrophobicContact CB-CD1 3.79Å; L213-F282 HydrophobicContact CB-CE1 3.82Å; L213-F282 HydrophobicContact CB-CG 4.39Å; L213-F282 HydrophobicContact CB-CZ 4.43Å; L213-F282 HydrophobicContact CD1-CD1 4.21Å; L213-F282 HydrophobicContact CD1-CE1 3.43Å; L213-F282 VanDerWaalsContact CD1-CE1 3.43Å; L213-F282 HydrophobicContact CD1-CE2 4.07Å; L213-F282 HydrophobicContact CD1-CZ 3.32Å; L213-F282 HydrophobicContact CG-CE1 4.28Å; L213-F282 HydrophobicContact CG-CZ 4.49Å; L213-F282 CarbonylContact O-C 3.54Å; L213-F282 VanDerWaalsContact O-CA 3.28Å; L213-F282 WeakPolarHBondContact O-CA 3.5Å; V215-F282 HydrophobicContact CG2-CD1 4.33Å; L270-F282 HydrophobicContact CD1-CD1 4.38Å; L270-F282 HydrophobicContact CD1-CE1 4.37Å; W273-F282 HydrophobicContact CB-CE1 3.92Å; W273-F282 HydrophobicContact CB-CZ 3.68Å; W273-F282 HydrophobicContact CD2-CE1 4.26Å; W273-F282 HydrophobicContact CD2-CZ 4.44Å; W273-F282 HydrophobicContact CE3-CE1 4.12Å; W273-F282 HydrophobicContact CE3-CZ 4.08Å; W273-F282 HydrophobicContact CG-CE1 4.2Å; W273-F282 HydrophobicContact CG-CZ 4.32Å; L274-F282 HydrophobicContact CD2-CD2 4.37Å; L274-F282 HydrophobicContact CD2-CE2 4.07Å; F277-F282 HydrophobicContact CB-CE2 3.5Å; F277-F282 HydrophobicContact CB-CZ 3.8Å; F277-F282 HydrophobicContact CG-CZ 4.49Å; P278-F282 WeakPolarHBondContact O-CD2 3.28Å; L279-F282 WeakPolarHBondContact O-CB 3.33Å; L279-F282 PolarHBondContact O-N 3.45Å; S280-F282 VanDerWaalsContact C-N 3.28Å; F282-F284 HydrophobicContact CB-CD2 4.41Å; F282-F284 HydrophobicContact CB-CE2 3.62Å; F282-F284 HydrophobicContact CB-CZ 3.71Å; F282-F284 HydrophobicContact CD1-CZ 4.22Å; F282-F284 HydrophobicContact CG-CE2 4.46Å; F282-F284 HydrophobicContact CG-CZ 4.1Å
283	L	98.9	Very high	98.5	Very high	17 Å²	17	46.8 Å²	46.8	9%	0.089	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.5	160.1	178.8	70.4	0	0	0	109.6	L213 I214 V215 V285 V301 F304	L213-L283 PolarHBondContact O-N 3.04Å; I214-L283 WeakPolarHBondContact CA-O 3.48Å; I214-L283 HydrophobicContact CG1-CB 4.39Å; V215-L283 PolarHBondContact N-O 2.9Å; L283-V285 HydrophobicContact CD2-CG2 3.85Å; L283-V285 HydrophobicContact CG-CG2 4.02Å; L283-V301 HydrophobicContact CD2-CB 4.04Å; L283-V301 HydrophobicContact CD2-CG1 4.36Å; L283-V301 HydrophobicContact CD2-CG2 3.61Å; L283-F304 HydrophobicContact CB-CB 4.33Å; L283-F304 HydrophobicContact CB-CD1 3.54Å; L283-F304 HydrophobicContact CB-CD2 3.9Å; L283-F304 HydrophobicContact CB-CE1 3.67Å; L283-F304 HydrophobicContact CB-CE2 4.04Å; L283-F304 HydrophobicContact CB-CG 3.64Å; L283-F304 HydrophobicContact CB-CZ 3.93Å; L283-F304 HydrophobicContact CD1-CB 4.35Å; L283-F304 HydrophobicContact CD1-CG 4.47Å; L283-F304 HydrophobicContact CD2-CB 3.79Å; L283-F304 HydrophobicContact CD2-CD1 3.89Å; L283-F304 HydrophobicContact CD2-CG 3.95Å; L283-F304 HydrophobicContact CG-CB 4.38Å; L283-F304 HydrophobicContact CG-CD1 4.31Å; L283-F304 HydrophobicContact CG-CG 4.23Å
284	F	98.9	Very high	98.5	Very high	10 Å²	10	47.3 Å²	47.3	4%	0.044	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	112.4	173.3	-55.4	-82.8	0	0	0	109.7	V215 L270 L279 F282 R300 F369 T373 Q375 F377	V215-F284 HydrophobicContact CB-CD1 3.84Å; V215-F284 HydrophobicContact CB-CE1 4.15Å; V215-F284 HydrophobicContact CG1-CD1 4.43Å; V215-F284 HydrophobicContact CG2-CD1 4.21Å; V215-F284 HydrophobicContact CG2-CE1 4.03Å; V215-F284 WeakPolarHBondContact O-CA 3.32Å; L270-F284 HydrophobicContact CD1-CE1 4.12Å; L270-F284 HydrophobicContact CD1-CZ 3.67Å; L270-F284 HydrophobicContact CD2-CE1 4.14Å; L270-F284 HydrophobicContact CD2-CZ 3.7Å; L270-F284 HydrophobicContact CG-CZ 4.34Å; L279-F284 HydrophobicContact CD1-CE2 3.81Å; L279-F284 HydrophobicContact CD1-CZ 4.18Å; F282-F284 HydrophobicContact CB-CD2 4.41Å; F282-F284 HydrophobicContact CB-CE2 3.62Å; F282-F284 HydrophobicContact CB-CZ 3.71Å; F282-F284 HydrophobicContact CD1-CZ 4.22Å; F282-F284 HydrophobicContact CG-CE2 4.46Å; F282-F284 HydrophobicContact CG-CZ 4.1Å; F284-R300 PolarHBondContact O-NH1 2.98Å; F284-R300 VanDerWaalsContact O-NH1 3.08Å; F284-R300 PolarHBondContact O-NH2 2.91Å; F284-F369 HydrophobicContact CD1-CE2 4.15Å; F284-F369 AromaticContact CD1-CZ 3.56Å; F284-F369 HydrophobicContact CD1-CZ 3.56Å; F284-F369 AromaticContact CE1-CE2 3.92Å; F284-F369 HydrophobicContact CE1-CE2 3.92Å; F284-F369 AromaticContact CE1-CZ 3.83Å; F284-F369 HydrophobicContact CE1-CZ 3.83Å; F284-F369 HydrophobicContact CG-CZ 4.26Å; F284-T373 HydrophobicContact CD1-CG2 4.04Å; F284-T373 HydrophobicContact CD2-CG2 3.5Å; F284-T373 VanDerWaalsContact CD2-CG2 3.5Å; F284-T373 HydrophobicContact CE1-CG2 3.95Å; F284-T373 HydrophobicContact CE2-CG2 3.42Å; F284-T373 VanDerWaalsContact CE2-CG2 3.42Å; F284-T373 HydrophobicContact CG-CG2 3.82Å; F284-T373 HydrophobicContact CZ-CG2 3.65Å; F284-Q375 PolarHBondContact O-OE1 3.14Å; F284-F377 HydrophobicContact CB-CE1 4.35Å; F284-F377 HydrophobicContact CB-CZ 3.62Å
285	V	98.9	Very high	98.4	Very high	0 Å²	0	46 Å²	46	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	129.8	-178.5	177.1	0	0	0	0	108.4	L143 I214 V215 V216 V217 L283 G287 E297 V301	L143-V285 HydrophobicContact CD2-CG2 4.32Å; I214-V285 HydrophobicContact CG2-CG2 3.75Å; V215-V285 PolarHBondContact O-N 2.85Å; V216-V285 WeakPolarHBondContact CA-O 3.35Å; V216-V285 HydrophobicContact CG1-CB 4.4Å; V216-V285 HydrophobicContact CG1-CG1 4.25Å; V216-V285 HydrophobicContact CG2-CB 4.27Å; V217-V285 WeakPolarHBondContact CG2-O 3.24Å; V217-V285 PolarHBondContact N-O 2.76Å; L283-V285 HydrophobicContact CD2-CG2 3.85Å; L283-V285 HydrophobicContact CG-CG2 4.02Å; V285-G287 PolarHBondContact O-N 3.05Å; V285-E297 WeakPolarHBondContact CA-OE2 3.37Å; V285-E297 HydrophobicContact CG1-CB 4.31Å; V285-E297 HydrophobicContact CG1-CG 4.42Å; V285-E297 WeakPolarHBondContact CG1-OE2 3.27Å; V285-V301 HydrophobicContact CG2-CG2 3.7Å
286	S	98.8	Very high	98.4	Very high	5 Å²	5	40.7 Å²	40.7	4%	0.035	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	118.6	175.7	168.3	0	0	0	0	109.5	E288 R289 L290 E297	S286-E288 VanDerWaalsContact C-N 3.28Å; S286-E288 PolarHBondContact O-N 3.47Å; S286-E288 PolarHBondContact OG-N 3.37Å; S286-E288 PolarHBondContact OG-OE2 3.15Å; S286-R289 PolarHBondContact O-N 2.95Å; S286-R289 PolarHBondContact OG-N 3.07Å; S286-L290 VanDerWaalsContact O-CB 3.3Å; S286-L290 WeakPolarHBondContact O-CB 3.46Å; S286-L290 PolarHBondContact O-N 3.49Å; S286-E297 PolarHBondContact N-OE2 3.4Å
287	G	98.5	Very high	98.4	Very high	9 Å²	9	36.3 Å²	36.3	9%	0.093	21%	0.213	C	C	.	.	H	α-helix	trans	-64.7	-33.7	175.1	0	0	0	0	0	112.4	V217 V285 V291	V217-G287 VanDerWaalsContact O-CA 3.24Å; V217-G287 WeakPolarHBondContact O-CA 3.34Å; V217-G287 PolarHBondContact O-N 3.15Å; V285-G287 PolarHBondContact O-N 3.05Å; G287-V291 WeakPolarHBondContact O-CG2 3.2Å; G287-V291 PolarHBondContact O-N 3.27Å
288	E	98.6	Very high	98.4	Very high	61 Å²	61	36.2 Å²	36.2	29%	0.285	21%	0.212	S	C	.	.	H	α-helix	trans	-64.7	-50.8	173.6	-66.5	72	-156.1	0	0	111	R218 D219 S286 L290 V291 S292 W379	R218-E288 WeakPolarHBondContact CA-OE1 3.22Å; R218-E288 WeakPolarHBondContact CG-OE1 3.5Å; D219-E288 PolarHBondContact N-OE1 3.4Å; S286-E288 VanDerWaalsContact C-N 3.28Å; S286-E288 PolarHBondContact O-N 3.47Å; S286-E288 PolarHBondContact OG-N 3.37Å; S286-E288 PolarHBondContact OG-OE2 3.15Å; E288-L290 VanDerWaalsContact C-N 3.3Å; E288-L290 PolarHBondContact O-N 3.34Å; E288-V291 WeakPolarHBondContact O-CB 3.33Å; E288-V291 PolarHBondContact O-N 2.79Å; E288-S292 PolarHBondContact O-N 3.19Å; E288-S292 PolarHBondContact O-OG 3.33Å; E288-W379 PolarHBondContact OE2-NE1 3.47Å
289	R	98.3	Very high	98.4	Very high	104 Å²	104	33.4 Å²	33.4	39%	0.392	20%	0.195	S	C	.	.	H	α-helix	trans	-67.1	-30.2	176.6	-63.4	-170.3	75.7	-141.2	6.6	112.6	S286 V291 S292 D293 E297	S286-R289 PolarHBondContact O-N 2.95Å; S286-R289 PolarHBondContact OG-N 3.07Å; R289-V291 PolarHBondContact O-N 3.24Å; R289-V291 VanDerWaalsContact O-N 3.15Å; R289-S292 WeakPolarHBondContact CA-OG 3.3Å; R289-S292 PolarHBondContact O-N 2.98Å; R289-D293 IonicContact NH2-OD2 2.76Å; R289-D293 PolarHBondContact NH2-OD2 2.75Å; R289-D293 CarbonylContact O-C 3.54Å; R289-D293 WeakPolarHBondContact O-CA 3.41Å; R289-D293 PolarHBondContact O-N 3.25Å; R289-D293 VanDerWaalsContact O-O 3.06Å; R289-E297 HydrophobicContact CB-CG 3.55Å; R289-E297 IonicContact CZ-OE1 3.46Å; R289-E297 IonicContact NE-OE1 2.78Å; R289-E297 IonicContact NH1-OE1 3.59Å; R289-E297 PolarHBondContact NH1-OE1 2.8Å
290	L	97.9	Very high	98.4	Very high	4 Å²	4	33.4 Å²	33.4	2%	0.021	19%	0.191	C	C	.	.	H	α-helix	trans	-62.9	-21.3	173.5	-168.8	65.9	0	0	0	112.4	A142 L143 F146 V216 S286 E288 E297	A142-L290 HydrophobicContact CB-CD2 4.14Å; L143-L290 HydrophobicContact CB-CD2 4.01Å; L143-L290 HydrophobicContact CD1-CD1 4.44Å; F146-L290 HydrophobicContact CD2-CD1 3.95Å; F146-L290 HydrophobicContact CE2-CD1 4.13Å; F146-L290 HydrophobicContact CE2-CG 4.27Å; V216-L290 HydrophobicContact CG1-CD2 4.21Å; S286-L290 VanDerWaalsContact O-CB 3.3Å; S286-L290 WeakPolarHBondContact O-CB 3.46Å; S286-L290 PolarHBondContact O-N 3.49Å; E288-L290 VanDerWaalsContact C-N 3.3Å; E288-L290 PolarHBondContact O-N 3.34Å; L290-E297 HydrophobicContact CD1-CB 4.16Å
291	V	97.3	Very high	98.4	Very high	50 Å²	50	29 Å²	29	30%	0.303	16%	0.16	S	C	.	.	H	α-helix	trans	-89.6	-47.8	172.7	177.2	0	0	0	0	111.5	G287 E288 R289 F324	G287-V291 WeakPolarHBondContact O-CG2 3.2Å; G287-V291 PolarHBondContact O-N 3.27Å; E288-V291 WeakPolarHBondContact O-CB 3.33Å; E288-V291 PolarHBondContact O-N 2.79Å; R289-V291 PolarHBondContact O-N 3.24Å; R289-V291 VanDerWaalsContact O-N 3.15Å; V291-F324 HydrophobicContact CG1-CD1 4.05Å; V291-F324 HydrophobicContact CG1-CE1 4.38Å; V291-F324 HydrophobicContact CG2-CD1 3.98Å; V291-F324 HydrophobicContact CG2-CE1 4.04Å
292	S	97.7	Very high	98.4	Very high	99 Å²	99	27.1 Å²	27.1	69%	0.692	15%	0.151	S	C	*	.	H	α-helix	trans	-80.4	-35.3	-173.9	59.1	0	0	0	0	114.2	E288 R289	E288-S292 PolarHBondContact O-N 3.19Å; E288-S292 PolarHBondContact O-OG 3.33Å; R289-S292 WeakPolarHBondContact CA-OG 3.3Å; R289-S292 PolarHBondContact O-N 2.98Å
293	D	98.1	Very high	98.4	Very high	54 Å²	54	30.3 Å²	30.3	29%	0.289	17%	0.169	S	C	.	.			trans	-140.5	71.9	177.7	177.8	18.1	0	0	0	110.5	R289 S295 G296 E297	R289-D293 IonicContact NH2-OD2 2.76Å; R289-D293 PolarHBondContact NH2-OD2 2.75Å; R289-D293 CarbonylContact O-C 3.54Å; R289-D293 WeakPolarHBondContact O-CA 3.41Å; R289-D293 PolarHBondContact O-N 3.25Å; R289-D293 VanDerWaalsContact O-O 3.06Å; D293-S295 PolarHBondContact O-N 2.86Å; D293-S295 PolarHBondContact OD1-OG 3.31Å; D293-G296 PolarHBondContact O-N 2.95Å; D293-G296 PolarHBondContact OD1-N 2.83Å; D293-G296 WeakPolarHBondContact OD2-CA 3.42Å; D293-E297 PolarHBondContact O-N 3.27Å
294	P	98.1	Very high	98.4	Very high	11 Å²	11	31.2 Å²	31.2	7%	0.071	17%	0.172	C	C	.	.	H	α-helix	trans	-59.1	-35.2	179.6	23.4	-34.1	0	0	0	112.1	F146 M298 F316 P325	F146-P294 HydrophobicContact CD2-CB 4.39Å; F146-P294 HydrophobicContact CE2-CB 3.99Å; P294-M298 VanDerWaalsContact O-CB 3.27Å; P294-M298 WeakPolarHBondContact O-CB 3.34Å; P294-M298 WeakPolarHBondContact O-CG 3.4Å; P294-M298 PolarHBondContact O-N 3.25Å; P294-F316 HydrophobicContact CB-CD1 3.99Å; P294-F316 HydrophobicContact CB-CD2 4.23Å; P294-F316 HydrophobicContact CB-CE1 3.94Å; P294-F316 HydrophobicContact CB-CE2 4.18Å; P294-F316 HydrophobicContact CB-CG 4.14Å; P294-F316 HydrophobicContact CB-CZ 4.04Å; P294-F316 HydrophobicContact CG-CB 4.15Å; P294-F316 HydrophobicContact CG-CD1 3.99Å; P294-F316 HydrophobicContact CG-CD2 4.03Å; P294-F316 HydrophobicContact CG-CE1 4.44Å; P294-F316 HydrophobicContact CG-CE2 4.47Å; P294-F316 HydrophobicContact CG-CG 3.77Å; P294-P325 HydrophobicContact CG-CB 3.97Å; P294-P325 HydrophobicContact CG-CG 4.27Å
295	S	97.7	Very high	98.4	Very high	32 Å²	32	31.1 Å²	31.1	22%	0.224	17%	0.172	C	C	.	.	H	α-helix	trans	-61.9	-45	177.5	32.6	0	0	0	0	113	D293 M298 G299	D293-S295 PolarHBondContact O-N 2.86Å; D293-S295 PolarHBondContact OD1-OG 3.31Å; S295-M298 PolarHBondContact O-N 3.02Å; S295-G299 PolarHBondContact O-N 3.09Å
296	G	98.3	Very high	98.4	Very high	24 Å²	24	34.2 Å²	34.2	25%	0.247	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-47.2	178.8	0	0	0	0	0	112.4	D293 M298 G299 R300	D293-G296 PolarHBondContact O-N 2.95Å; D293-G296 PolarHBondContact OD1-N 2.83Å; D293-G296 WeakPolarHBondContact OD2-CA 3.42Å; G296-M298 PolarHBondContact O-N 3.34Å; G296-G299 PolarHBondContact O-N 3.3Å; G296-R300 PolarHBondContact O-N 3.43Å
297	E	98.5	Very high	98.3	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-65.4	-39	176.5	-72.4	-60.9	112.2	0	0	111.7	V285 S286 R289 L290 D293 G299 R300 V301	V285-E297 WeakPolarHBondContact CA-OE2 3.37Å; V285-E297 HydrophobicContact CG1-CB 4.31Å; V285-E297 HydrophobicContact CG1-CG 4.42Å; V285-E297 WeakPolarHBondContact CG1-OE2 3.27Å; S286-E297 PolarHBondContact N-OE2 3.4Å; R289-E297 HydrophobicContact CB-CG 3.55Å; R289-E297 IonicContact CZ-OE1 3.46Å; R289-E297 IonicContact NE-OE1 2.78Å; R289-E297 IonicContact NH1-OE1 3.59Å; R289-E297 PolarHBondContact NH1-OE1 2.8Å; L290-E297 HydrophobicContact CD1-CB 4.16Å; D293-E297 PolarHBondContact O-N 3.27Å; E297-G299 VanDerWaalsContact C-N 3.28Å; E297-G299 PolarHBondContact O-N 2.98Å; E297-R300 WeakPolarHBondContact O-CB 3.11Å; E297-R300 PolarHBondContact O-N 3.44Å; E297-R300 IonicContact OE1-NH1 2.6Å; E297-R300 PolarHBondContact OE1-NH1 3.43Å; E297-R300 IonicContact OE2-NH1 3.38Å; E297-R300 PolarHBondContact OE2-NH1 3.26Å; E297-V301 VanDerWaalsContact O-CG2 3.27Å; E297-V301 WeakPolarHBondContact O-CG2 3.37Å; E297-V301 PolarHBondContact O-N 3.06Å
298	M	98.6	Very high	98.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-64.7	-30.6	175.6	-73.4	-56.7	-49.7	0	0	113.1	L143 F146 L147 P294 S295 G296 V301 Q302 I311 F316	L143-M298 HydrophobicContact CD1-SD 3.75Å; F146-M298 HydrophobicContact CB-CE 4.37Å; F146-M298 HydrophobicContact CB-CG 4.31Å; F146-M298 HydrophobicContact CB-SD 3.69Å; F146-M298 HydrophobicContact CD2-SD 4.48Å; L147-M298 HydrophobicContact CB-CE 4.31Å; L147-M298 HydrophobicContact CD2-CE 3.36Å; L147-M298 HydrophobicContact CG-CE 3.61Å; L147-M298 HydrophobicContact CG-SD 4.32Å; P294-M298 VanDerWaalsContact O-CB 3.27Å; P294-M298 WeakPolarHBondContact O-CB 3.34Å; P294-M298 WeakPolarHBondContact O-CG 3.4Å; P294-M298 PolarHBondContact O-N 3.25Å; S295-M298 PolarHBondContact O-N 3.02Å; G296-M298 PolarHBondContact O-N 3.34Å; M298-V301 PolarHBondContact O-N 3.47Å; M298-Q302 WeakPolarHBondContact O-CB 3.34Å; M298-Q302 VanDerWaalsContact O-CG 3.26Å; M298-Q302 WeakPolarHBondContact O-CG 3.3Å; M298-Q302 PolarHBondContact O-N 3.18Å; M298-Q302 PolarHBondContact O-NE2 3.11Å; M298-I311 HydrophobicContact CB-CB 4.5Å; M298-I311 HydrophobicContact CB-CG2 4.04Å; M298-I311 HydrophobicContact CE-CB 4.47Å; M298-I311 HydrophobicContact CE-CD1 3.47Å; M298-I311 VanDerWaalsContact CE-CD1 3.47Å; M298-I311 HydrophobicContact CE-CG2 4.34Å; M298-I311 HydrophobicContact CG-CG2 4.14Å; M298-F316 HydrophobicContact CG-CZ 4.01Å
299	G	98.7	Very high	98.3	Very high	7 Å²	7	46.8 Å²	46.8	7%	0.072	25%	0.251	C	S	.	.	H	α-helix	trans	-58.8	-49.6	170.4	0	0	0	0	0	111.9	S295 G296 E297 V301 Q302 D303	S295-G299 PolarHBondContact O-N 3.09Å; G296-G299 PolarHBondContact O-N 3.3Å; E297-G299 VanDerWaalsContact C-N 3.28Å; E297-G299 PolarHBondContact O-N 2.98Å; G299-V301 VanDerWaalsContact C-N 3.32Å; G299-V301 PolarHBondContact O-N 2.84Å; G299-Q302 PolarHBondContact O-N 3.26Å; G299-D303 PolarHBondContact O-N 2.87Å; G299-D303 VanDerWaalsContact O-N 3.15Å
300	R	98.7	Very high	98.3	Very high	69 Å²	69	44.4 Å²	44.4	26%	0.26	25%	0.248	S	C	.	.	H	α-helix	trans	-60	-41.6	177.2	-60.4	173.7	67	-143.9	1.7	112.1	F284 G296 E297 F304	F284-R300 PolarHBondContact O-NH1 2.98Å; F284-R300 VanDerWaalsContact O-NH1 3.08Å; F284-R300 PolarHBondContact O-NH2 2.91Å; G296-R300 PolarHBondContact O-N 3.43Å; E297-R300 WeakPolarHBondContact O-CB 3.11Å; E297-R300 PolarHBondContact O-N 3.44Å; E297-R300 IonicContact OE1-NH1 2.6Å; E297-R300 PolarHBondContact OE1-NH1 3.43Å; E297-R300 IonicContact OE2-NH1 3.38Å; E297-R300 PolarHBondContact OE2-NH1 3.26Å; R300-F304 WeakPolarHBondContact O-CB 3.27Å; R300-F304 PolarHBondContact O-N 3.16Å
301	V	98.8	Very high	98.3	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-68.6	-41.3	-178.8	-178.1	0	0	0	0	111.6	L143 L147 I214 L283 V285 E297 M298 G299 F304 L305	L143-V301 HydrophobicContact CD1-CG1 4.41Å; L143-V301 HydrophobicContact CD1-CG2 3.91Å; L147-V301 HydrophobicContact CD1-CG1 3.89Å; L147-V301 HydrophobicContact CD2-CB 4.46Å; L147-V301 HydrophobicContact CD2-CG1 3.61Å; L147-V301 HydrophobicContact CG-CG1 4.14Å; I214-V301 HydrophobicContact CD1-CG1 4.01Å; L283-V301 HydrophobicContact CD2-CB 4.04Å; L283-V301 HydrophobicContact CD2-CG1 4.36Å; L283-V301 HydrophobicContact CD2-CG2 3.61Å; V285-V301 HydrophobicContact CG2-CG2 3.7Å; E297-V301 VanDerWaalsContact O-CG2 3.27Å; E297-V301 WeakPolarHBondContact O-CG2 3.37Å; E297-V301 PolarHBondContact O-N 3.06Å; M298-V301 PolarHBondContact O-N 3.47Å; G299-V301 VanDerWaalsContact C-N 3.32Å; G299-V301 PolarHBondContact O-N 2.84Å; V301-F304 PolarHBondContact O-N 3.43Å; V301-L305 HydrophobicContact CG1-CD1 3.98Å; V301-L305 HydrophobicContact CG1-CG 4.42Å; V301-L305 WeakPolarHBondContact O-CB 3.39Å; V301-L305 VanDerWaalsContact O-CG 3.29Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.68Å
302	Q	98.8	Very high	98.3	Very high	0 Å²	0	44 Å²	44	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.7	-46.7	176.9	-73.7	167.9	114.4	0	0	111	H150 M298 G299 F304 L305 G306 L307 K308 R309 I311	H150-Q302 PolarHBondContact CD2-OE1 3.37Å; M298-Q302 WeakPolarHBondContact O-CB 3.34Å; M298-Q302 VanDerWaalsContact O-CG 3.26Å; M298-Q302 WeakPolarHBondContact O-CG 3.3Å; M298-Q302 PolarHBondContact O-N 3.18Å; M298-Q302 PolarHBondContact O-NE2 3.11Å; G299-Q302 PolarHBondContact O-N 3.26Å; Q302-F304 PolarHBondContact O-N 2.94Å; Q302-L305 PolarHBondContact O-N 2.92Å; Q302-G306 PolarHBondContact O-N 3.46Å; Q302-L307 HydrophobicContact CB-CB 4.24Å; Q302-L307 PolarHBondContact O-N 3.2Å; Q302-K308 PolarHBondContact OE1-O 3.24Å; Q302-R309 HydrophobicContact CB-CG 4.29Å; Q302-I311 PolarHBondContact NE2-O 3.2Å
303	D	98.8	Very high	98.2	Very high	80 Å²	80	43.9 Å²	43.9	43%	0.428	24%	0.239	S	C	.	.	H	α-helix	trans	-61	-47.4	177.6	-65.1	-5.7	0	0	0	112.1	G299 L305 G306 R309	G299-D303 PolarHBondContact O-N 2.87Å; G299-D303 VanDerWaalsContact O-N 3.15Å; D303-L305 PolarHBondContact O-N 3.48Å; D303-G306 PolarHBondContact O-N 3.28Å; D303-R309 WeakPolarHBondContact OD1-CG 3.45Å; D303-R309 IonicContact OD1-CZ 2.65Å; D303-R309 IonicContact OD1-NE 2.6Å; D303-R309 PolarHBondContact OD1-NE 3.44Å; D303-R309 IonicContact OD1-NH2 3.1Å; D303-R309 IonicContact OD2-CZ 3.66Å; D303-R309 VanDerWaalsContact OD2-CZ 3.28Å; D303-R309 IonicContact OD2-NE 3.99Å; D303-R309 PolarHBondContact OD2-NE 2.98Å; D303-R309 IonicContact OD2-NH2 2.98Å; D303-R309 PolarHBondContact OD2-NH2 2.93Å
304	F	98.8	Very high	98.1	Very high	37 Å²	37	48.7 Å²	48.7	16%	0.162	26%	0.257	C	S	.	.	H	α-helix	trans	-58.7	-37.9	178.6	173.5	-108.1	0	0	0	111.7	K212 I214 H281 L283 R300 V301 Q302 G306	K212-F304 HydrophobicContact CB-CE1 3.73Å; K212-F304 HydrophobicContact CB-CZ 3.79Å; K212-F304 HydrophobicContact CD-CE1 4.19Å; K212-F304 HydrophobicContact CD-CZ 4.26Å; K212-F304 WeakPolarHBondContact CD-O 3.44Å; K212-F304 WeakPolarHBondContact CE-O 3.21Å; K212-F304 HydrophobicContact CG-CE1 4.3Å; K212-F304 HydrophobicContact CG-CZ 4.09Å; K212-F304 PolarHBondContact NZ-O 3.34Å; I214-F304 HydrophobicContact CD1-CD1 4.46Å; I214-F304 HydrophobicContact CD1-CE1 4.49Å; I214-F304 HydrophobicContact CG1-CD1 4.14Å; I214-F304 HydrophobicContact CG1-CE1 3.82Å; H281-F304 WeakPolarHBondContact O-CZ 2.99Å; L283-F304 HydrophobicContact CB-CB 4.33Å; L283-F304 HydrophobicContact CB-CD1 3.54Å; L283-F304 HydrophobicContact CB-CD2 3.9Å; L283-F304 HydrophobicContact CB-CE1 3.67Å; L283-F304 HydrophobicContact CB-CE2 4.04Å; L283-F304 HydrophobicContact CB-CG 3.64Å; L283-F304 HydrophobicContact CB-CZ 3.93Å; L283-F304 HydrophobicContact CD1-CB 4.35Å; L283-F304 HydrophobicContact CD1-CG 4.47Å; L283-F304 HydrophobicContact CD2-CB 3.79Å; L283-F304 HydrophobicContact CD2-CD1 3.89Å; L283-F304 HydrophobicContact CD2-CG 3.95Å; L283-F304 HydrophobicContact CG-CB 4.38Å; L283-F304 HydrophobicContact CG-CD1 4.31Å; L283-F304 HydrophobicContact CG-CG 4.23Å; R300-F304 WeakPolarHBondContact O-CB 3.27Å; R300-F304 PolarHBondContact O-N 3.16Å; V301-F304 PolarHBondContact O-N 3.43Å; Q302-F304 PolarHBondContact O-N 2.94Å; F304-G306 VanDerWaalsContact C-N 3.28Å; F304-G306 PolarHBondContact O-N 2.7Å
305	L	98.5	Very high	98	Very high	8 Å²	8	50.4 Å²	50.4	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-76.3	-14.4	176.1	-68.4	177.3	0	0	0	113.2	A130 L147 I186 M188 K212 I214 V301 Q302 D303 L307	A130-L305 HydrophobicContact CB-CD2 3.44Å; A130-L305 VanDerWaalsContact CB-CD2 3.44Å; L147-L305 HydrophobicContact CD1-CD1 4.49Å; L147-L305 HydrophobicContact CD2-CD1 4.04Å; I186-L305 HydrophobicContact CD1-CB 3.95Å; M188-L305 HydrophobicContact CE-CD1 4.18Å; M188-L305 HydrophobicContact SD-CD1 3.95Å; K212-L305 HydrophobicContact CD-CD2 4.33Å; K212-L305 PolarHBondContact NZ-O 2.93Å; I214-L305 HydrophobicContact CD1-CD1 4.5Å; I214-L305 HydrophobicContact CD1-CD2 4.23Å; V301-L305 HydrophobicContact CG1-CD1 3.98Å; V301-L305 HydrophobicContact CG1-CG 4.42Å; V301-L305 WeakPolarHBondContact O-CB 3.39Å; V301-L305 VanDerWaalsContact O-CG 3.29Å; V301-L305 WeakPolarHBondContact O-CG 3.49Å; V301-L305 PolarHBondContact O-N 2.68Å; Q302-L305 PolarHBondContact O-N 2.92Å; D303-L305 PolarHBondContact O-N 3.48Å; L305-L307 HydrophobicContact CB-CD1 3.9Å; L305-L307 HydrophobicContact CB-CG 3.88Å; L305-L307 HydrophobicContact CD1-CD1 3.93Å
306	G	98.3	Very high	98	Very high	65 Å²	65	49.5 Å²	49.5	67%	0.67	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.8	25.2	-173.6	0	0	0	0	0	112.8	Q302 D303 F304	Q302-G306 PolarHBondContact O-N 3.46Å; D303-G306 PolarHBondContact O-N 3.28Å; F304-G306 VanDerWaalsContact C-N 3.28Å; F304-G306 PolarHBondContact O-N 2.7Å
307	L	98.3	Very high	97.9	Very high	17 Å²	17	51.8 Å²	51.8	9%	0.089	26%	0.258	C	S	.	.			trans	-92.8	151.7	178.8	-64.7	173.9	0	0	0	110.6	D152 V153 I186 Q302 L305	D152-L307 HydrophobicContact CB-CD2 3.91Å; V153-L307 HydrophobicContact CG2-CD1 3.43Å; V153-L307 VanDerWaalsContact CG2-CD1 3.43Å; I186-L307 HydrophobicContact CD1-CD1 4.19Å; I186-L307 HydrophobicContact CD1-CD2 3.6Å; I186-L307 HydrophobicContact CD1-CG 3.82Å; I186-L307 HydrophobicContact CG1-CD2 4.13Å; Q302-L307 HydrophobicContact CB-CB 4.24Å; Q302-L307 PolarHBondContact O-N 3.2Å; L305-L307 HydrophobicContact CB-CD1 3.9Å; L305-L307 HydrophobicContact CB-CG 3.88Å; L305-L307 HydrophobicContact CD1-CD1 3.93Å
308	K	98.1	Very high	97.7	Very high	166 Å²	166	57.4 Å²	57.4	72%	0.722	28%	0.283	S	S	*	.			trans	-61.1	140.2	167.2	-175.5	175.6	-179.9	177	0	109.4	H150 Q302 V310	H150-K308 PolarHBondContact NE2-O 2.9Å; Q302-K308 PolarHBondContact OE1-O 3.24Å; K308-V310 VanDerWaalsContact C-N 3.3Å; K308-V310 HydrophobicContact CB-CG2 4.21Å; K308-V310 HydrophobicContact CD-CG2 4.32Å; K308-V310 HydrophobicContact CG-CG2 4.15Å; K308-V310 PolarHBondContact O-N 3.31Å
309	R	98.1	Very high	97.6	Very high	155 Å²	155	59.5 Å²	59.5	59%	0.585	29%	0.294	S	S	*	.			trans	-72	84.3	173.1	-69.4	-175.8	172.8	-167	-1.2	110.9	Q302 D303	Q302-R309 HydrophobicContact CB-CG 4.29Å; D303-R309 WeakPolarHBondContact OD1-CG 3.45Å; D303-R309 IonicContact OD1-CZ 2.65Å; D303-R309 IonicContact OD1-NE 2.6Å; D303-R309 PolarHBondContact OD1-NE 3.44Å; D303-R309 IonicContact OD1-NH2 3.1Å; D303-R309 IonicContact OD2-CZ 3.66Å; D303-R309 VanDerWaalsContact OD2-CZ 3.28Å; D303-R309 IonicContact OD2-NE 3.99Å; D303-R309 PolarHBondContact OD2-NE 2.98Å; D303-R309 IonicContact OD2-NH2 2.98Å; D303-R309 PolarHBondContact OD2-NH2 2.93Å
310	V	97.8	Very high	97.3	Very high	54 Å²	54	67.5 Å²	67.5	33%	0.327	33%	0.329	S	S	.	.			trans	-93.6	-41.7	176.5	176.5	0	0	0	0	110.8	K308 S312 H315	K308-V310 VanDerWaalsContact C-N 3.3Å; K308-V310 HydrophobicContact CB-CG2 4.21Å; K308-V310 HydrophobicContact CD-CG2 4.32Å; K308-V310 HydrophobicContact CG-CG2 4.15Å; K308-V310 PolarHBondContact O-N 3.31Å; V310-S312 PolarHBondContact O-N 3.4Å; V310-H315 PolarHBondContact O-CE1 2.86Å
311	I	97.9	Very high	96.9	Very high	6 Å²	6	71.1 Å²	71.1	3%	0.031	36%	0.359	C	S	.	.			trans	-74.9	110.6	-179.2	-58.3	168.5	0	0	0	108.7	F146 I149 H150 M298 Q302 F316	F146-I311 VanDerWaalsContact O-CD1 3.24Å; F146-I311 WeakPolarHBondContact O-CD1 3.49Å; I149-I311 HydrophobicContact CB-CD1 4.35Å; I149-I311 HydrophobicContact CB-CG1 4.37Å; I149-I311 HydrophobicContact CG2-CG1 4.48Å; H150-I311 HydrophobicContact CB-CD1 3.88Å; H150-I311 HydrophobicContact CB-CG1 4.35Å; M298-I311 HydrophobicContact CB-CB 4.5Å; M298-I311 HydrophobicContact CB-CG2 4.04Å; M298-I311 HydrophobicContact CE-CB 4.47Å; M298-I311 HydrophobicContact CE-CD1 3.47Å; M298-I311 VanDerWaalsContact CE-CD1 3.47Å; M298-I311 HydrophobicContact CE-CG2 4.34Å; M298-I311 HydrophobicContact CG-CG2 4.14Å; Q302-I311 PolarHBondContact NE2-O 3.2Å; I311-F316 HydrophobicContact CG2-CE2 3.73Å; I311-F316 HydrophobicContact CG2-CZ 3.75Å
312	S	97	Very high	96.5	Very high	40 Å²	40	73.6 Å²	73.6	28%	0.28	37%	0.37	S	S	.	.			trans	-121.1	177.5	175.4	89.9	0	0	0	0	112.7	V310 K314 H315 F316	V310-S312 PolarHBondContact O-N 3.4Å; S312-K314 PolarHBondContact O-N 2.91Å; S312-K314 PolarHBondContact OG-N 3.16Å; S312-H315 PolarHBondContact N-ND1 2.97Å; S312-H315 WeakPolarHBondContact O-CB 3.44Å; S312-H315 PolarHBondContact O-N 3.22Å; S312-H315 PolarHBondContact O-ND1 2.86Å; S312-F316 WeakPolarHBondContact O-CD2 3.46Å
313	D	96.4	Very high	96.2	Very high	97 Å²	97	75.2 Å²	75.2	52%	0.519	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-39.2	-38.2	168.4	66.3	-34.8	0	0	0	114.8	H315 F316	D313-H315 PolarHBondContact O-N 2.94Å; D313-H315 VanDerWaalsContact O-N 3.09Å; D313-F316 PolarHBondContact O-N 2.97Å
314	K	96	Very high	96	Very high	155 Å²	155	74.8 Å²	74.8	67%	0.674	38%	0.381	S	S	*	.	G	3₁₀ helix	trans	-58.5	-26.4	180	-67.1	177.6	-174.9	177.5	0	113	S312 F316 K328	S312-K314 PolarHBondContact O-N 2.91Å; S312-K314 PolarHBondContact OG-N 3.16Å; K314-F316 VanDerWaalsContact C-N 3.31Å; K314-K328 VanDerWaalsContact O-CD 3.29Å; K314-K328 WeakPolarHBondContact O-CD 3.47Å; K314-K328 PolarHBondContact O-NZ 3.4Å
315	H	96.9	Very high	95.9	Very high	46 Å²	46	73.6 Å²	73.6	21%	0.213	38%	0.377	C	S	.	.	G	3₁₀ helix	trans	-80.1	-14.5	-178.9	-58.6	85	0	0	0	113.4	I149 V310 S312 D313 K328	I149-H315 HydrophobicContact CD1-CB 4.43Å; V310-H315 PolarHBondContact O-CE1 2.86Å; S312-H315 PolarHBondContact N-ND1 2.97Å; S312-H315 WeakPolarHBondContact O-CB 3.44Å; S312-H315 PolarHBondContact O-N 3.22Å; S312-H315 PolarHBondContact O-ND1 2.86Å; D313-H315 PolarHBondContact O-N 2.94Å; D313-H315 VanDerWaalsContact O-N 3.09Å; H315-K328 PolarHBondContact O-N 2.83Å
316	F	97.3	Very high	95.8	Very high	14 Å²	14	73.3 Å²	73.3	6%	0.061	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	150.8	-174	-56.5	-75.6	0	0	0	112.1	F146 P294 M298 I311 S312 D313 K314 C326 L327 K328	F146-F316 HydrophobicContact CB-CE1 4.18Å; F146-F316 HydrophobicContact CB-CZ 4.26Å; F146-F316 AromaticContact CD1-CE1 3.84Å; F146-F316 HydrophobicContact CD1-CE1 3.84Å; F146-F316 AromaticContact CD2-CE1 3.68Å; F146-F316 HydrophobicContact CD2-CE1 3.68Å; F146-F316 HydrophobicContact CD2-CZ 4.14Å; F146-F316 HydrophobicContact CE1-CE1 4.06Å; F146-F316 AromaticContact CE2-CE1 3.93Å; F146-F316 HydrophobicContact CE2-CE1 3.93Å; F146-F316 AromaticContact CG-CE1 3.63Å; F146-F316 HydrophobicContact CG-CE1 3.63Å; F146-F316 HydrophobicContact CG-CZ 4.15Å; F146-F316 HydrophobicContact CZ-CD1 4.46Å; F146-F316 HydrophobicContact CZ-CE1 4.1Å; P294-F316 HydrophobicContact CB-CD1 3.99Å; P294-F316 HydrophobicContact CB-CD2 4.23Å; P294-F316 HydrophobicContact CB-CE1 3.94Å; P294-F316 HydrophobicContact CB-CE2 4.18Å; P294-F316 HydrophobicContact CB-CG 4.14Å; P294-F316 HydrophobicContact CB-CZ 4.04Å; P294-F316 HydrophobicContact CG-CB 4.15Å; P294-F316 HydrophobicContact CG-CD1 3.99Å; P294-F316 HydrophobicContact CG-CD2 4.03Å; P294-F316 HydrophobicContact CG-CE1 4.44Å; P294-F316 HydrophobicContact CG-CE2 4.47Å; P294-F316 HydrophobicContact CG-CG 3.77Å; M298-F316 HydrophobicContact CG-CZ 4.01Å; I311-F316 HydrophobicContact CG2-CE2 3.73Å; I311-F316 HydrophobicContact CG2-CZ 3.75Å; S312-F316 WeakPolarHBondContact O-CD2 3.46Å; D313-F316 PolarHBondContact O-N 2.97Å; K314-F316 VanDerWaalsContact C-N 3.31Å; F316-C326 WeakPolarHBondContact CA-O 3.03Å; F316-L327 HydrophobicContact CD1-CD2 3.77Å; F316-L327 HydrophobicContact CE1-CD2 3.51Å; F316-L327 HydrophobicContact CZ-CD2 4.47Å; F316-K328 WeakPolarHBondContact O-CE 3.34Å; F316-K328 PolarHBondContact O-NZ 2.91Å
317	Y	95.8	Very high	95.7	Very high	72 Å²	72	70.6 Å²	70.6	28%	0.282	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	148.9	162.3	73	-77.4	0	0	0	108.8	N319 P325 C326 L327 K328 P336 C338	Y317-N319 HydrophobicContact CE2-CB 4.2Å; Y317-P325 WeakPolarHBondContact O-CA 3.14Å; Y317-C326 HydrophobicContact CD1-CB 3.93Å; Y317-C326 WeakPolarHBondContact CD1-O 3.16Å; Y317-C326 HydrophobicContact CE1-CB 3.31Å; Y317-C326 HydrophobicContact CE2-CB 4.03Å; Y317-C326 PolarHBondContact N-O 3.12Å; Y317-C326 PolarHBondContact O-N 2.83Å; Y317-L327 WeakPolarHBondContact CE1-O 3.39Å; Y317-K328 HydrophobicContact CD1-CG 3.76Å; Y317-K328 HydrophobicContact CG-CG 4.35Å; Y317-P336 HydrophobicContact CE1-CB 3.68Å; Y317-C338 PolarHBondContact OH-SG 3.32Å
318	F	95.3	Very high	95.5	Very high	118 Å²	118	74 Å²	74	52%	0.518	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.9	176.9	-165.5	-97.3	0	0	0	110.3	Q320 G323	F318-Q320 HydrophobicContact CD1-CG 4.33Å; F318-G323 VanDerWaalsContact CZ-C 3.44Å
319	N	95.2	Very high	95.1	Very high	43 Å²	43	73 Å²	73	23%	0.23	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	106.5	174.1	-176.6	-45.6	0	0	0	109	Y317 T321 K322 G323 F324	Y317-N319 HydrophobicContact CE2-CB 4.2Å; N319-T321 PolarHBondContact O-N 3.38Å; N319-T321 WeakPolarHBondContact OD1-CB 3.23Å; N319-T321 PolarHBondContact OD1-N 3.19Å; N319-T321 VanDerWaalsContact OD1-N 3.14Å; N319-K322 HydrophobicContact CB-CB 3.96Å; N319-K322 PolarHBondContact O-N 3.16Å; N319-K322 PolarHBondContact OD1-N 3.31Å; N319-G323 PolarHBondContact O-N 3.31Å; N319-F324 PolarHBondContact N-O 3.11Å; N319-F324 VanDerWaalsContact N-O 3.13Å
320	Q	92.9	Very high	94.4	Very high	176 Å²	176	66.1 Å²	66.1	82%	0.822	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-42.6	-177.5	-67.7	179.9	-4.5	0	0	112.6	F318 K322 G323	F318-Q320 HydrophobicContact CD1-CG 4.33Å; Q320-K322 VanDerWaalsContact C-N 3.3Å; Q320-K322 PolarHBondContact O-N 3.11Å; Q320-G323 PolarHBondContact O-N 2.84Å
321	T	89.5	Confident	93.7	Very high	145 Å²	145	66.2 Å²	66.2	89%	0.89	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-38.1	178.1	-48.3	0	0	0	0	112.1	N319	N319-T321 PolarHBondContact O-N 3.38Å; N319-T321 WeakPolarHBondContact OD1-CB 3.23Å; N319-T321 PolarHBondContact OD1-N 3.19Å; N319-T321 VanDerWaalsContact OD1-N 3.14Å
322	K	91.1	Very high	92.9	Very high	52 Å²	52	70.3 Å²	70.3	23%	0.226	37%	0.371	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-31.7	177.9	-167.8	179.9	168.6	67.8	0	111.8	N319 Q320 F324 C338 L339 G340 K343	N319-K322 HydrophobicContact CB-CB 3.96Å; N319-K322 PolarHBondContact O-N 3.16Å; N319-K322 PolarHBondContact OD1-N 3.31Å; Q320-K322 VanDerWaalsContact C-N 3.3Å; Q320-K322 PolarHBondContact O-N 3.11Å; K322-F324 HydrophobicContact CD-CB 4.35Å; K322-F324 HydrophobicContact CG-CB 4.35Å; K322-F324 HydrophobicContact CG-CD2 4.15Å; K322-F324 VanDerWaalsContact O-CD2 3.22Å; K322-F324 WeakPolarHBondContact O-CD2 3.37Å; K322-C338 HydrophobicContact CD-CB 3.68Å; K322-L339 WeakPolarHBondContact CE-O 3.16Å; K322-L339 PolarHBondContact NZ-O 2.78Å; K322-G340 PolarHBondContact NZ-O 2.8Å; K322-K343 PolarHBondContact NZ-O 3.31Å
323	G	92.4	Very high	92.4	Very high	33 Å²	33	70 Å²	70	34%	0.34	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.6	21.4	-172.2	0	0	0	0	0	114.1	F318 N319 Q320	F318-G323 VanDerWaalsContact CZ-C 3.44Å; N319-G323 PolarHBondContact O-N 3.31Å; Q320-G323 PolarHBondContact O-N 2.84Å
324	F	95.5	Very high	91.8	Very high	72 Å²	72	70.2 Å²	70.2	32%	0.316	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	153.3	-177.1	-71.1	-84	0	0	0	112	V291 N319 K322	V291-F324 HydrophobicContact CG1-CD1 4.05Å; V291-F324 HydrophobicContact CG1-CE1 4.38Å; V291-F324 HydrophobicContact CG2-CD1 3.98Å; V291-F324 HydrophobicContact CG2-CE1 4.04Å; N319-F324 PolarHBondContact N-O 3.11Å; N319-F324 VanDerWaalsContact N-O 3.13Å; K322-F324 HydrophobicContact CD-CB 4.35Å; K322-F324 HydrophobicContact CG-CB 4.35Å; K322-F324 HydrophobicContact CG-CD2 4.15Å; K322-F324 VanDerWaalsContact O-CD2 3.22Å; K322-F324 WeakPolarHBondContact O-CD2 3.37Å
325	P	95.5	Very high	91.5	Very high	12 Å²	12	72 Å²	72	8%	0.078	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	144.8	169.8	28.9	-34.9	0	0	0	111.4	F146 P294 Y317	F146-P325 HydrophobicContact CZ-CG 4.35Å; P294-P325 HydrophobicContact CG-CB 3.97Å; P294-P325 HydrophobicContact CG-CG 4.27Å; Y317-P325 WeakPolarHBondContact O-CA 3.14Å
326	C	96.4	Very high	91.2	Very high	1 Å²	1	73.7 Å²	73.7	1%	0.007	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	162.4	180	-59.2	0	0	0	0	110.2	F316 Y317 C338	F316-C326 WeakPolarHBondContact CA-O 3.03Å; Y317-C326 HydrophobicContact CD1-CB 3.93Å; Y317-C326 WeakPolarHBondContact CD1-O 3.16Å; Y317-C326 HydrophobicContact CE1-CB 3.31Å; Y317-C326 HydrophobicContact CE2-CB 4.03Å; Y317-C326 PolarHBondContact N-O 3.12Å; Y317-C326 PolarHBondContact O-N 2.83Å; C326-C338 HydrophobicContact CB-CB 3.95Å; C326-C338 WeakPolarHBondContact CB-SG 3.06Å; C326-C338 WeakPolarHBondContact SG-CA 3.45Å; C326-C338 WeakPolarHBondContact SG-CB 3.28Å; C326-C338 CovalentContact SG-SG 2.03Å; C326-C338 PolarHBondContact SG-SG 3.46Å
327	L	95.9	Very high	91	Very high	9 Å²	9	79.3 Å²	79.3	5%	0.047	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	127.5	-178.3	-62.9	179.3	0	0	0	110.5	F146 I149 F316 Y317 K329 P330 P336 R337	F146-L327 HydrophobicContact CD1-CD1 4.11Å; F146-L327 HydrophobicContact CD1-CD2 3.42Å; F146-L327 VanDerWaalsContact CD1-CD2 3.42Å; F146-L327 HydrophobicContact CD1-CG 3.9Å; F146-L327 HydrophobicContact CE1-CD2 3.75Å; F146-L327 HydrophobicContact CE1-CG 4.04Å; F146-L327 HydrophobicContact CG-CD2 4.27Å; I149-L327 HydrophobicContact CD1-CB 4.37Å; I149-L327 HydrophobicContact CD1-CD1 3.63Å; I149-L327 HydrophobicContact CD1-CD2 3.26Å; I149-L327 HydrophobicContact CD1-CG 3.9Å; I149-L327 HydrophobicContact CG1-CD1 4.19Å; F316-L327 HydrophobicContact CD1-CD2 3.77Å; F316-L327 HydrophobicContact CE1-CD2 3.51Å; F316-L327 HydrophobicContact CZ-CD2 4.47Å; Y317-L327 WeakPolarHBondContact CE1-O 3.39Å; L327-K329 VanDerWaalsContact C-N 3.34Å; L327-P330 HydrophobicContact CB-CB 4.31Å; L327-P330 HydrophobicContact CD1-CB 4Å; L327-P336 CarbonylContact O-C 3.52Å; L327-P336 VanDerWaalsContact O-CA 3.23Å; L327-P336 WeakPolarHBondContact O-CA 3.46Å; L327-R337 PolarHBondContact N-O 3.38Å; L327-R337 PolarHBondContact O-N 3.02Å
328	K	93.5	Very high	90.9	Very high	89 Å²	89	77.5 Å²	77.5	39%	0.387	41%	0.414	S	S	.	.	S	Bend	trans	-66.2	-38.1	174	-66.3	-163.6	-171.6	122	0	111.8	K314 H315 F316 Y317 P336	K314-K328 VanDerWaalsContact O-CD 3.29Å; K314-K328 WeakPolarHBondContact O-CD 3.47Å; K314-K328 PolarHBondContact O-NZ 3.4Å; H315-K328 PolarHBondContact O-N 2.83Å; F316-K328 WeakPolarHBondContact O-CE 3.34Å; F316-K328 PolarHBondContact O-NZ 2.91Å; Y317-K328 HydrophobicContact CD1-CG 3.76Å; Y317-K328 HydrophobicContact CG-CG 4.35Å; K328-P336 VanDerWaalsContact O-CA 3.26Å; K328-P336 WeakPolarHBondContact O-CA 3.29Å
329	K	91.2	Very high	90.9	Very high	144 Å²	144	73.7 Å²	73.7	63%	0.626	40%	0.399	S	S	*	.	S	Bend	trans	-141.7	94.9	177.3	-67.9	-176.1	-179.2	179.3	0	109.5	L327	L327-K329 VanDerWaalsContact C-N 3.34Å
330	P	83.9	Confident	90.7	Very high	11 Å²	11	73.9 Å²	73.9	7%	0.071	41%	0.411	C	S	.	.			trans	-72.1	164.2	175.5	34.1	-38	0	0	0	111.2	L327 G332 S333 R335 R337	L327-P330 HydrophobicContact CB-CB 4.31Å; L327-P330 HydrophobicContact CD1-CB 4Å; P330-G332 PolarHBondContact O-N 2.99Å; P330-S333 PolarHBondContact O-N 3.04Å; P330-S333 VanDerWaalsContact O-N 3.14Å; P330-R335 WeakPolarHBondContact CD-O 3.23Å; P330-R337 HydrophobicContact CB-CB 4.24Å; P330-R337 HydrophobicContact CG-CB 3.72Å
331	E	82.2	Confident	90.6	Very high	56 Å²	56	75.4 Å²	75.4	26%	0.262	41%	0.414	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	127.4	175.3	-168.2	-174.6	-150.8	0	0	111.7	R148 R154 S333	R148-E331 HydrophobicContact CB-CB 4.34Å; R148-E331 IonicContact CZ-OE2 3.93Å; R148-E331 IonicContact NE-OE2 3.86Å; R148-E331 PolarHBondContact NE-OE2 3.27Å; R148-E331 IonicContact NH2-OE2 3.81Å; R148-E331 PolarHBondContact NH2-OE2 3.32Å; R148-E331 WeakPolarHBondContact O-CB 3.49Å; R148-E331 WeakPolarHBondContact O-CG 3.26Å; R154-E331 IonicContact CZ-OE1 3.7Å; R154-E331 IonicContact NH1-OE1 3.3Å; R154-E331 PolarHBondContact NH1-OE1 3.38Å; R154-E331 IonicContact NH1-OE2 3.67Å; E331-S333 VanDerWaalsContact C-N 3.27Å; E331-S333 PolarHBondContact O-N 3.4Å
332	G	81.3	Confident	90.7	Very high	91 Å²	91	71.1 Å²	71.1	94%	0.938	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.4	13.3	177.4	0	0	0	0	0	115.6	P330	P330-G332 PolarHBondContact O-N 2.99Å
333	S	85.9	Confident	91	Very high	34 Å²	34	72.2 Å²	72.2	24%	0.238	40%	0.395	C	S	.	.			trans	-144.1	137	175.8	154.3	0	0	0	0	112.7	P330 E331 R335	P330-S333 PolarHBondContact O-N 3.04Å; P330-S333 VanDerWaalsContact O-N 3.14Å; E331-S333 VanDerWaalsContact C-N 3.27Å; E331-S333 PolarHBondContact O-N 3.4Å; S333-R335 VanDerWaalsContact C-N 3.34Å; S333-R335 PolarHBondContact OG-N 3.36Å; S333-R335 PolarHBondContact OG-O 2.89Å
334	S	85.1	Confident	91	Very high	102 Å²	102	72.7 Å²	72.7	71%	0.713	40%	0.4	S	S	*	.	S	Bend	trans	-80.4	-13	176.2	56.2	0	0	0	0	114
335	R	88.1	Confident	90.9	Very high	191 Å²	191	71.8 Å²	71.8	72%	0.721	40%	0.395	S	S	*	.	S	Bend	trans	-95.3	143.9	-176.7	-66.6	-177	179.7	158.4	0.5	112.5	P330 S333	P330-R335 WeakPolarHBondContact CD-O 3.23Å; S333-R335 VanDerWaalsContact C-N 3.34Å; S333-R335 PolarHBondContact OG-N 3.36Å; S333-R335 PolarHBondContact OG-O 2.89Å
336	P	91.3	Very high	90.9	Very high	82 Å²	82	76.9 Å²	76.9	53%	0.532	43%	0.428	S	S	.	.			trans	-56.3	144.2	174	-23.6	32.8	0	0	0	112.7	Y317 L327 K328	Y317-P336 HydrophobicContact CE1-CB 3.68Å; L327-P336 CarbonylContact O-C 3.52Å; L327-P336 VanDerWaalsContact O-CA 3.23Å; L327-P336 WeakPolarHBondContact O-CA 3.46Å; K328-P336 VanDerWaalsContact O-CA 3.26Å; K328-P336 WeakPolarHBondContact O-CA 3.29Å
337	R	92.8	Very high	90.9	Very high	132 Å²	132	80.1 Å²	80.1	50%	0.498	44%	0.443	S	S	.	.	B	Isolated β-bridge	trans	-141.6	125.4	-179.2	-175.2	-178.9	-69.7	-179.1	-0.7	111.4	L327 P330	L327-R337 PolarHBondContact N-O 3.38Å; L327-R337 PolarHBondContact O-N 3.02Å; P330-R337 HydrophobicContact CB-CB 4.24Å; P330-R337 HydrophobicContact CG-CB 3.72Å
338	C	94.8	Very high	90.9	Very high	34 Å²	34	81.7 Å²	81.7	23%	0.23	45%	0.454	C	S	.	.	P	Polyproline II helix	trans	-90.5	158.1	164.5	-66.6	0	0	0	0	111	Y317 K322 C326	Y317-C338 PolarHBondContact OH-SG 3.32Å; K322-C338 HydrophobicContact CD-CB 3.68Å; C326-C338 HydrophobicContact CB-CB 3.95Å; C326-C338 WeakPolarHBondContact CB-SG 3.06Å; C326-C338 WeakPolarHBondContact SG-CA 3.45Å; C326-C338 WeakPolarHBondContact SG-CB 3.28Å; C326-C338 CovalentContact SG-SG 2.03Å; C326-C338 PolarHBondContact SG-SG 3.46Å
339	L	93.8	Very high	91	Very high	39 Å²	39	86.3 Å²	86.3	20%	0.204	48%	0.477	C	S	.	.	P	Polyproline II helix	trans	-61.5	145.8	167.7	-62.7	176.5	0	0	0	110.8	R141 A142 E145 K322 K343	R141-L339 HydrophobicContact CG-CD2 4.27Å; A142-L339 HydrophobicContact CB-CD1 3.72Å; E145-L339 HydrophobicContact CB-CD2 4.4Å; E145-L339 HydrophobicContact CG-CD2 4.08Å; K322-L339 WeakPolarHBondContact CE-O 3.16Å; K322-L339 PolarHBondContact NZ-O 2.78Å; L339-K343 HydrophobicContact CB-CB 3.77Å; L339-K343 HydrophobicContact CB-CG 3.99Å; L339-K343 HydrophobicContact CD1-CB 4.18Å; L339-K343 HydrophobicContact CD1-CG 4.35Å
340	G	92.2	Very high	91.2	Very high	46 Å²	46	80.4 Å²	80.4	47%	0.474	45%	0.452	S	S	.	.	P	Polyproline II helix	trans	-62.3	173.2	-176.5	0	0	0	0	0	114.8	K322 S342 K343	K322-G340 PolarHBondContact NZ-O 2.8Å; G340-S342 PolarHBondContact O-N 3.06Å; G340-K343 PolarHBondContact O-N 3.41Å
341	K	91.2	Very high	91.7	Very high	208 Å²	208	82.9 Å²	82.9	90%	0.904	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.9	-176.7	-61.5	-177.2	-179.8	-178.3	0	114	K343	K341-K343 PolarHBondContact O-N 3.15Å
342	S	91.7	Very high	92.3	Very high	56 Å²	56	84.9 Å²	84.9	39%	0.392	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-1.2	175.9	69	0	0	0	0	114.1	G340 R345	G340-S342 PolarHBondContact O-N 3.06Å; S342-R345 VanDerWaalsContact O-CZ 3.25Å; S342-R345 PolarHBondContact O-NH1 3.02Å; S342-R345 PolarHBondContact O-NH2 3.29Å
343	K	95.3	Very high	92.9	Very high	74 Å²	74	85.8 Å²	85.8	32%	0.322	47%	0.468	S	S	.	.	S	Bend	trans	-122.5	123.3	178.8	-51.9	-61.3	172.7	-178.4	0	109.3	K322 L339 G340 K341	K322-K343 PolarHBondContact NZ-O 3.31Å; L339-K343 HydrophobicContact CB-CB 3.77Å; L339-K343 HydrophobicContact CB-CG 3.99Å; L339-K343 HydrophobicContact CD1-CB 4.18Å; L339-K343 HydrophobicContact CD1-CG 4.35Å; G340-K343 PolarHBondContact O-N 3.41Å; K341-K343 PolarHBondContact O-N 3.15Å
344	G	92.6	Very high	93.3	Very high	43 Å²	43	84.4 Å²	84.4	44%	0.443	46%	0.458	S	S	.	.	S	Bend	trans	81.1	48	-170.4	0	0	0	0	0	113
345	R	94.8	Very high	93.9	Very high	53 Å²	53	81.5 Å²	81.5	20%	0.2	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-68.9	142.8	175.7	-69.4	-177.3	-171.5	72.4	1.4	109.6	T229 S342 H347	T229-R345 HydrophobicContact CG2-CB 3.95Å; S342-R345 VanDerWaalsContact O-CZ 3.25Å; S342-R345 PolarHBondContact O-NH1 3.02Å; S342-R345 PolarHBondContact O-NH2 3.29Å; R345-H347 PolarHBondContact O-CD2 3.3Å; R345-H347 VanDerWaalsContact O-CD2 3.31Å; R345-H347 PolarHBondContact O-N 2.75Å
346	P	94.6	Very high	94.2	Very high	120 Å²	120	76.6 Å²	76.6	78%	0.779	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-59.6	134.3	167.5	27.5	-33.5	0	0	0	108.9	T229	T229-P346 WeakPolarHBondContact CG2-O 3.35Å
347	H	96.3	Very high	94.5	Very high	68 Å²	68	76.1 Å²	76.1	32%	0.315	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-86.1	142.8	176.9	-68.8	-179.4	0	0	0	109.4	V225 S226 R345	V225-H347 HydrophobicContact CG1-CB 3.85Å; S226-H347 WeakPolarHBondContact CB-NE2 3.45Å; S226-H347 PolarHBondContact OG-NE2 3.27Å; R345-H347 PolarHBondContact O-CD2 3.3Å; R345-H347 VanDerWaalsContact O-CD2 3.31Å; R345-H347 PolarHBondContact O-N 2.75Å
348	P	95.6	Very high	94.7	Very high	43 Å²	43	69.8 Å²	69.8	28%	0.279	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-66	155	172.8	28.2	-31.2	0	0	0	110.1	Y228 T229 I350	Y228-P348 HydrophobicContact CD1-CG 4.05Å; Y228-P348 HydrophobicContact CE1-CG 3.78Å; T229-P348 WeakPolarHBondContact OG1-CD 3.21Å; P348-I350 HydrophobicContact CB-CD1 4.37Å; P348-I350 HydrophobicContact CG-CD1 3.95Å; P348-I350 PolarHBondContact O-N 3.25Å
349	Q	96.1	Very high	94.9	Very high	186 Å²	186	71.7 Å²	71.7	87%	0.869	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-68	122.1	172.5	-66.3	-62	-20	0	0	109.3
350	I	95.6	Very high	95	Very high	19 Å²	19	73.1 Å²	73.1	10%	0.097	39%	0.394	C	S	.	.			trans	-112.2	136.1	177.6	-54.3	-48.6	0	0	0	107.7	V225 F241 P348 S352 A354 L355	V225-I350 HydrophobicContact CG1-CG1 4.29Å; V225-I350 HydrophobicContact CG2-CG1 4.26Å; F241-I350 HydrophobicContact CB-CD1 3.47Å; F241-I350 VanDerWaalsContact CB-CD1 3.47Å; F241-I350 HydrophobicContact CB-CG1 4.29Å; F241-I350 HydrophobicContact CB-CG2 4.45Å; F241-I350 HydrophobicContact CD1-CD1 4.46Å; F241-I350 HydrophobicContact CD1-CG1 4.41Å; F241-I350 HydrophobicContact CD1-CG2 3.64Å; F241-I350 HydrophobicContact CE1-CG2 4.29Å; F241-I350 HydrophobicContact CG-CD1 4Å; F241-I350 HydrophobicContact CG-CG1 4.31Å; F241-I350 HydrophobicContact CG-CG2 4.28Å; P348-I350 HydrophobicContact CB-CD1 4.37Å; P348-I350 HydrophobicContact CG-CD1 3.95Å; P348-I350 PolarHBondContact O-N 3.25Å; I350-S352 PolarHBondContact O-N 3.27Å; I350-A354 HydrophobicContact CG2-CB 4.3Å; I350-L355 HydrophobicContact CB-CD1 4.3Å; I350-L355 HydrophobicContact CB-CD2 3.98Å; I350-L355 HydrophobicContact CB-CG 4.09Å; I350-L355 HydrophobicContact CG2-CD2 3.76Å; I350-L355 HydrophobicContact CG2-CG 3.89Å
351	P	95	Very high	95.3	Very high	63 Å²	63	73.2 Å²	73.2	41%	0.409	38%	0.381	S	S	.	.			trans	-53.8	132.7	177	-26.5	34.7	0	0	0	112.1	E353 A354 L355	P351-E353 PolarHBondContact O-N 3.09Å; P351-A354 HydrophobicContact CB-CB 4.47Å; P351-A354 WeakPolarHBondContact O-CB 3.46Å; P351-A354 PolarHBondContact O-N 2.99Å; P351-L355 PolarHBondContact O-N 2.94Å
352	S	95.1	Very high	95.7	Very high	99 Å²	99	63.4 Å²	63.4	69%	0.692	34%	0.339	S	S	*	.	H	α-helix	trans	-57.3	-35.5	-177.6	-53.7	0	0	0	0	112.6	I350 A354 L355 Q356	I350-S352 PolarHBondContact O-N 3.27Å; S352-A354 PolarHBondContact O-N 2.8Å; S352-L355 PolarHBondContact O-N 3.46Å; S352-Q356 WeakPolarHBondContact O-CB 3.49Å; S352-Q356 PolarHBondContact O-N 3.41Å
353	E	93.7	Very high	96	Very high	109 Å²	109	64.4 Å²	64.4	51%	0.509	33%	0.334	S	S	.	.	H	α-helix	trans	-61.3	-42.9	176.1	-167.9	-166.6	159.2	0	0	112	P351 Q356 R357	P351-E353 PolarHBondContact O-N 3.09Å; E353-Q356 PolarHBondContact O-N 3.07Å; E353-R357 VanDerWaalsContact O-CG 3.31Å; E353-R357 WeakPolarHBondContact O-CG 3.4Å; E353-R357 PolarHBondContact O-N 3.21Å; E353-R357 IonicContact OE1-CZ 3.62Å; E353-R357 VanDerWaalsContact OE1-CZ 3.32Å; E353-R357 IonicContact OE1-NE 2.65Å; E353-R357 PolarHBondContact OE1-NE 3.31Å; E353-R357 IonicContact OE1-NH2 3.73Å; E353-R357 PolarHBondContact OE1-NH2 3.21Å
354	A	94.3	Very high	96.2	Very high	5 Å²	5	64.4 Å²	64.4	4%	0.041	34%	0.341	C	S	.	.	H	α-helix	trans	-66.3	-40.6	178	0	0	0	0	0	111.2	Q242 L246 I350 P351 S352 L358	Q242-A354 HydrophobicContact CB-CB 3.91Å; L246-A354 HydrophobicContact CD1-CB 4.24Å; I350-A354 HydrophobicContact CG2-CB 4.3Å; P351-A354 HydrophobicContact CB-CB 4.47Å; P351-A354 WeakPolarHBondContact O-CB 3.46Å; P351-A354 PolarHBondContact O-N 2.99Å; S352-A354 PolarHBondContact O-N 2.8Å; A354-L358 WeakPolarHBondContact O-CD1 3.46Å; A354-L358 PolarHBondContact O-N 3.44Å; A354-L358 VanDerWaalsContact O-N 3.16Å
355	L	96.4	Very high	96.5	Very high	41 Å²	41	65.8 Å²	65.8	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-62.7	-44.7	174.5	-64.3	177.7	0	0	0	111.3	V221 V225 I350 P351 S352 L358 R359	V221-L355 HydrophobicContact CG1-CB 4.5Å; V221-L355 HydrophobicContact CG1-CD2 3.72Å; V225-L355 HydrophobicContact CG2-CD2 3.96Å; I350-L355 HydrophobicContact CB-CD1 4.3Å; I350-L355 HydrophobicContact CB-CD2 3.98Å; I350-L355 HydrophobicContact CB-CG 4.09Å; I350-L355 HydrophobicContact CG2-CD2 3.76Å; I350-L355 HydrophobicContact CG2-CG 3.89Å; P351-L355 PolarHBondContact O-N 2.94Å; S352-L355 PolarHBondContact O-N 3.46Å; L355-L358 PolarHBondContact O-N 2.83Å; L355-R359 WeakPolarHBondContact O-CG 3.37Å; L355-R359 PolarHBondContact O-N 2.82Å
356	Q	96.1	Very high	96.7	Very high	88 Å²	88	63.5 Å²	63.5	41%	0.411	33%	0.327	S	S	.	.	H	α-helix	trans	-61.8	-44.7	179.1	-172.7	57.2	43.1	0	0	111.6	S352 E353 L358 R359 D360	S352-Q356 WeakPolarHBondContact O-CB 3.49Å; S352-Q356 PolarHBondContact O-N 3.41Å; E353-Q356 PolarHBondContact O-N 3.07Å; Q356-L358 VanDerWaalsContact C-N 3.28Å; Q356-L358 PolarHBondContact O-N 3.07Å; Q356-R359 WeakPolarHBondContact O-CA 3.47Å; Q356-R359 WeakPolarHBondContact O-CB 3.33Å; Q356-R359 PolarHBondContact O-N 3.35Å; Q356-D360 PolarHBondContact NE2-OD1 3.34Å; Q356-D360 PolarHBondContact NE2-OD2 2.83Å; Q356-D360 PolarHBondContact O-N 3.44Å
357	R	95.6	Very high	96.9	Very high	72 Å²	72	62.5 Å²	62.5	27%	0.272	31%	0.312	S	S	.	.	H	α-helix	trans	-57.7	-40.2	174.4	-72.8	167.8	178	-106.9	4	112.6	L246 T251 G252 E353 F361	L246-R357 HydrophobicContact CD2-CB 4.4Å; T251-R357 PolarHBondContact O-NH1 2.69Å; T251-R357 PolarHBondContact O-NH2 3.24Å; G252-R357 PolarHBondContact O-NH1 3.39Å; E353-R357 VanDerWaalsContact O-CG 3.31Å; E353-R357 WeakPolarHBondContact O-CG 3.4Å; E353-R357 PolarHBondContact O-N 3.21Å; E353-R357 IonicContact OE1-CZ 3.62Å; E353-R357 VanDerWaalsContact OE1-CZ 3.32Å; E353-R357 IonicContact OE1-NE 2.65Å; E353-R357 PolarHBondContact OE1-NE 3.31Å; E353-R357 IonicContact OE1-NH2 3.73Å; E353-R357 PolarHBondContact OE1-NH2 3.21Å; R357-F361 VanDerWaalsContact O-CB 3.28Å; R357-F361 WeakPolarHBondContact O-CB 3.46Å; R357-F361 PolarHBondContact O-N 3.21Å
358	L	97.6	Very high	97	Very high	0 Å²	0	65.3 Å²	65.3	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-67.4	-38.4	174.5	-92	78.7	0	0	0	111.8	V221 A224 F241 A245 L246 V254 V261 A354 L355 Q356 F361 Y362	V221-L358 HydrophobicContact CG1-CB 4.35Å; V221-L358 HydrophobicContact CG2-CB 3.95Å; A224-L358 HydrophobicContact CB-CD2 4.46Å; F241-L358 HydrophobicContact CE1-CD1 4.3Å; F241-L358 HydrophobicContact CE1-CD2 3.86Å; F241-L358 HydrophobicContact CZ-CD2 3.66Å; A245-L358 HydrophobicContact CB-CD1 4.02Å; L246-L358 HydrophobicContact CD2-CD1 4.16Å; V254-L358 HydrophobicContact CG1-CG 4.47Å; V254-L358 HydrophobicContact CG2-CD1 4.05Å; V254-L358 HydrophobicContact CG2-CG 4.27Å; V261-L358 HydrophobicContact CG2-CD2 4.41Å; A354-L358 WeakPolarHBondContact O-CD1 3.46Å; A354-L358 PolarHBondContact O-N 3.44Å; A354-L358 VanDerWaalsContact O-N 3.16Å; L355-L358 PolarHBondContact O-N 2.83Å; Q356-L358 VanDerWaalsContact C-N 3.28Å; Q356-L358 PolarHBondContact O-N 3.07Å; L358-F361 PolarHBondContact O-N 3.21Å; L358-Y362 HydrophobicContact CB-CD2 4.41Å; L358-Y362 HydrophobicContact CB-CE2 4.36Å; L358-Y362 HydrophobicContact CD2-CE2 4.2Å; L358-Y362 HydrophobicContact CG-CE2 4.45Å; L358-Y362 WeakPolarHBondContact O-CD2 3.32Å; L358-Y362 PolarHBondContact O-N 3.33Å
359	R	98.4	Very high	97.1	Very high	73 Å²	73	63.3 Å²	63.3	28%	0.275	31%	0.307	S	S	.	.	H	α-helix	trans	-59.8	-50.6	174.6	-70.3	-171.7	-172.2	-52.6	3.1	111.2	D219 V221 L355 Q356 F361 Y362 R363	D219-R359 IonicContact OD1-NH1 3.46Å; D219-R359 PolarHBondContact OD1-NH1 2.87Å; D219-R359 IonicContact OD2-CZ 3.32Å; D219-R359 IonicContact OD2-NH1 3.04Å; D219-R359 PolarHBondContact OD2-NH1 3.34Å; D219-R359 IonicContact OD2-NH2 2.74Å; D219-R359 PolarHBondContact OD2-NH2 3.13Å; V221-R359 HydrophobicContact CG2-CG 3.72Å; L355-R359 WeakPolarHBondContact O-CG 3.37Å; L355-R359 PolarHBondContact O-N 2.82Å; Q356-R359 WeakPolarHBondContact O-CA 3.47Å; Q356-R359 WeakPolarHBondContact O-CB 3.33Å; Q356-R359 PolarHBondContact O-N 3.35Å; R359-F361 VanDerWaalsContact C-N 3.27Å; R359-F361 PolarHBondContact O-N 3.48Å; R359-Y362 PolarHBondContact O-N 3.26Å; R359-Y362 VanDerWaalsContact O-N 3.16Å; R359-R363 PolarHBondContact O-N 2.88Å
360	D	97.9	Very high	97.3	Very high	70 Å²	70	55.6 Å²	55.6	37%	0.374	27%	0.27	S	S	.	.	H	α-helix	trans	-62.2	-38.2	179.3	-61.9	-31.8	0	0	0	111.7	Q356 R363 P364	Q356-D360 PolarHBondContact NE2-OD1 3.34Å; Q356-D360 PolarHBondContact NE2-OD2 2.83Å; Q356-D360 PolarHBondContact O-N 3.44Å; D360-R363 IonicContact OD1-CZ 3.25Å; D360-R363 VanDerWaalsContact OD1-CZ 3.25Å; D360-R363 IonicContact OD1-NH1 2.74Å; D360-R363 PolarHBondContact OD1-NH1 3.05Å; D360-R363 IonicContact OD1-NH2 2.85Å; D360-R363 PolarHBondContact OD1-NH2 3Å; D360-P364 WeakPolarHBondContact O-CD 3.33Å
361	F	98.2	Very high	97.4	Very high	48 Å²	48	62 Å²	62	21%	0.211	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-44.7	173.4	170	-98	0	0	0	113.1	V254 V261 L265 R357 L358 R359 F365	V254-F361 HydrophobicContact CB-CB 4.07Å; V254-F361 HydrophobicContact CB-CD1 4.19Å; V254-F361 HydrophobicContact CB-CD2 3.81Å; V254-F361 HydrophobicContact CB-CE2 4.31Å; V254-F361 HydrophobicContact CB-CG 3.74Å; V254-F361 HydrophobicContact CG1-CB 4.44Å; V254-F361 HydrophobicContact CG1-CD1 3.72Å; V254-F361 HydrophobicContact CG1-CD2 4.13Å; V254-F361 HydrophobicContact CG1-CE1 3.94Å; V254-F361 HydrophobicContact CG1-CE2 4.33Å; V254-F361 HydrophobicContact CG1-CG 3.82Å; V254-F361 HydrophobicContact CG1-CZ 4.24Å; V254-F361 HydrophobicContact CG2-CB 3.66Å; V254-F361 HydrophobicContact CG2-CD1 4.46Å; V254-F361 HydrophobicContact CG2-CD2 4.34Å; V254-F361 HydrophobicContact CG2-CG 3.91Å; V261-F361 HydrophobicContact CG1-CD1 4.39Å; V261-F361 HydrophobicContact CG1-CE1 3.65Å; V261-F361 HydrophobicContact CG1-CZ 4.21Å; L265-F361 HydrophobicContact CD2-CE1 3.82Å; L265-F361 HydrophobicContact CD2-CZ 3.96Å; R357-F361 VanDerWaalsContact O-CB 3.28Å; R357-F361 WeakPolarHBondContact O-CB 3.46Å; R357-F361 PolarHBondContact O-N 3.21Å; L358-F361 PolarHBondContact O-N 3.21Å; R359-F361 VanDerWaalsContact C-N 3.27Å; R359-F361 PolarHBondContact O-N 3.48Å; F361-F365 HydrophobicContact CD2-CE2 4.46Å; F361-F365 HydrophobicContact CE1-CE2 4.4Å; F361-F365 HydrophobicContact CE2-CE2 4.04Å; F361-F365 HydrophobicContact CZ-CE2 4.01Å; F361-F365 WeakPolarHBondContact O-CD2 3.42Å; F361-F365 WeakPolarHBondContact O-CE2 3.22Å
362	Y	98.8	Very high	97.6	Very high	1 Å²	1	61 Å²	61	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-77.8	-29.6	-177.2	-75.7	-61.5	0	0	0	113.9	P220 V221 V261 L265 L358 R359 F365 N366	P220-Y362 HydrophobicContact CB-CD1 3.74Å; P220-Y362 HydrophobicContact CB-CD2 3.6Å; P220-Y362 HydrophobicContact CB-CE1 3.76Å; P220-Y362 HydrophobicContact CB-CE2 3.61Å; P220-Y362 HydrophobicContact CB-CG 3.65Å; P220-Y362 HydrophobicContact CG-CD1 4.28Å; P220-Y362 HydrophobicContact CG-CG 4.21Å; V221-Y362 HydrophobicContact CG2-CD2 3.82Å; V221-Y362 HydrophobicContact CG2-CE2 4.21Å; V261-Y362 VanDerWaalsContact CA-OH 3.24Å; V261-Y362 WeakPolarHBondContact CA-OH 3.4Å; V261-Y362 PolarHBondContact O-OH 3.49Å; L265-Y362 HydrophobicContact CD2-CD1 4.11Å; L265-Y362 HydrophobicContact CD2-CE1 4Å; L265-Y362 HydrophobicContact CG-CE1 4.48Å; L358-Y362 HydrophobicContact CB-CD2 4.41Å; L358-Y362 HydrophobicContact CB-CE2 4.36Å; L358-Y362 HydrophobicContact CD2-CE2 4.2Å; L358-Y362 HydrophobicContact CG-CE2 4.45Å; L358-Y362 WeakPolarHBondContact O-CD2 3.32Å; L358-Y362 PolarHBondContact O-N 3.33Å; R359-Y362 PolarHBondContact O-N 3.26Å; R359-Y362 VanDerWaalsContact O-N 3.16Å; Y362-F365 CarbonylContact O-C 3.56Å; Y362-F365 WeakPolarHBondContact O-CA 3.43Å; Y362-F365 WeakPolarHBondContact O-CB 3.34Å; Y362-F365 PolarHBondContact O-N 3.4Å; Y362-N366 PolarHBondContact O-N 3.31Å
363	R	98.8	Very high	97.8	Very high	78 Å²	78	57.3 Å²	57.3	29%	0.294	26%	0.263	S	S	.	.	H	α-helix	trans	-43.7	-52.6	-175	-172.2	-180	-62.4	111.7	4.1	114.8	R359 D360 F365 N366 Q367 D380	R359-R363 PolarHBondContact O-N 2.88Å; D360-R363 IonicContact OD1-CZ 3.25Å; D360-R363 VanDerWaalsContact OD1-CZ 3.25Å; D360-R363 IonicContact OD1-NH1 2.74Å; D360-R363 PolarHBondContact OD1-NH1 3.05Å; D360-R363 IonicContact OD1-NH2 2.85Å; D360-R363 PolarHBondContact OD1-NH2 3Å; R363-F365 VanDerWaalsContact C-N 3.29Å; R363-F365 PolarHBondContact O-N 3.47Å; R363-N366 PolarHBondContact O-N 2.81Å; R363-Q367 WeakPolarHBondContact O-CG 3.29Å; R363-Q367 PolarHBondContact O-N 2.03Å; R363-D380 WeakPolarHBondContact CA-OD1 3.17Å; R363-D380 HydrophobicContact CG-CB 4.26Å
364	P	98.6	Very high	98	Very high	73 Å²	73	55.7 Å²	55.7	47%	0.474	28%	0.276	S	S	.	.	H	α-helix	trans	-64.2	-32.6	178.6	25.1	-35.1	0	0	0	113.2	D360 R368	D360-P364 WeakPolarHBondContact O-CD 3.33Å; P364-R368 PolarHBondContact O-N 2.67Å
365	F	98.7	Very high	98.1	Very high	73 Å²	73	57.5 Å²	57.5	32%	0.32	28%	0.283	S	S	.	.	H	α-helix	trans	-75.2	-34	176.8	-57.1	-73.6	0	0	0	112.3	L265 F361 Y362 R363 F369	L265-F365 HydrophobicContact CD2-CB 4.36Å; L265-F365 HydrophobicContact CD2-CD1 4.17Å; L265-F365 HydrophobicContact CD2-CD2 3.64Å; L265-F365 HydrophobicContact CD2-CE1 4.39Å; L265-F365 HydrophobicContact CD2-CE2 3.89Å; L265-F365 HydrophobicContact CD2-CG 3.79Å; L265-F365 HydrophobicContact CD2-CZ 4.26Å; F361-F365 HydrophobicContact CD2-CE2 4.46Å; F361-F365 HydrophobicContact CE1-CE2 4.4Å; F361-F365 HydrophobicContact CE2-CE2 4.04Å; F361-F365 HydrophobicContact CZ-CE2 4.01Å; F361-F365 WeakPolarHBondContact O-CD2 3.42Å; F361-F365 WeakPolarHBondContact O-CE2 3.22Å; Y362-F365 CarbonylContact O-C 3.56Å; Y362-F365 WeakPolarHBondContact O-CA 3.43Å; Y362-F365 WeakPolarHBondContact O-CB 3.34Å; Y362-F365 PolarHBondContact O-N 3.4Å; R363-F365 VanDerWaalsContact C-N 3.29Å; R363-F365 PolarHBondContact O-N 3.47Å; F365-F369 WeakPolarHBondContact O-CB 3.46Å; F365-F369 PolarHBondContact O-N 3.33Å
366	N	98.8	Very high	98.2	Very high	4 Å²	4	61 Å²	61	2%	0.021	30%	0.302	C	S	.	.	H	α-helix	trans	-65.4	-49.4	174.4	-69.1	-11.7	0	0	0	110.7	P220 Y362 R363 R368 F369 Y370 W379 D380	P220-N366 WeakPolarHBondContact CG-OD1 3.2Å; Y362-N366 PolarHBondContact O-N 3.31Å; R363-N366 PolarHBondContact O-N 2.81Å; N366-R368 VanDerWaalsContact C-N 3.3Å; N366-R368 PolarHBondContact O-N 3.04Å; N366-F369 CarbonylContact O-C 3.56Å; N366-F369 WeakPolarHBondContact O-CA 3.01Å; N366-F369 WeakPolarHBondContact O-CB 3.24Å; N366-F369 PolarHBondContact O-N 2.86Å; N366-Y370 HydrophobicContact CB-CE1 4.3Å; N366-Y370 HydrophobicContact CB-CE2 4.13Å; N366-Y370 VanDerWaalsContact O-CD1 3.27Å; N366-Y370 WeakPolarHBondContact O-CD1 3.36Å; N366-Y370 PolarHBondContact O-N 3.13Å; N366-W379 HydrophobicContact CB-CE3 4.39Å; N366-D380 WeakPolarHBondContact CB-OD2 3.13Å; N366-D380 PolarHBondContact ND2-OD1 3.46Å; N366-D380 PolarHBondContact ND2-OD2 2.74Å; N366-D380 VanDerWaalsContact ND2-OD2 3.15Å
367	Q	98.8	Very high	98.3	Very high	99 Å²	99	57.7 Å²	57.7	46%	0.463	29%	0.286	S	S	.	.	H	α-helix	trans	-56.1	-45.1	175.9	-71.5	174.8	-11.9	0	0	111.8	R363 F369 Y370 Q371	R363-Q367 WeakPolarHBondContact O-CG 3.29Å; R363-Q367 PolarHBondContact O-N 2.03Å; Q367-F369 VanDerWaalsContact C-N 3.34Å; Q367-F369 PolarHBondContact O-N 2.95Å; Q367-Y370 PolarHBondContact O-N 2.81Å; Q367-Q371 VanDerWaalsContact O-CG 3.31Å; Q367-Q371 WeakPolarHBondContact O-CG 3.22Å; Q367-Q371 PolarHBondContact O-N 2.74Å
368	R	98.8	Very high	98.5	Very high	128 Å²	128	57.3 Å²	57.3	48%	0.483	31%	0.305	S	S	.	.	H	α-helix	trans	-60.6	-43.2	173.4	-175.9	177	-179.8	148.1	3.7	111.7	A267 E271 P364 N366 Q371 M372	A267-R368 HydrophobicContact CB-CB 4.19Å; A267-R368 HydrophobicContact CB-CG 3.96Å; E271-R368 IonicContact OE1-CZ 2.75Å; E271-R368 IonicContact OE1-NE 3.24Å; E271-R368 PolarHBondContact OE1-NE 2.85Å; E271-R368 IonicContact OE1-NH1 3.33Å; E271-R368 IonicContact OE1-NH2 2.75Å; E271-R368 PolarHBondContact OE1-NH2 3.07Å; P364-R368 PolarHBondContact O-N 2.67Å; N366-R368 VanDerWaalsContact C-N 3.3Å; N366-R368 PolarHBondContact O-N 3.04Å; R368-Q371 PolarHBondContact O-N 2.95Å; R368-M372 HydrophobicContact CG-CG 4.43Å; R368-M372 HydrophobicContact CG-SD 4.06Å; R368-M372 WeakPolarHBondContact O-CB 3.05Å; R368-M372 WeakPolarHBondContact O-CG 3.31Å; R368-M372 PolarHBondContact O-N 2.85Å
369	F	98.9	Very high	98.5	Very high	1 Å²	1	58.3 Å²	58.3	0%	0.004	31%	0.309	C	S	.	.	H	α-helix	trans	-62.1	-44.1	177.1	-175.7	-110	0	0	0	111.6	V217 Y266 A267 L270 F284 F365 N366 Q367 Q371 M372 T373 F377 W379	V217-F369 HydrophobicContact CG1-CE1 4.01Å; V217-F369 HydrophobicContact CG1-CZ 3.8Å; V217-F369 HydrophobicContact CG2-CE1 4.4Å; Y266-F369 HydrophobicContact CD2-CD1 4.3Å; Y266-F369 HydrophobicContact CD2-CE1 4.3Å; A267-F369 HydrophobicContact CB-CB 4.15Å; L270-F369 HydrophobicContact CB-CE2 4.49Å; L270-F369 HydrophobicContact CD2-CD2 4.14Å; L270-F369 HydrophobicContact CD2-CE2 3.88Å; F284-F369 HydrophobicContact CD1-CE2 4.15Å; F284-F369 AromaticContact CD1-CZ 3.56Å; F284-F369 HydrophobicContact CD1-CZ 3.56Å; F284-F369 AromaticContact CE1-CE2 3.92Å; F284-F369 HydrophobicContact CE1-CE2 3.92Å; F284-F369 AromaticContact CE1-CZ 3.83Å; F284-F369 HydrophobicContact CE1-CZ 3.83Å; F284-F369 HydrophobicContact CG-CZ 4.26Å; F365-F369 WeakPolarHBondContact O-CB 3.46Å; F365-F369 PolarHBondContact O-N 3.33Å; N366-F369 CarbonylContact O-C 3.56Å; N366-F369 WeakPolarHBondContact O-CA 3.01Å; N366-F369 WeakPolarHBondContact O-CB 3.24Å; N366-F369 PolarHBondContact O-N 2.86Å; Q367-F369 VanDerWaalsContact C-N 3.34Å; Q367-F369 PolarHBondContact O-N 2.95Å; F369-Q371 VanDerWaalsContact C-N 3.32Å; F369-Q371 PolarHBondContact O-N 3.3Å; F369-M372 PolarHBondContact O-N 3.01Å; F369-T373 HydrophobicContact CD1-CG2 4.4Å; F369-T373 HydrophobicContact CD2-CG2 4.02Å; F369-T373 HydrophobicContact CE1-CG2 4.04Å; F369-T373 HydrophobicContact CE2-CG2 3.63Å; F369-T373 HydrophobicContact CG-CG2 4.4Å; F369-T373 HydrophobicContact CZ-CG2 3.63Å; F369-T373 WeakPolarHBondContact O-CG2 3.43Å; F369-T373 PolarHBondContact O-N 3.18Å; F369-T373 PolarHBondContact O-OG1 3.32Å; F369-T373 VanDerWaalsContact O-OG1 3.1Å; F369-F377 HydrophobicContact CD1-CD2 4.24Å; F369-F377 HydrophobicContact CD1-CE2 4.08Å; F369-F377 HydrophobicContact CE1-CD2 4.02Å; F369-F377 AromaticContact CE1-CE2 3.54Å; F369-F377 HydrophobicContact CE1-CE2 3.54Å; F369-F377 HydrophobicContact CE1-CZ 4.23Å; F369-W379 HydrophobicContact CD1-CH2 4.19Å; F369-W379 HydrophobicContact CD1-CZ3 4.11Å; F369-W379 HydrophobicContact CE1-CH2 4.09Å; F369-W379 HydrophobicContact CE1-CZ3 4.47Å
370	Y	98.8	Very high	98.2	Very high	23 Å²	23	59.5 Å²	59.5	9%	0.09	32%	0.321	C	S	.	.	H	α-helix	trans	-60.6	-42.4	177.8	-54.3	-23.2	0	0	0	112	N366 Q367 T373 G374 Q375 D376 F377 W379 D380	N366-Y370 HydrophobicContact CB-CE1 4.3Å; N366-Y370 HydrophobicContact CB-CE2 4.13Å; N366-Y370 VanDerWaalsContact O-CD1 3.27Å; N366-Y370 WeakPolarHBondContact O-CD1 3.36Å; N366-Y370 PolarHBondContact O-N 3.13Å; Q367-Y370 PolarHBondContact O-N 2.81Å; Y370-T373 PolarHBondContact O-N 3.02Å; Y370-G374 WeakPolarHBondContact O-CA 3.41Å; Y370-G374 PolarHBondContact O-N 2.78Å; Y370-Q375 VanDerWaalsContact CA-O 3.28Å; Y370-Q375 WeakPolarHBondContact CA-O 3.49Å; Y370-Q375 WeakPolarHBondContact CB-O 3Å; Y370-Q375 WeakPolarHBondContact CD1-O 3.29Å; Y370-Q375 PolarHBondContact O-N 2.88Å; Y370-Q375 VanDerWaalsContact O-N 3.13Å; Y370-D376 WeakPolarHBondContact CE2-OD1 3.48Å; Y370-F377 AromaticContact CD1-CD2 3.74Å; Y370-F377 HydrophobicContact CD1-CD2 3.74Å; Y370-F377 HydrophobicContact CE1-CB 3.91Å; Y370-F377 AromaticContact CE1-CD2 3.77Å; Y370-F377 HydrophobicContact CE1-CD2 3.77Å; Y370-F377 HydrophobicContact CE1-CG 4.34Å; Y370-W379 HydrophobicContact CE1-CD2 4.32Å; Y370-W379 AromaticContact CE1-CE3 3.67Å; Y370-W379 HydrophobicContact CE1-CE3 3.67Å; Y370-W379 HydrophobicContact CE1-CH2 4.49Å; Y370-W379 AromaticContact CE1-CZ3 3.76Å; Y370-W379 HydrophobicContact CE1-CZ3 3.76Å; Y370-W379 AromaticContact CZ-CE3 3.89Å; Y370-W379 WeakPolarHBondContact OH-CB 3.4Å; Y370-W379 VanDerWaalsContact OH-CE3 3.23Å; Y370-W379 PolarHBondContact OH-N 2.95Å; Y370-D380 VanDerWaalsContact CE2-OD2 3.3Å; Y370-D380 WeakPolarHBondContact CE2-OD2 3.42Å; Y370-D380 PolarHBondContact OH-OD2 3.4Å
371	Q	98.6	Very high	98.2	Very high	155 Å²	155	59 Å²	59	72%	0.724	32%	0.318	S	S	*	.	H	α-helix	trans	-62	-47.5	174.2	-70.4	169.5	1.6	0	0	111.4	Q367 R368 F369 T373 G374	Q367-Q371 VanDerWaalsContact O-CG 3.31Å; Q367-Q371 WeakPolarHBondContact O-CG 3.22Å; Q367-Q371 PolarHBondContact O-N 2.74Å; R368-Q371 PolarHBondContact O-N 2.95Å; F369-Q371 VanDerWaalsContact C-N 3.32Å; F369-Q371 PolarHBondContact O-N 3.3Å; Q371-T373 VanDerWaalsContact C-N 3.32Å; Q371-T373 PolarHBondContact O-N 3.21Å; Q371-G374 PolarHBondContact O-N 3.38Å
372	M	98.7	Very high	98.2	Very high	41 Å²	41	59.6 Å²	59.6	20%	0.202	32%	0.324	C	S	.	.	H	α-helix	trans	-62.1	-37.7	179.4	-71.7	173	76.6	0	0	112.6	A267 L270 E271 L274 L279 R368 F369	A267-M372 HydrophobicContact CB-SD 3.77Å; L270-M372 HydrophobicContact CB-CE 3.96Å; L270-M372 HydrophobicContact CD2-CB 4.05Å; L270-M372 HydrophobicContact CD2-CE 3.75Å; L270-M372 HydrophobicContact CD2-SD 4.46Å; L270-M372 HydrophobicContact CG-CE 3.72Å; E271-M372 HydrophobicContact CG-CE 3.78Å; L274-M372 HydrophobicContact CD1-CE 3.75Å; L279-M372 WeakPolarHBondContact CD2-O 3.12Å; R368-M372 HydrophobicContact CG-CG 4.43Å; R368-M372 HydrophobicContact CG-SD 4.06Å; R368-M372 WeakPolarHBondContact O-CB 3.05Å; R368-M372 WeakPolarHBondContact O-CG 3.31Å; R368-M372 PolarHBondContact O-N 2.85Å; F369-M372 PolarHBondContact O-N 3.01Å
373	T	98.4	Very high	98.1	Very high	21 Å²	21	62.8 Å²	62.8	13%	0.129	34%	0.342	C	S	.	.	H	α-helix	trans	-92.3	-10.6	-177.4	63.1	0	0	0	0	113.7	L270 F284 F369 Y370 Q371 Q375	L270-T373 HydrophobicContact CD2-CG2 3.92Å; F284-T373 HydrophobicContact CD1-CG2 4.04Å; F284-T373 HydrophobicContact CD2-CG2 3.5Å; F284-T373 VanDerWaalsContact CD2-CG2 3.5Å; F284-T373 HydrophobicContact CE1-CG2 3.95Å; F284-T373 HydrophobicContact CE2-CG2 3.42Å; F284-T373 VanDerWaalsContact CE2-CG2 3.42Å; F284-T373 HydrophobicContact CG-CG2 3.82Å; F284-T373 HydrophobicContact CZ-CG2 3.65Å; F369-T373 HydrophobicContact CD1-CG2 4.4Å; F369-T373 HydrophobicContact CD2-CG2 4.02Å; F369-T373 HydrophobicContact CE1-CG2 4.04Å; F369-T373 HydrophobicContact CE2-CG2 3.63Å; F369-T373 HydrophobicContact CG-CG2 4.4Å; F369-T373 HydrophobicContact CZ-CG2 3.63Å; F369-T373 WeakPolarHBondContact O-CG2 3.43Å; F369-T373 PolarHBondContact O-N 3.18Å; F369-T373 PolarHBondContact O-OG1 3.32Å; F369-T373 VanDerWaalsContact O-OG1 3.1Å; Y370-T373 PolarHBondContact O-N 3.02Å; Q371-T373 VanDerWaalsContact C-N 3.32Å; Q371-T373 PolarHBondContact O-N 3.21Å; T373-Q375 PolarHBondContact O-N 3.36Å; T373-Q375 PolarHBondContact OG1-N 3.25Å; T373-Q375 PolarHBondContact OG1-O 3.22Å
374	G	98.3	Very high	98.1	Very high	76 Å²	76	61.9 Å²	61.9	78%	0.784	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.6	26.9	-170.7	0	0	0	0	0	113.2	Y370 Q371	Y370-G374 WeakPolarHBondContact O-CA 3.41Å; Y370-G374 PolarHBondContact O-N 2.78Å; Q371-G374 PolarHBondContact O-N 3.38Å
375	Q	97.9	Very high	98.1	Very high	43 Å²	43	61.3 Å²	61.3	20%	0.201	34%	0.336	C	S	.	.			trans	-142.5	122	-176	178.6	174.7	-5	0	0	110.2	F284 Y370 T373 F377	F284-Q375 PolarHBondContact O-OE1 3.14Å; Y370-Q375 VanDerWaalsContact CA-O 3.28Å; Y370-Q375 WeakPolarHBondContact CA-O 3.49Å; Y370-Q375 WeakPolarHBondContact CB-O 3Å; Y370-Q375 WeakPolarHBondContact CD1-O 3.29Å; Y370-Q375 PolarHBondContact O-N 2.88Å; Y370-Q375 VanDerWaalsContact O-N 3.13Å; T373-Q375 PolarHBondContact O-N 3.36Å; T373-Q375 PolarHBondContact OG1-N 3.25Å; T373-Q375 PolarHBondContact OG1-O 3.22Å; Q375-F377 HydrophobicContact CB-CE2 4Å; Q375-F377 HydrophobicContact CB-CZ 4.12Å; Q375-F377 VanDerWaalsContact CD-CE1 3.48Å; Q375-F377 HydrophobicContact CG-CD2 4.3Å; Q375-F377 HydrophobicContact CG-CE1 4.12Å; Q375-F377 HydrophobicContact CG-CE2 3.86Å; Q375-F377 HydrophobicContact CG-CZ 3.73Å; Q375-F377 VanDerWaalsContact NE2-CE1 3.31Å; Q375-F377 WeakPolarHBondContact O-CD2 3.36Å; Q375-F377 WeakPolarHBondContact O-CE2 3.47Å
376	D	98.4	Very high	98	Very high	114 Å²	114	60.5 Å²	60.5	61%	0.61	34%	0.337	S	S	*	.			trans	-82.5	131	167.1	-165.6	-24.1	0	0	0	109.9	Y370 G378	Y370-D376 WeakPolarHBondContact CE2-OD1 3.48Å; D376-G378 PolarHBondContact OD1-N 3.44Å
377	F	98.3	Very high	98	Very high	18 Å²	18	64.5 Å²	64.5	8%	0.079	36%	0.36	C	S	.	.			trans	-102	-2.7	179	-66	-90.5	0	0	0	113.5	V217 F284 F369 Y370 Q375 W379	V217-F377 HydrophobicContact CG2-CD1 3.63Å; V217-F377 HydrophobicContact CG2-CE1 3.36Å; V217-F377 HydrophobicContact CG2-CE2 4.3Å; V217-F377 HydrophobicContact CG2-CG 4.22Å; V217-F377 HydrophobicContact CG2-CZ 3.75Å; F284-F377 HydrophobicContact CB-CE1 4.35Å; F284-F377 HydrophobicContact CB-CZ 3.62Å; F369-F377 HydrophobicContact CD1-CD2 4.24Å; F369-F377 HydrophobicContact CD1-CE2 4.08Å; F369-F377 HydrophobicContact CE1-CD2 4.02Å; F369-F377 AromaticContact CE1-CE2 3.54Å; F369-F377 HydrophobicContact CE1-CE2 3.54Å; F369-F377 HydrophobicContact CE1-CZ 4.23Å; Y370-F377 AromaticContact CD1-CD2 3.74Å; Y370-F377 HydrophobicContact CD1-CD2 3.74Å; Y370-F377 HydrophobicContact CE1-CB 3.91Å; Y370-F377 AromaticContact CE1-CD2 3.77Å; Y370-F377 HydrophobicContact CE1-CD2 3.77Å; Y370-F377 HydrophobicContact CE1-CG 4.34Å; Q375-F377 HydrophobicContact CB-CE2 4Å; Q375-F377 HydrophobicContact CB-CZ 4.12Å; Q375-F377 VanDerWaalsContact CD-CE1 3.48Å; Q375-F377 HydrophobicContact CG-CD2 4.3Å; Q375-F377 HydrophobicContact CG-CE1 4.12Å; Q375-F377 HydrophobicContact CG-CE2 3.86Å; Q375-F377 HydrophobicContact CG-CZ 3.73Å; Q375-F377 VanDerWaalsContact NE2-CE1 3.31Å; Q375-F377 WeakPolarHBondContact O-CD2 3.36Å; Q375-F377 WeakPolarHBondContact O-CE2 3.47Å; F377-W379 HydrophobicContact CB-CD2 3.84Å; F377-W379 HydrophobicContact CB-CE3 4.33Å; F377-W379 HydrophobicContact CB-CG 4.38Å; F377-W379 HydrophobicContact CB-CH2 3.91Å; F377-W379 HydrophobicContact CB-CZ2 3.39Å; F377-W379 HydrophobicContact CB-CZ3 4.36Å; F377-W379 HydrophobicContact CD1-CZ2 4.04Å; F377-W379 AromaticContact CD2-CH2 3.99Å; F377-W379 HydrophobicContact CD2-CH2 3.99Å; F377-W379 HydrophobicContact CD2-CZ2 4.21Å; F377-W379 AromaticContact CG-CH2 3.88Å; F377-W379 HydrophobicContact CG-CH2 3.88Å; F377-W379 AromaticContact CG-CZ2 3.62Å; F377-W379 HydrophobicContact CG-CZ2 3.62Å
378	G	97.9	Very high	97.9	Very high	64 Å²	64	61.8 Å²	61.8	66%	0.66	35%	0.352	S	S	*	.	S	Bend	trans	69.7	36.4	173.4	0	0	0	0	0	114.3	D376	D376-G378 PolarHBondContact OD1-N 3.44Å
379	W	98.3	Very high	97.8	Very high	21 Å²	21	56.3 Å²	56.3	8%	0.08	34%	0.341	C	S	.	.			trans	-91.5	-11.4	178.8	-50.1	-37.7	0	0	0	114.3	V217 D219 P220 Y266 E288 N366 F369 Y370 F377	V217-W379 HydrophobicContact CB-CH2 3.8Å; V217-W379 HydrophobicContact CB-CZ2 3.9Å; V217-W379 HydrophobicContact CG2-CH2 3.81Å; V217-W379 HydrophobicContact CG2-CZ2 3.71Å; D219-W379 HydrophobicContact CB-CB 4.27Å; D219-W379 HydrophobicContact CB-CG 3.91Å; D219-W379 VanDerWaalsContact N-NE1 3.19Å; P220-W379 HydrophobicContact CG-CE3 4.21Å; P220-W379 HydrophobicContact CG-CZ3 4.38Å; Y266-W379 AromaticContact CD2-CH2 3.7Å; Y266-W379 HydrophobicContact CD2-CH2 3.7Å; Y266-W379 AromaticContact CD2-CZ3 3.69Å; Y266-W379 HydrophobicContact CD2-CZ3 3.69Å; Y266-W379 AromaticContact CE2-CH2 3.48Å; Y266-W379 HydrophobicContact CE2-CH2 3.48Å; Y266-W379 VanDerWaalsContact CE2-CH2 3.48Å; Y266-W379 HydrophobicContact CE2-CZ2 4.29Å; Y266-W379 AromaticContact CE2-CZ3 3.63Å; Y266-W379 HydrophobicContact CE2-CZ3 3.63Å; E288-W379 PolarHBondContact OE2-NE1 3.47Å; N366-W379 HydrophobicContact CB-CE3 4.39Å; F369-W379 HydrophobicContact CD1-CH2 4.19Å; F369-W379 HydrophobicContact CD1-CZ3 4.11Å; F369-W379 HydrophobicContact CE1-CH2 4.09Å; F369-W379 HydrophobicContact CE1-CZ3 4.47Å; Y370-W379 HydrophobicContact CE1-CD2 4.32Å; Y370-W379 AromaticContact CE1-CE3 3.67Å; Y370-W379 HydrophobicContact CE1-CE3 3.67Å; Y370-W379 HydrophobicContact CE1-CH2 4.49Å; Y370-W379 AromaticContact CE1-CZ3 3.76Å; Y370-W379 HydrophobicContact CE1-CZ3 3.76Å; Y370-W379 AromaticContact CZ-CE3 3.89Å; Y370-W379 WeakPolarHBondContact OH-CB 3.4Å; Y370-W379 VanDerWaalsContact OH-CE3 3.23Å; Y370-W379 PolarHBondContact OH-N 2.95Å; F377-W379 HydrophobicContact CB-CD2 3.84Å; F377-W379 HydrophobicContact CB-CE3 4.33Å; F377-W379 HydrophobicContact CB-CG 4.38Å; F377-W379 HydrophobicContact CB-CH2 3.91Å; F377-W379 HydrophobicContact CB-CZ2 3.39Å; F377-W379 HydrophobicContact CB-CZ3 4.36Å; F377-W379 HydrophobicContact CD1-CZ2 4.04Å; F377-W379 AromaticContact CD2-CH2 3.99Å; F377-W379 HydrophobicContact CD2-CH2 3.99Å; F377-W379 HydrophobicContact CD2-CZ2 4.21Å; F377-W379 AromaticContact CG-CH2 3.88Å; F377-W379 HydrophobicContact CG-CH2 3.88Å; F377-W379 AromaticContact CG-CZ2 3.62Å; F377-W379 HydrophobicContact CG-CZ2 3.62Å
380	D	91.5	Very high	97.7	Very high	99 Å²	99	61.4 Å²	61.4	53%	0.529	37%	0.372	S	S	.	.			trans	-116.9	0	-170.2	-57.9	-72.1	0	0	0	114	R363 N366 Y370	R363-D380 WeakPolarHBondContact CA-OD1 3.17Å; R363-D380 HydrophobicContact CG-CB 4.26Å; N366-D380 WeakPolarHBondContact CB-OD2 3.13Å; N366-D380 PolarHBondContact ND2-OD1 3.46Å; N366-D380 PolarHBondContact ND2-OD2 2.74Å; N366-D380 VanDerWaalsContact ND2-OD2 3.15Å; Y370-D380 VanDerWaalsContact CE2-OD2 3.3Å; Y370-D380 WeakPolarHBondContact CE2-OD2 3.42Å; Y370-D380 PolarHBondContact OH-OD2 3.4Å

Retrieved 380 of 380 residues in 326.3 ms (Link to these results)

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