A0A3Q0KV46_SCHMA Loading...

Ufm1-specific protease 2

AlphaFold DB , UniProt , Accession A0A3Q0KV46, Species SCHMA (Schistosoma mansoni, Blood fluke), 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	36.4	Very low	46.6	Very low	196 Å²	196	92 Å²	92	97%	0.966	46%	0.455	S	S	*	.				0	124.4	0	-93.5	176.2	-102	0	0	108.1
2	T	41.5	Very low	47	Very low	46 Å²	46	88.1 Å²	88.1	28%	0.282	44%	0.436	S	S	.	.			trans	-79	112.7	162.5	39.2	0	0	0	0	106.5
3	D	45	Very low	47.3	Very low	71 Å²	71	94.8 Å²	94.8	38%	0.38	48%	0.475	S	S	.	.			trans	-62.2	141	174.8	-69.5	-44.6	0	0	0	109.8	L8	D3-L8 HydrophobicContact CB-CD1 3.93Å; D3-L8 HydrophobicContact CB-CG 4.04Å
4	S	49	Very low	47.9	Very low	30 Å²	30	93.5 Å²	93.5	21%	0.21	47%	0.47	C	S	.	.			trans	-65.6	147.5	179.7	83.2	0	0	0	0	110.6	R6 K7 L8 E167	S4-R6 PolarHBondContact O-N 3.27Å; S4-K7 PolarHBondContact O-N 3.22Å; S4-K7 VanDerWaalsContact O-N 3.08Å; S4-K7 PolarHBondContact OG-N 3.46Å; S4-L8 PolarHBondContact O-N 2.92Å; S4-E167 WeakPolarHBondContact CB-OE1 3.17Å
5	F	45.5	Very low	48.5	Very low	41 Å²	41	92.9 Å²	92.9	18%	0.18	49%	0.485	C	S	.	.	H	α-helix	trans	-56.5	-35.1	179.9	177.3	-116.7	0	0	0	112.3	L8 K9 L14 L145 H146	F5-L8 PolarHBondContact O-N 3.09Å; F5-K9 HydrophobicContact CE1-CD 4.25Å; F5-K9 WeakPolarHBondContact O-CB 3.09Å; F5-K9 PolarHBondContact O-N 3.11Å; F5-L14 HydrophobicContact CE2-CD1 4.02Å; F5-L14 HydrophobicContact CZ-CD1 3.93Å; F5-L145 HydrophobicContact CB-CD1 4.46Å; F5-L145 HydrophobicContact CD2-CB 4.47Å; F5-L145 HydrophobicContact CD2-CD1 3.41Å; F5-L145 VanDerWaalsContact CD2-CD1 3.41Å; F5-L145 HydrophobicContact CD2-CD2 4.25Å; F5-L145 HydrophobicContact CD2-CG 3.38Å; F5-L145 WeakPolarHBondContact CD2-O 3.23Å; F5-L145 HydrophobicContact CE2-CD1 4.09Å; F5-L145 HydrophobicContact CE2-CD2 4.08Å; F5-L145 HydrophobicContact CE2-CG 3.61Å; F5-L145 HydrophobicContact CG-CD1 4.39Å; F5-L145 VanDerWaalsContact CG-O 3.32Å; F5-L145 WeakPolarHBondContact CG-O 3.36Å; F5-H146 AromaticContact CE2-CE1 3.67Å; F5-H146 AromaticContact CZ-CE1 3.41Å; F5-H146 VanDerWaalsContact CZ-CE1 3.41Å; F5-H146 WeakPolarHBondContact CZ-CE1 3.48Å; F5-H146 AromaticContact CZ-ND1 3.68Å
6	R	50.1	Low	49.3	Very low	74 Å²	74	93.6 Å²	93.6	28%	0.279	51%	0.508	S	S	.	.	H	α-helix	trans	-64.6	-46.4	175	-81	-174.9	172.8	145.2	-6.2	112.6	S4 L8 K9 D10 C164 E167	S4-R6 PolarHBondContact O-N 3.27Å; R6-L8 PolarHBondContact O-N 2.72Å; R6-K9 PolarHBondContact O-N 3.49Å; R6-D10 PolarHBondContact O-N 3.35Å; R6-C164 PolarHBondContact NH1-O 2.91Å; R6-E167 HydrophobicContact CB-CB 4.43Å; R6-E167 VanDerWaalsContact CB-OE2 3.23Å; R6-E167 WeakPolarHBondContact CB-OE2 3.44Å; R6-E167 VanDerWaalsContact CD-OE2 3.31Å; R6-E167 WeakPolarHBondContact CD-OE2 3.44Å; R6-E167 VanDerWaalsContact CG-OE2 3.24Å; R6-E167 WeakPolarHBondContact CG-OE2 3.28Å
7	K	51.1	Low	50	Low	131 Å²	131	95 Å²	95	57%	0.57	52%	0.515	S	S	*	.	H	α-helix	trans	-60.6	-34.4	176.8	-77.8	-173.4	175.1	-175.6	0	112.5	S4 N11	S4-K7 PolarHBondContact O-N 3.22Å; S4-K7 VanDerWaalsContact O-N 3.08Å; S4-K7 PolarHBondContact OG-N 3.46Å; K7-N11 PolarHBondContact O-ND2 3.24Å
8	L	49.8	Very low	50.8	Low	25 Å²	25	97.1 Å²	97.1	13%	0.131	52%	0.524	C	S	.	.	H	α-helix	trans	-72.1	-42.6	172.2	-80.3	156.8	0	0	0	111.5	D3 S4 F5 R6 D10 N11 I12 V100 L145	D3-L8 HydrophobicContact CB-CD1 3.93Å; D3-L8 HydrophobicContact CB-CG 4.04Å; S4-L8 PolarHBondContact O-N 2.92Å; F5-L8 PolarHBondContact O-N 3.09Å; R6-L8 PolarHBondContact O-N 2.72Å; L8-D10 VanDerWaalsContact C-N 3.33Å; L8-D10 PolarHBondContact O-N 3.08Å; L8-N11 CarbonylContact O-C 3.58Å; L8-N11 PolarHBondContact O-N 3.42Å; L8-I12 HydrophobicContact CB-CD1 4.03Å; L8-I12 HydrophobicContact CD2-CD1 3.73Å; L8-I12 VanDerWaalsContact O-CB 3.23Å; L8-I12 WeakPolarHBondContact O-CB 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.23Å; L8-I12 PolarHBondContact O-N 2.87Å; L8-V100 HydrophobicContact CD1-CB 3.78Å; L8-V100 HydrophobicContact CD1-CG1 3.96Å; L8-V100 HydrophobicContact CD1-CG2 3.76Å; L8-V100 HydrophobicContact CD2-CG1 4.15Å; L8-V100 HydrophobicContact CD2-CG2 4.3Å; L8-L145 HydrophobicContact CB-CD1 4.48Å; L8-L145 HydrophobicContact CD1-CD1 3.73Å
9	K	49.8	Very low	51.4	Low	121 Å²	121	95.8 Å²	95.8	53%	0.526	52%	0.52	S	S	.	.	H	α-helix	trans	-62.4	-38.5	179.1	-172.5	-177.5	177.3	-173.8	0	112.2	F5 R6 N11 I12	F5-K9 HydrophobicContact CE1-CD 4.25Å; F5-K9 WeakPolarHBondContact O-CB 3.09Å; F5-K9 PolarHBondContact O-N 3.11Å; R6-K9 PolarHBondContact O-N 3.49Å; K9-N11 PolarHBondContact O-N 3.45Å; K9-I12 PolarHBondContact O-N 3.37Å; K9-I12 VanDerWaalsContact O-O 3.08Å
10	D	48.1	Very low	52	Low	136 Å²	136	99.4 Å²	99.4	73%	0.727	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.9	176.4	-64.9	-21.6	0	0	0	111.9	R6 L8	R6-D10 PolarHBondContact O-N 3.35Å; L8-D10 VanDerWaalsContact C-N 3.33Å; L8-D10 PolarHBondContact O-N 3.08Å
11	N	45.9	Very low	52.6	Low	141 Å²	141	100.3 Å²	100.3	75%	0.754	53%	0.53	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	-2.3	177.9	-68.3	-39.3	0	0	0	114	K7 L8 K9	K7-N11 PolarHBondContact O-ND2 3.24Å; L8-N11 CarbonylContact O-C 3.58Å; L8-N11 PolarHBondContact O-N 3.42Å; K9-N11 PolarHBondContact O-N 3.45Å
12	I	52.2	Low	53.8	Low	45 Å²	45	94.1 Å²	94.1	23%	0.231	51%	0.506	C	S	.	.			trans	-128.8	106.3	-175.7	-60.6	173.1	0	0	0	108.3	L8 K9 L14 M105	L8-I12 HydrophobicContact CB-CD1 4.03Å; L8-I12 HydrophobicContact CD2-CD1 3.73Å; L8-I12 VanDerWaalsContact O-CB 3.23Å; L8-I12 WeakPolarHBondContact O-CB 3.29Å; L8-I12 WeakPolarHBondContact O-CG1 3.23Å; L8-I12 PolarHBondContact O-N 2.87Å; K9-I12 PolarHBondContact O-N 3.37Å; K9-I12 VanDerWaalsContact O-O 3.08Å; I12-L14 HydrophobicContact CG2-CD2 4.2Å; I12-L14 HydrophobicContact CG2-CG 4.02Å; I12-L14 PolarHBondContact O-N 2.78Å; I12-M105 HydrophobicContact CD1-CE 4.49Å
13	N	50.8	Low	54.6	Low	175 Å²	175	99 Å²	99	94%	0.936	53%	0.529	S	S	*	.			trans	-68.2	97.5	168.7	-108	-24.4	0	0	0	109.3	A15	N13-A15 PolarHBondContact O-N 3.37Å
14	L	56	Low	55.1	Low	77 Å²	77	100.7 Å²	100.7	40%	0.403	54%	0.539	S	S	.	.			trans	-84.5	102.4	173.9	-74.8	164.1	0	0	0	109.3	F5 I12	F5-L14 HydrophobicContact CE2-CD1 4.02Å; F5-L14 HydrophobicContact CZ-CD1 3.93Å; I12-L14 HydrophobicContact CG2-CD2 4.2Å; I12-L14 HydrophobicContact CG2-CG 4.02Å; I12-L14 PolarHBondContact O-N 2.78Å
15	A	56.6	Low	55.3	Low	85 Å²	85	107.3 Å²	107.3	70%	0.702	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-91.1	122.2	167.3	0	0	0	0	0	109.7	N13 L17	N13-A15 PolarHBondContact O-N 3.37Å; A15-L17 PolarHBondContact O-N 2.81Å
16	A	60.8	Low	55.5	Low	104 Å²	104	110.4 Å²	110.4	86%	0.86	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-77.8	116.6	171.3	0	0	0	0	0	109
17	L	62.1	Low	55.6	Low	117 Å²	117	113.5 Å²	113.5	61%	0.613	62%	0.617	S	S	*	*	P	Polyproline II helix	trans	-102.5	131.7	174.6	-68	167.9	0	0	0	109.2	A15 L65	A15-L17 PolarHBondContact O-N 2.81Å; L17-L65 HydrophobicContact CD1-CD1 4.36Å; L17-L65 HydrophobicContact CD1-CD2 3.85Å
18	I	63.5	Low	55.7	Low	133 Å²	133	111.3 Å²	111.3	68%	0.682	62%	0.618	S	S	*	*	P	Polyproline II helix	trans	-97.2	122.2	172.1	-54.1	175.4	0	0	0	107.7	F20	I18-F20 HydrophobicContact CB-CD2 4.44Å; I18-F20 HydrophobicContact CB-CE2 3.73Å; I18-F20 HydrophobicContact CB-CZ 4.13Å; I18-F20 HydrophobicContact CG2-CD2 4.01Å; I18-F20 HydrophobicContact CG2-CE1 3.99Å; I18-F20 HydrophobicContact CG2-CE2 3.38Å; I18-F20 HydrophobicContact CG2-CZ 3.37Å
19	V	62.6	Low	55.9	Low	73 Å²	73	117.4 Å²	117.4	44%	0.442	65%	0.65	S	S	.	*	P	Polyproline II helix	trans	-90.5	121.9	176.9	-178.1	0	0	0	0	108.7	L69	V19-L69 HydrophobicContact CG1-CD2 4.29Å
20	F	63.1	Low	55.9	Low	166 Å²	166	119.5 Å²	119.5	73%	0.728	66%	0.662	S	S	*	*			trans	-111.9	146.1	172.3	-63.5	-83.1	0	0	0	109.8	I18	I18-F20 HydrophobicContact CB-CD2 4.44Å; I18-F20 HydrophobicContact CB-CE2 3.73Å; I18-F20 HydrophobicContact CB-CZ 4.13Å; I18-F20 HydrophobicContact CG2-CD2 4.01Å; I18-F20 HydrophobicContact CG2-CE1 3.99Å; I18-F20 HydrophobicContact CG2-CE2 3.38Å; I18-F20 HydrophobicContact CG2-CZ 3.37Å
21	F	64.4	Low	55.7	Low	119 Å²	119	116.2 Å²	116.2	52%	0.522	65%	0.646	S	S	.	*			trans	-98.6	129.9	165.3	-64.5	-81.1	0	0	0	107.6	P32	F21-P32 HydrophobicContact CD1-CG 3.48Å; F21-P32 VanDerWaalsContact CD1-CG 3.48Å; F21-P32 HydrophobicContact CE1-CG 3.71Å; F21-P32 HydrophobicContact CG-CG 4.27Å
22	S	62.5	Low	56	Low	66 Å²	66	112.7 Å²	112.7	46%	0.462	63%	0.631	S	S	.	*			trans	-69	139.3	171.3	-173.6	0	0	0	0	109.4	D24	S22-D24 VanDerWaalsContact C-N 3.33Å; S22-D24 WeakPolarHBondContact OG-CB 3.45Å; S22-D24 PolarHBondContact OG-N 3.24Å; S22-D24 VanDerWaalsContact OG-N 3.13Å; S22-D24 PolarHBondContact OG-OD2 3.34Å
23	L	58.4	Low	55.9	Low	148 Å²	148	117.1 Å²	117.1	78%	0.775	66%	0.661	S	S	*	*			trans	-88.5	-5.3	171	-70.1	171.5	0	0	0	112.1	L34	L23-L34 HydrophobicContact CD2-CD1 4Å
24	D	55.6	Low	55.9	Low	108 Å²	108	114.9 Å²	114.9	58%	0.578	65%	0.648	S	S	*	*	S	Bend	trans	-74.3	144.2	179.9	-61.4	-33.8	0	0	0	110.4	S22 N26	S22-D24 VanDerWaalsContact C-N 3.33Å; S22-D24 WeakPolarHBondContact OG-CB 3.45Å; S22-D24 PolarHBondContact OG-N 3.24Å; S22-D24 VanDerWaalsContact OG-N 3.13Å; S22-D24 PolarHBondContact OG-OD2 3.34Å; D24-N26 PolarHBondContact O-N 3.38Å
25	D	52.5	Low	55.7	Low	169 Å²	169	119.4 Å²	119.4	90%	0.904	67%	0.667	S	S	*	*			trans	-64.7	34.1	171.6	-73.9	-30	0	0	0	112.9	T27	D25-T27 PolarHBondContact O-N 3.29Å
26	N	49.9	Very low	55.4	Low	106 Å²	106	122.8 Å²	122.8	57%	0.567	67%	0.672	S	S	*	*			trans	-61	124.8	172.4	-84.6	-32	0	0	0	108.3	D24 C28 T31	D24-N26 PolarHBondContact O-N 3.38Å; N26-C28 PolarHBondContact O-N 3.38Å; N26-T31 PolarHBondContact O-OG1 3.26Å
27	T	52.2	Low	55.1	Low	138 Å²	138	121 Å²	121	85%	0.847	65%	0.653	S	S	*	*			trans	-65.8	35.8	-179.7	51.9	0	0	0	0	113.1	D25 D29	D25-T27 PolarHBondContact O-N 3.29Å; T27-D29 PolarHBondContact O-N 2.66Å
28	C	52.1	Low	54.5	Low	86 Å²	86	126.6 Å²	126.6	58%	0.581	67%	0.666	S	S	*	*			trans	-73.9	123.6	169.1	-150.5	0	0	0	0	107.2	N26 H30 T31	N26-C28 PolarHBondContact O-N 3.38Å; C28-H30 PolarHBondContact O-N 3.33Å; C28-T31 PolarHBondContact O-N 2.79Å; C28-T31 PolarHBondContact O-OG1 3.28Å
29	D	55	Low	53.7	Low	153 Å²	153	128.8 Å²	128.8	82%	0.818	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-3.6	-177.1	-67.2	-35.7	0	0	0	114.6	T27	T27-D29 PolarHBondContact O-N 2.66Å
30	H	49	Very low	53.1	Low	165 Å²	165	129.5 Å²	129.5	76%	0.764	68%	0.681	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.6	18.3	-171.2	-56.1	-35.5	0	0	0	114.2	C28 P32	C28-H30 PolarHBondContact O-N 3.33Å; H30-P32 WeakPolarHBondContact O-CD 3.48Å
31	T	45.2	Very low	52.8	Low	66 Å²	66	130.9 Å²	130.9	41%	0.405	69%	0.694	S	S	.	*			trans	-64.4	119.5	175.5	-51.3	0	0	0	0	109.9	N26 C28 T33	N26-T31 PolarHBondContact O-OG1 3.26Å; C28-T31 PolarHBondContact O-N 2.79Å; C28-T31 PolarHBondContact O-OG1 3.28Å; T31-T33 PolarHBondContact O-N 3.08Å
32	P	50.6	Low	52.9	Low	68 Å²	68	127.5 Å²	127.5	44%	0.442	69%	0.692	S	S	.	*			trans	-66.9	128.2	-177.4	23.7	-30.2	0	0	0	110.9	F21 H30 L34	F21-P32 HydrophobicContact CD1-CG 3.48Å; F21-P32 VanDerWaalsContact CD1-CG 3.48Å; F21-P32 HydrophobicContact CE1-CG 3.71Å; F21-P32 HydrophobicContact CG-CG 4.27Å; H30-P32 WeakPolarHBondContact O-CD 3.48Å; P32-L34 PolarHBondContact O-N 2.97Å; P32-L34 VanDerWaalsContact O-N 3.1Å
33	T	51.6	Low	53.4	Low	138 Å²	138	129.9 Å²	129.9	85%	0.847	70%	0.696	S	S	*	*			trans	-67.3	107.8	176.1	-41.1	0	0	0	0	110.3	T31 Q35	T31-T33 PolarHBondContact O-N 3.08Å; T33-Q35 PolarHBondContact O-N 2.95Å
34	L	50.8	Low	54.4	Low	128 Å²	128	128 Å²	128	67%	0.67	70%	0.695	S	S	*	*			trans	-81.6	92.9	170.3	-78.3	165.1	0	0	0	109.6	L23 P32 I36	L23-L34 HydrophobicContact CD2-CD1 4Å; P32-L34 PolarHBondContact O-N 2.97Å; P32-L34 VanDerWaalsContact O-N 3.1Å; L34-I36 PolarHBondContact O-N 3.45Å
35	Q	51.8	Low	55.7	Low	172 Å²	172	125.2 Å²	125.2	80%	0.804	68%	0.678	S	S	*	*			trans	-80.6	104.5	172	-169.9	179.2	2.7	0	0	110.4	T33 S37	T33-Q35 PolarHBondContact O-N 2.95Å; Q35-S37 PolarHBondContact O-N 2.9Å; Q35-S37 VanDerWaalsContact O-N 3.16Å
36	I	50.3	Low	57.3	Low	156 Å²	156	126.4 Å²	126.4	80%	0.8	67%	0.67	S	S	*	*			trans	-79.9	91.7	169.6	-58.2	172.7	0	0	0	108.1	L34	L34-I36 PolarHBondContact O-N 3.45Å
37	S	52.9	Low	59.1	Low	65 Å²	65	125.1 Å²	125.1	46%	0.455	66%	0.662	S	S	.	*			trans	-76.2	125.4	173.2	91	0	0	0	0	109.9	Q35 H39	Q35-S37 PolarHBondContact O-N 2.9Å; Q35-S37 VanDerWaalsContact O-N 3.16Å; S37-H39 PolarHBondContact O-N 3.15Å; S37-H39 PolarHBondContact OG-O 2.89Å
38	R	49.5	Very low	60.7	Low	235 Å²	235	120.2 Å²	120.2	89%	0.887	63%	0.633	S	S	*	*	S	Bend	trans	-75	-3.3	179.1	-72.3	-175	178.3	178.8	0	114.6
39	H	47.9	Very low	62.2	Low	179 Å²	179	119.3 Å²	119.3	83%	0.829	62%	0.622	S	S	*	*			trans	-143.7	120.6	174.2	-75.1	-70.9	0	0	0	110.3	S37	S37-H39 PolarHBondContact O-N 3.15Å; S37-H39 PolarHBondContact OG-O 2.89Å
40	S	50	Low	63.6	Low	89 Å²	89	115.4 Å²	115.4	62%	0.622	60%	0.601	S	S	*	*			trans	-142.3	100.9	163.8	57.9	0	0	0	0	111.3	G42	S40-G42 PolarHBondContact O-N 3.38Å
41	I	55.7	Low	65	Low	195 Å²	195	110.4 Å²	110.4	100%	1	58%	0.58	S	S	*	*			trans	-72.7	54.6	145.4	-52.4	174	0	0	0	106.5
42	G	68.5	Low	66.5	Low	47 Å²	47	108.9 Å²	108.9	49%	0.485	57%	0.569	S	S	.	*	S	Bend	trans	-126.7	148	-164.8	0	0	0	0	0	112.1	S40 S44	S40-G42 PolarHBondContact O-N 3.38Å; G42-S44 PolarHBondContact O-N 3.14Å
43	H	72.5	Confident	67.6	Low	117 Å²	117	107 Å²	107	54%	0.542	56%	0.556	S	S	.	*			trans	-68.7	119.1	177.1	-176.8	84.7	0	0	0	110.3
44	S	78	Confident	68.6	Low	107 Å²	107	106 Å²	106	75%	0.748	55%	0.546	S	S	*	.			trans	-95.9	127.3	172.3	-176.8	0	0	0	0	110	G42	G42-S44 PolarHBondContact O-N 3.14Å
45	H	84	Confident	69.5	Low	50 Å²	50	104.4 Å²	104.4	23%	0.231	53%	0.534	C	S	.	.			trans	-119.4	122.7	178	-172.5	88.1	0	0	0	110	Y76 P91 K92	H45-Y76 AromaticContact NE2-CE1 3.46Å; H45-Y76 WeakPolarHBondContact NE2-CE1 3.45Å; H45-Y76 AromaticContact NE2-CZ 3.59Å; H45-Y76 PolarHBondContact NE2-OH 2.9Å; H45-P91 PolarHBondContact CE1-O 2.88Å; H45-P91 PolarHBondContact ND1-O 2.9Å; H45-K92 PolarHBondContact ND1-O 3.38Å
46	R	84.9	Confident	70.1	Confident	194 Å²	194	102.7 Å²	102.7	73%	0.732	54%	0.541	S	S	*	.			trans	-95.2	133.1	179.1	-172.3	177.9	178.5	-170.6	-0.4	110	P48 Y76 K92 T93	R46-P48 VanDerWaalsContact O-CD 3.27Å; R46-P48 WeakPolarHBondContact O-CD 3.45Å; R46-Y76 PolarHBondContact O-OH 3.41Å; R46-Y76 VanDerWaalsContact O-OH 3.14Å; R46-K92 PolarHBondContact N-O 2.84Å; R46-T93 PolarHBondContact O-OG1 3.25Å
47	I	88.1	Confident	70.8	Confident	79 Å²	79	97.7 Å²	97.7	41%	0.405	53%	0.528	S	S	.	.			trans	-108.1	95.5	174.6	-55.4	-179.5	0	0	0	108.6	I49 F72 L73 Y76	I47-I49 PolarHBondContact O-N 3.04Å; I47-F72 HydrophobicContact CG2-CE1 4.1Å; I47-L73 HydrophobicContact CG2-CD2 4.18Å; I47-Y76 HydrophobicContact CB-CE2 4.5Å; I47-Y76 HydrophobicContact CD1-CD1 4.4Å; I47-Y76 HydrophobicContact CD1-CE1 4.28Å; I47-Y76 HydrophobicContact CG1-CD1 4.4Å; I47-Y76 HydrophobicContact CG1-CE1 3.87Å; I47-Y76 HydrophobicContact CG2-CD1 4.26Å; I47-Y76 HydrophobicContact CG2-CD2 3.88Å; I47-Y76 HydrophobicContact CG2-CE1 4.21Å; I47-Y76 HydrophobicContact CG2-CE2 3.8Å; I47-Y76 HydrophobicContact CG2-CG 4.14Å
48	P	85.9	Confident	71.4	Confident	35 Å²	35	103 Å²	103	23%	0.227	55%	0.551	C	S	.	*			trans	-73.8	116.7	172	28.1	-29	0	0	0	108.9	R46 D50 F72 T93 L94 L95	R46-P48 VanDerWaalsContact O-CD 3.27Å; R46-P48 WeakPolarHBondContact O-CD 3.45Å; P48-D50 PolarHBondContact O-N 3.1Å; P48-F72 WeakPolarHBondContact O-CZ 3.3Å; P48-T93 VanDerWaalsContact CD-OG1 3.26Å; P48-T93 WeakPolarHBondContact CD-OG1 3.34Å; P48-L94 WeakPolarHBondContact CD-O 3.49Å; P48-L94 WeakPolarHBondContact CG-O 3.41Å; P48-L95 HydrophobicContact CG-CD2 3.82Å
49	I	84.6	Confident	72.2	Confident	67 Å²	67	100.5 Å²	100.5	34%	0.344	55%	0.55	S	S	.	.			trans	-78.1	116.9	176.1	-61.8	167	0	0	0	108	I47 L69 F72	I47-I49 PolarHBondContact O-N 3.04Å; I49-L69 HydrophobicContact CD1-CD1 3.89Å; I49-L69 HydrophobicContact CG1-CD1 4.25Å; I49-L69 HydrophobicContact CG2-CD1 3.81Å; I49-F72 HydrophobicContact CB-CE1 4.35Å; I49-F72 HydrophobicContact CG1-CE1 4.07Å; I49-F72 HydrophobicContact CG2-CE1 4.41Å
50	D	84.1	Confident	73.3	Confident	72 Å²	72	94.5 Å²	94.5	39%	0.385	53%	0.528	S	S	.	.			trans	-141.4	106.5	174.9	-175.8	10	0	0	0	107.5	P48 F72 S96 H98	P48-D50 PolarHBondContact O-N 3.1Å; D50-F72 VanDerWaalsContact O-CE2 3.26Å; D50-F72 WeakPolarHBondContact O-CE2 3.39Å; D50-S96 PolarHBondContact O-OG 3.12Å; D50-H98 IonicContact OD1-NE2 3.9Å; D50-H98 PolarHBondContact OD1-NE2 3.4Å; D50-H98 IonicContact OD2-NE2 3.46Å
51	L	77.9	Confident	74.6	Confident	60 Å²	60	93.6 Å²	93.6	31%	0.314	52%	0.519	S	S	.	.			trans	-130.7	134.3	-164.9	179.7	89	0	0	0	108.6	C53 K68 F72	L51-C53 WeakPolarHBondContact CD2-SG 3.4Å; L51-K68 HydrophobicContact CD1-CB 4.14Å; L51-K68 WeakPolarHBondContact CD1-O 3.31Å; L51-K68 HydrophobicContact CD2-CB 3.86Å; L51-F72 HydrophobicContact CD1-CB 3.64Å; L51-F72 HydrophobicContact CD1-CD2 4.43Å; L51-F72 HydrophobicContact CD1-CG 4.34Å
52	I	76.1	Confident	75.8	Confident	34 Å²	34	91.4 Å²	91.4	17%	0.174	50%	0.504	C	S	.	.			trans	-107.4	127.8	168.1	-59	178	0	0	0	109.1	H98 M105 L145	I52-H98 HydrophobicContact CD1-CB 3.52Å; I52-H98 WeakPolarHBondContact CD1-ND1 3.41Å; I52-M105 HydrophobicContact CB-SD 3.82Å; I52-M105 HydrophobicContact CD1-CE 4.1Å; I52-M105 HydrophobicContact CD1-SD 3.42Å; I52-M105 WeakPolarHBondContact CD1-SD 3.5Å; I52-M105 HydrophobicContact CG1-SD 4.21Å; I52-M105 HydrophobicContact CG2-CE 3.98Å; I52-M105 HydrophobicContact CG2-SD 3.48Å; I52-M105 WeakPolarHBondContact CG2-SD 3.42Å; I52-L145 HydrophobicContact CD1-CD2 4.27Å
53	C	75.1	Confident	76.4	Confident	27 Å²	27	97.1 Å²	97.1	18%	0.182	52%	0.516	C	S	.	.			trans	-111.2	125.7	173.5	-66.3	0	0	0	0	109.3	L51 F55	L51-C53 WeakPolarHBondContact CD2-SG 3.4Å; C53-F55 HydrophobicContact CB-CD2 4.2Å; C53-F55 HydrophobicContact CB-CE1 3.91Å; C53-F55 HydrophobicContact CB-CE2 3.43Å; C53-F55 VanDerWaalsContact CB-CE2 3.43Å; C53-F55 HydrophobicContact CB-CZ 3.27Å
54	N	71.9	Confident	76.9	Confident	117 Å²	117	95.2 Å²	95.2	63%	0.626	51%	0.509	S	S	*	.			trans	-93.3	118.2	167	-68.3	-11.7	0	0	0	107.5
55	F	70	Confident	77	Confident	96 Å²	96	92.3 Å²	92.3	42%	0.421	49%	0.485	S	S	.	.			trans	-103.3	123.7	173.7	-57.9	-68	0	0	0	108.6	C53 L65	C53-F55 HydrophobicContact CB-CD2 4.2Å; C53-F55 HydrophobicContact CB-CE1 3.91Å; C53-F55 HydrophobicContact CB-CE2 3.43Å; C53-F55 VanDerWaalsContact CB-CE2 3.43Å; C53-F55 HydrophobicContact CB-CZ 3.27Å; F55-L65 HydrophobicContact CE1-CD2 4.48Å; F55-L65 HydrophobicContact CZ-CD2 3.82Å
56	S	65.1	Low	77	Confident	135 Å²	135	92.4 Å²	92.4	94%	0.944	49%	0.491	S	S	*	.	S	Bend	trans	-98.2	74.3	172.2	55.5	0	0	0	0	108.2
57	G	65.1	Low	77	Confident	52 Å²	52	86.1 Å²	86.1	54%	0.536	48%	0.48	S	S	.	.	S	Bend	trans	141.4	169.2	-177.5	0	0	0	0	0	112.9	E59	G57-E59 VanDerWaalsContact C-N 3.29Å; G57-E59 PolarHBondContact O-N 3.36Å
58	D	65.4	Low	76.9	Confident	177 Å²	177	87.2 Å²	87.2	95%	0.947	48%	0.482	S	S	*	.	S	Bend	trans	-77.5	-9.7	-176.3	-72.8	-26.4	0	0	0	114
59	E	65.9	Low	76.9	Confident	181 Å²	181	87 Å²	87	85%	0.846	48%	0.479	S	S	*	.			trans	-124.5	122.3	-176.9	-68	-170.7	162.6	0	0	112.1	G57	G57-E59 VanDerWaalsContact C-N 3.29Å; G57-E59 PolarHBondContact O-N 3.36Å
60	S	69.9	Low	77.1	Confident	53 Å²	53	87.1 Å²	87.1	37%	0.371	49%	0.485	S	S	.	.			trans	-108	130.7	166.8	65.9	0	0	0	0	109.5
61	T	78.4	Confident	77.3	Confident	71 Å²	71	87 Å²	87	44%	0.436	49%	0.49	S	S	.	.			trans	-84.1	152.4	177	72.5	0	0	0	0	111.3	K63 D64 L65	T61-K63 PolarHBondContact O-N 2.87Å; T61-D64 WeakPolarHBondContact CB-OD2 3.45Å; T61-D64 PolarHBondContact N-OD2 3.23Å; T61-D64 VanDerWaalsContact N-OD2 3.11Å; T61-D64 WeakPolarHBondContact O-CB 3.18Å; T61-D64 PolarHBondContact O-N 3.44Å; T61-D64 PolarHBondContact OG1-N 3.12Å; T61-D64 PolarHBondContact OG1-OD2 2.63Å; T61-L65 PolarHBondContact O-N 3Å
62	H	79.7	Confident	77.9	Confident	149 Å²	149	84.5 Å²	84.5	69%	0.69	48%	0.477	S	S	*	.	H	α-helix	trans	-51.5	-37.5	170.1	175.5	-96.4	0	0	0	111.7	D64 L65 C66	H62-D64 PolarHBondContact O-N 3.09Å; H62-L65 PolarHBondContact O-N 3.42Å; H62-C66 PolarHBondContact CE1-SG 2.94Å; H62-C66 PolarHBondContact O-N 2.94Å; H62-C66 PolarHBondContact O-SG 2.96Å; H62-C66 VanDerWaalsContact O-SG 3.33Å
63	K	82.6	Confident	78.6	Confident	167 Å²	167	86.1 Å²	86.1	73%	0.726	49%	0.486	S	S	*	.	H	α-helix	trans	-62	-40.7	177.3	-173.5	179.4	178.7	-179.9	0	112.5	T61 C66 A67	T61-K63 PolarHBondContact O-N 2.87Å; K63-C66 PolarHBondContact O-N 3.49Å; K63-A67 WeakPolarHBondContact O-CB 3.3Å; K63-A67 PolarHBondContact O-N 3.21Å
64	D	82.2	Confident	79.3	Confident	77 Å²	77	89.1 Å²	89.1	41%	0.412	50%	0.5	S	S	.	.	H	α-helix	trans	-65.4	-41.7	177.8	-60	-44.2	0	0	0	111.4	T61 H62 A67 K68	T61-D64 WeakPolarHBondContact CB-OD2 3.45Å; T61-D64 PolarHBondContact N-OD2 3.23Å; T61-D64 VanDerWaalsContact N-OD2 3.11Å; T61-D64 WeakPolarHBondContact O-CB 3.18Å; T61-D64 PolarHBondContact O-N 3.44Å; T61-D64 PolarHBondContact OG1-N 3.12Å; T61-D64 PolarHBondContact OG1-OD2 2.63Å; H62-D64 PolarHBondContact O-N 3.09Å; D64-A67 PolarHBondContact O-N 3.48Å; D64-K68 WeakPolarHBondContact O-CG 3.35Å; D64-K68 PolarHBondContact O-N 2.84Å
65	L	80.7	Confident	80.1	Confident	46 Å²	46	85.6 Å²	85.6	24%	0.241	48%	0.484	C	S	.	.	H	α-helix	trans	-61.8	-46.2	174.5	-71.3	172.2	0	0	0	111.4	L17 F55 T61 H62 A67 K68 L69	L17-L65 HydrophobicContact CD1-CD1 4.36Å; L17-L65 HydrophobicContact CD1-CD2 3.85Å; F55-L65 HydrophobicContact CE1-CD2 4.48Å; F55-L65 HydrophobicContact CZ-CD2 3.82Å; T61-L65 PolarHBondContact O-N 3Å; H62-L65 PolarHBondContact O-N 3.42Å; L65-A67 PolarHBondContact O-N 3.13Å; L65-K68 PolarHBondContact O-N 3.36Å; L65-L69 WeakPolarHBondContact O-CB 3.47Å; L65-L69 PolarHBondContact O-N 3.24Å
66	C	83.1	Confident	81.1	Confident	52 Å²	52	81.2 Å²	81.2	35%	0.351	47%	0.465	S	S	.	.	H	α-helix	trans	-59.1	-45.7	174.8	-69.8	0	0	0	0	111.8	H62 K63 K68 L69 S70	H62-C66 PolarHBondContact CE1-SG 2.94Å; H62-C66 PolarHBondContact O-N 2.94Å; H62-C66 PolarHBondContact O-SG 2.96Å; H62-C66 VanDerWaalsContact O-SG 3.33Å; K63-C66 PolarHBondContact O-N 3.49Å; C66-K68 VanDerWaalsContact C-N 3.32Å; C66-K68 PolarHBondContact O-N 3.49Å; C66-L69 PolarHBondContact O-N 3.32Å; C66-S70 PolarHBondContact O-N 3.37Å; C66-S70 PolarHBondContact O-OG 3.2Å
67	A	86	Confident	82.4	Confident	61 Å²	61	79.7 Å²	79.7	50%	0.504	44%	0.443	S	S	.	.	H	α-helix	trans	-61.9	-40	178.5	0	0	0	0	0	112	K63 D64 L65 S71	K63-A67 WeakPolarHBondContact O-CB 3.3Å; K63-A67 PolarHBondContact O-N 3.21Å; D64-A67 PolarHBondContact O-N 3.48Å; L65-A67 PolarHBondContact O-N 3.13Å; A67-S71 WeakPolarHBondContact O-CB 3.44Å; A67-S71 PolarHBondContact O-N 2.85Å
68	K	85.3	Confident	83.6	Confident	103 Å²	103	84 Å²	84	45%	0.448	44%	0.443	S	S	.	.	H	α-helix	trans	-67.1	-40.3	174.9	-71.1	-66.6	-174.5	-172.6	0	112.3	L51 D64 L65 C66 S71 F72	L51-K68 HydrophobicContact CD1-CB 4.14Å; L51-K68 WeakPolarHBondContact CD1-O 3.31Å; L51-K68 HydrophobicContact CD2-CB 3.86Å; D64-K68 WeakPolarHBondContact O-CG 3.35Å; D64-K68 PolarHBondContact O-N 2.84Å; L65-K68 PolarHBondContact O-N 3.36Å; C66-K68 VanDerWaalsContact C-N 3.32Å; C66-K68 PolarHBondContact O-N 3.49Å; K68-S71 PolarHBondContact O-N 2.84Å; K68-F72 WeakPolarHBondContact O-CB 3.4Å; K68-F72 PolarHBondContact O-N 3.46Å
69	L	86.2	Confident	84.7	Confident	31 Å²	31	76.4 Å²	76.4	16%	0.162	40%	0.404	C	S	.	.	H	α-helix	trans	-62.5	-46.2	174.8	179.2	59.7	0	0	0	111.7	V19 I49 L65 C66 S71 F72 L73	V19-L69 HydrophobicContact CG1-CD2 4.29Å; I49-L69 HydrophobicContact CD1-CD1 3.89Å; I49-L69 HydrophobicContact CG1-CD1 4.25Å; I49-L69 HydrophobicContact CG2-CD1 3.81Å; L65-L69 WeakPolarHBondContact O-CB 3.47Å; L65-L69 PolarHBondContact O-N 3.24Å; C66-L69 PolarHBondContact O-N 3.32Å; L69-S71 PolarHBondContact O-N 3.14Å; L69-F72 HydrophobicContact CD1-CD1 4.39Å; L69-F72 WeakPolarHBondContact O-CA 3.46Å; L69-F72 WeakPolarHBondContact O-CB 3.38Å; L69-F72 PolarHBondContact O-N 3.47Å; L69-F72 VanDerWaalsContact O-N 3.12Å; L69-L73 HydrophobicContact CD1-CG 4.46Å; L69-L73 HydrophobicContact CG-CD1 4.43Å; L69-L73 WeakPolarHBondContact O-CG 3.42Å; L69-L73 PolarHBondContact O-N 3.32Å
70	S	88.7	Confident	85.8	Confident	68 Å²	68	68.9 Å²	68.9	48%	0.476	37%	0.37	S	S	.	.	H	α-helix	trans	-59.7	-45.5	175.3	-62.3	0	0	0	0	111.5	C66 F72 L73 D74	C66-S70 PolarHBondContact O-N 3.37Å; C66-S70 PolarHBondContact O-OG 3.2Å; S70-F72 VanDerWaalsContact C-N 3.26Å; S70-F72 PolarHBondContact O-N 3.4Å; S70-L73 PolarHBondContact O-N 2.68Å; S70-L73 VanDerWaalsContact O-N 3.15Å; S70-D74 PolarHBondContact O-N 2.93Å
71	S	89	Confident	86.8	Confident	69 Å²	69	70.4 Å²	70.4	48%	0.483	37%	0.374	S	S	.	.	H	α-helix	trans	-59.9	-37.2	174.9	-171.8	0	0	0	0	112.6	A67 K68 L69 S75	A67-S71 WeakPolarHBondContact O-CB 3.44Å; A67-S71 PolarHBondContact O-N 2.85Å; K68-S71 PolarHBondContact O-N 2.84Å; L69-S71 PolarHBondContact O-N 3.14Å; S71-S75 WeakPolarHBondContact O-CB 3.24Å; S71-S75 PolarHBondContact O-N 3.29Å
72	F	89.6	Confident	87.1	Confident	8 Å²	8	69.8 Å²	69.8	4%	0.035	37%	0.365	C	S	.	.	H	α-helix	trans	-62.9	-49.8	173.3	166.5	-86.4	0	0	0	111.6	I47 P48 I49 D50 L51 K68 L69 S70 D74 S75 Y76 S96 R109	I47-F72 HydrophobicContact CG2-CE1 4.1Å; P48-F72 WeakPolarHBondContact O-CZ 3.3Å; I49-F72 HydrophobicContact CB-CE1 4.35Å; I49-F72 HydrophobicContact CG1-CE1 4.07Å; I49-F72 HydrophobicContact CG2-CE1 4.41Å; D50-F72 VanDerWaalsContact O-CE2 3.26Å; D50-F72 WeakPolarHBondContact O-CE2 3.39Å; L51-F72 HydrophobicContact CD1-CB 3.64Å; L51-F72 HydrophobicContact CD1-CD2 4.43Å; L51-F72 HydrophobicContact CD1-CG 4.34Å; K68-F72 WeakPolarHBondContact O-CB 3.4Å; K68-F72 PolarHBondContact O-N 3.46Å; L69-F72 HydrophobicContact CD1-CD1 4.39Å; L69-F72 WeakPolarHBondContact O-CA 3.46Å; L69-F72 WeakPolarHBondContact O-CB 3.38Å; L69-F72 PolarHBondContact O-N 3.47Å; L69-F72 VanDerWaalsContact O-N 3.12Å; S70-F72 VanDerWaalsContact C-N 3.26Å; S70-F72 PolarHBondContact O-N 3.4Å; F72-D74 PolarHBondContact O-N 2.9Å; F72-S75 PolarHBondContact O-N 3.2Å; F72-Y76 HydrophobicContact CE1-CD2 4.27Å; F72-Y76 AromaticContact CZ-CD2 3.89Å; F72-Y76 HydrophobicContact CZ-CD2 3.89Å; F72-Y76 WeakPolarHBondContact O-CB 3.44Å; F72-Y76 PolarHBondContact O-N 3.38Å; F72-S96 WeakPolarHBondContact CE2-OG 3.13Å; F72-R109 PolarHBondContact O-NH2 3.33Å
73	L	90.5	Very high	87.4	Confident	69 Å²	69	62.7 Å²	62.7	36%	0.361	33%	0.332	S	S	.	.	H	α-helix	trans	-62.3	-43.9	-178.4	-69	173.3	0	0	0	111.6	I47 L69 S70 S75 Y76 H77	I47-L73 HydrophobicContact CG2-CD2 4.18Å; L69-L73 HydrophobicContact CD1-CG 4.46Å; L69-L73 HydrophobicContact CG-CD1 4.43Å; L69-L73 WeakPolarHBondContact O-CG 3.42Å; L69-L73 PolarHBondContact O-N 3.32Å; S70-L73 PolarHBondContact O-N 2.68Å; S70-L73 VanDerWaalsContact O-N 3.15Å; L73-S75 VanDerWaalsContact C-N 3.35Å; L73-S75 PolarHBondContact O-N 3.22Å; L73-Y76 WeakPolarHBondContact O-CB 3.28Å; L73-Y76 PolarHBondContact O-N 2.94Å; L73-Y76 VanDerWaalsContact O-N 3.17Å; L73-H77 WeakPolarHBondContact O-CB 3.35Å; L73-H77 PolarHBondContact O-N 3.27Å
74	D	90.4	Very high	87.7	Confident	90 Å²	90	60.7 Å²	60.7	48%	0.481	32%	0.32	S	S	.	.	H	α-helix	trans	-58.4	-47.2	174.9	-83.4	-8.2	0	0	0	112.2	S70 F72 Y76 H77 R78	S70-D74 PolarHBondContact O-N 2.93Å; F72-D74 PolarHBondContact O-N 2.9Å; D74-Y76 VanDerWaalsContact C-N 3.29Å; D74-Y76 PolarHBondContact O-N 2.84Å; D74-H77 PolarHBondContact O-N 3.02Å; D74-R78 WeakPolarHBondContact O-CG 3.26Å; D74-R78 PolarHBondContact O-N 3.32Å
75	S	88.6	Confident	87.9	Confident	43 Å²	43	64.3 Å²	64.3	30%	0.301	33%	0.328	S	S	.	.	H	α-helix	trans	-68.3	-33.5	179.8	-173.7	0	0	0	0	110.8	S71 F72 L73 A79 R109	S71-S75 WeakPolarHBondContact O-CB 3.24Å; S71-S75 PolarHBondContact O-N 3.29Å; F72-S75 PolarHBondContact O-N 3.2Å; L73-S75 VanDerWaalsContact C-N 3.35Å; L73-S75 PolarHBondContact O-N 3.22Å; S75-A79 PolarHBondContact O-N 2.63Å; S75-A79 VanDerWaalsContact O-N 3.13Å; S75-R109 PolarHBondContact O-NH1 3.46Å; S75-R109 PolarHBondContact OG-NH1 3.49Å
76	Y	91.8	Very high	88	Confident	4 Å²	4	66.3 Å²	66.3	2%	0.016	34%	0.336	C	S	.	.	H	α-helix	trans	-65.4	-48.5	175.1	-173.6	-72.4	0	0	0	110.5	H45 R46 I47 F72 L73 D74 R78 A79 L80 L94 R109	H45-Y76 AromaticContact NE2-CE1 3.46Å; H45-Y76 WeakPolarHBondContact NE2-CE1 3.45Å; H45-Y76 AromaticContact NE2-CZ 3.59Å; H45-Y76 PolarHBondContact NE2-OH 2.9Å; R46-Y76 PolarHBondContact O-OH 3.41Å; R46-Y76 VanDerWaalsContact O-OH 3.14Å; I47-Y76 HydrophobicContact CB-CE2 4.5Å; I47-Y76 HydrophobicContact CD1-CD1 4.4Å; I47-Y76 HydrophobicContact CD1-CE1 4.28Å; I47-Y76 HydrophobicContact CG1-CD1 4.4Å; I47-Y76 HydrophobicContact CG1-CE1 3.87Å; I47-Y76 HydrophobicContact CG2-CD1 4.26Å; I47-Y76 HydrophobicContact CG2-CD2 3.88Å; I47-Y76 HydrophobicContact CG2-CE1 4.21Å; I47-Y76 HydrophobicContact CG2-CE2 3.8Å; I47-Y76 HydrophobicContact CG2-CG 4.14Å; F72-Y76 HydrophobicContact CE1-CD2 4.27Å; F72-Y76 AromaticContact CZ-CD2 3.89Å; F72-Y76 HydrophobicContact CZ-CD2 3.89Å; F72-Y76 WeakPolarHBondContact O-CB 3.44Å; F72-Y76 PolarHBondContact O-N 3.38Å; L73-Y76 WeakPolarHBondContact O-CB 3.28Å; L73-Y76 PolarHBondContact O-N 2.94Å; L73-Y76 VanDerWaalsContact O-N 3.17Å; D74-Y76 VanDerWaalsContact C-N 3.29Å; D74-Y76 PolarHBondContact O-N 2.84Å; Y76-R78 VanDerWaalsContact C-N 3.35Å; Y76-R78 PolarHBondContact O-N 3.04Å; Y76-A79 PolarHBondContact O-N 2.99Å; Y76-L80 HydrophobicContact CD1-CB 4.49Å; Y76-L80 HydrophobicContact CE1-CB 4.41Å; Y76-L80 HydrophobicContact CE1-CD2 4.34Å; Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 3.17Å; Y76-L94 HydrophobicContact CE1-CD1 4.28Å; Y76-L94 HydrophobicContact CE1-CG 4.31Å; Y76-L94 HydrophobicContact CE2-CB 3.72Å; Y76-L94 HydrophobicContact CE2-CG 4.38Å; Y76-L94 PolarHBondContact OH-N 2.88Å; Y76-R109 VanDerWaalsContact CD2-CD 3.46Å; Y76-R109 VanDerWaalsContact N-CZ 3.31Å
77	H	91	Very high	87.9	Confident	102 Å²	102	64.3 Å²	64.3	47%	0.472	32%	0.322	S	S	.	.	H	α-helix	trans	-57.1	-47.1	177.9	178.6	70.2	0	0	0	111.6	L73 D74 A79 L80 L81	L73-H77 WeakPolarHBondContact O-CB 3.35Å; L73-H77 PolarHBondContact O-N 3.27Å; D74-H77 PolarHBondContact O-N 3.02Å; H77-A79 PolarHBondContact O-N 3.32Å; H77-L80 PolarHBondContact O-N 3.18Å; H77-L81 VanDerWaalsContact NE2-CD1 3.27Å; H77-L81 WeakPolarHBondContact NE2-CD1 3.13Å; H77-L81 PolarHBondContact O-N 3.11Å
78	R	89.8	Confident	87.9	Confident	143 Å²	143	69.7 Å²	69.7	54%	0.54	33%	0.334	S	S	.	.	H	α-helix	trans	-58.5	-44.6	175.4	-74.8	-174.3	-72.7	-93.7	2	112.8	D74 Y76 F82	D74-R78 WeakPolarHBondContact O-CG 3.26Å; D74-R78 PolarHBondContact O-N 3.32Å; Y76-R78 VanDerWaalsContact C-N 3.35Å; Y76-R78 PolarHBondContact O-N 3.04Å; R78-F82 PolarHBondContact O-N 3.31Å
79	A	88.6	Confident	87.9	Confident	17 Å²	17	70.7 Å²	70.7	14%	0.14	34%	0.335	C	S	.	.	H	α-helix	trans	-64.6	-41	177.5	0	0	0	0	0	111.8	S75 Y76 H77 L83 L94 R109	S75-A79 PolarHBondContact O-N 2.63Å; S75-A79 VanDerWaalsContact O-N 3.13Å; Y76-A79 PolarHBondContact O-N 2.99Å; H77-A79 PolarHBondContact O-N 3.32Å; A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.45Å; A79-L94 HydrophobicContact CB-CD1 3.91Å; A79-R109 HydrophobicContact CB-CB 4.1Å
80	L	90.3	Very high	87.8	Confident	24 Å²	24	70.9 Å²	70.9	13%	0.126	34%	0.339	C	S	.	.	H	α-helix	trans	-63	-49.4	178.5	-180	62.6	0	0	0	112	Y76 H77 F82 L83 W84 P91 L94	Y76-L80 HydrophobicContact CD1-CB 4.49Å; Y76-L80 HydrophobicContact CE1-CB 4.41Å; Y76-L80 HydrophobicContact CE1-CD2 4.34Å; Y76-L80 WeakPolarHBondContact O-CB 3.38Å; Y76-L80 PolarHBondContact O-N 3.17Å; H77-L80 PolarHBondContact O-N 3.18Å; L80-F82 VanDerWaalsContact C-N 3.34Å; L80-F82 PolarHBondContact O-N 3.46Å; L80-L83 PolarHBondContact O-N 3.26Å; L80-W84 VanDerWaalsContact O-CB 3.32Å; L80-W84 WeakPolarHBondContact O-CB 3.46Å; L80-W84 PolarHBondContact O-N 2.88Å; L80-P91 HydrophobicContact CD1-CG 3.73Å; L80-L94 HydrophobicContact CB-CD1 4.01Å; L80-L94 HydrophobicContact CD1-CD1 4.47Å; L80-L94 HydrophobicContact CD1-CG 4.42Å
81	L	89.9	Confident	87.7	Confident	85 Å²	85	68 Å²	68	45%	0.445	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-44.3	179.2	-73.7	-176.3	0	0	0	111.9	H77 W84 R85	H77-L81 VanDerWaalsContact NE2-CD1 3.27Å; H77-L81 WeakPolarHBondContact NE2-CD1 3.13Å; H77-L81 PolarHBondContact O-N 3.11Å; L81-W84 PolarHBondContact O-N 3.1Å; L81-R85 PolarHBondContact O-N 3.35Å
82	F	85.9	Confident	87.5	Confident	58 Å²	58	72.9 Å²	72.9	25%	0.254	33%	0.331	S	S	.	.	H	α-helix	trans	-62.8	-50.8	176.6	-173.8	-64.4	0	0	0	110.2	R78 L80 W84 R85 E86 W122 I125	R78-F82 PolarHBondContact O-N 3.31Å; L80-F82 VanDerWaalsContact C-N 3.34Å; L80-F82 PolarHBondContact O-N 3.46Å; F82-W84 VanDerWaalsContact C-N 3.29Å; F82-W84 PolarHBondContact O-N 2.86Å; F82-R85 PolarHBondContact O-N 2.84Å; F82-R85 VanDerWaalsContact O-N 3.12Å; F82-E86 HydrophobicContact CD1-CG 3.6Å; F82-E86 HydrophobicContact CE1-CG 3.33Å; F82-E86 HydrophobicContact CZ-CG 4.08Å; F82-E86 WeakPolarHBondContact O-CG 3.46Å; F82-E86 PolarHBondContact O-N 2.87Å; F82-W122 HydrophobicContact CB-CH2 3.86Å; F82-W122 HydrophobicContact CB-CZ2 4.46Å; F82-W122 AromaticContact CD1-CE2 4Å; F82-W122 AromaticContact CD1-CH2 2.88Å; F82-W122 HydrophobicContact CD1-CH2 2.88Å; F82-W122 AromaticContact CD1-CZ2 2.98Å; F82-W122 HydrophobicContact CD1-CZ2 2.98Å; F82-W122 AromaticContact CD1-CZ3 3.79Å; F82-W122 HydrophobicContact CD1-CZ3 3.79Å; F82-W122 HydrophobicContact CE1-CD2 4.45Å; F82-W122 AromaticContact CE1-CE2 3.88Å; F82-W122 HydrophobicContact CE1-CE3 4.39Å; F82-W122 AromaticContact CE1-CH2 3.36Å; F82-W122 HydrophobicContact CE1-CH2 3.36Å; F82-W122 AromaticContact CE1-CZ2 3.3Å; F82-W122 HydrophobicContact CE1-CZ2 3.3Å; F82-W122 AromaticContact CE1-CZ3 3.89Å; F82-W122 HydrophobicContact CE1-CZ3 3.89Å; F82-W122 AromaticContact CG-CH2 3.53Å; F82-W122 HydrophobicContact CG-CH2 3.53Å; F82-W122 HydrophobicContact CG-CZ2 4.03Å; F82-W122 HydrophobicContact CG-CZ3 4.33Å; F82-W122 HydrophobicContact CZ-CH2 4.41Å; F82-I125 HydrophobicContact CE1-CD1 3.92Å; F82-I125 HydrophobicContact CE2-CD1 4.48Å; F82-I125 HydrophobicContact CZ-CD1 3.46Å; F82-I125 VanDerWaalsContact CZ-CD1 3.46Å
83	L	85.7	Confident	87.6	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-57.7	-41.7	179.2	-82.4	164.7	0	0	0	112.6	A79 L80 E86 L87 P91 L94 P111 W122	A79-L83 WeakPolarHBondContact O-CB 3.34Å; A79-L83 WeakPolarHBondContact O-CG 3.3Å; A79-L83 PolarHBondContact O-N 3.45Å; L80-L83 PolarHBondContact O-N 3.26Å; L83-E86 PolarHBondContact O-N 2.79Å; L83-L87 HydrophobicContact CB-CD1 4.42Å; L83-L87 HydrophobicContact CD2-CD1 4.02Å; L83-L87 HydrophobicContact CD2-CG 4.49Å; L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.31Å; L83-L87 PolarHBondContact O-N 3.43Å; L83-P91 HydrophobicContact CB-CG 4.24Å; L83-L94 HydrophobicContact CD1-CD1 3.78Å; L83-L94 HydrophobicContact CD1-CD2 3.28Å; L83-L94 HydrophobicContact CD1-CG 4.17Å; L83-P111 HydrophobicContact CD1-CG 3.93Å; L83-P111 HydrophobicContact CD2-CG 3.89Å; L83-W122 HydrophobicContact CB-CZ2 4.04Å; L83-W122 HydrophobicContact CD1-CZ2 4.28Å; L83-W122 HydrophobicContact CD2-CD2 4.21Å; L83-W122 HydrophobicContact CD2-CH2 4.09Å; L83-W122 HydrophobicContact CD2-CZ2 3.12Å; L83-W122 HydrophobicContact CG-CH2 3.7Å; L83-W122 HydrophobicContact CG-CZ2 3.15Å
84	W	88.2	Confident	87.6	Confident	124 Å²	124	70.5 Å²	70.5	47%	0.47	32%	0.32	S	S	.	.	H	α-helix	trans	-60.6	-47.8	176.2	-175.1	-5	0	0	0	110.7	L80 L81 F82 E86 L87 K88 P90	L80-W84 VanDerWaalsContact O-CB 3.32Å; L80-W84 WeakPolarHBondContact O-CB 3.46Å; L80-W84 PolarHBondContact O-N 2.88Å; L81-W84 PolarHBondContact O-N 3.1Å; F82-W84 VanDerWaalsContact C-N 3.29Å; F82-W84 PolarHBondContact O-N 2.86Å; W84-E86 VanDerWaalsContact C-N 3.34Å; W84-E86 PolarHBondContact O-N 2.79Å; W84-L87 PolarHBondContact O-N 2.89Å; W84-K88 WeakPolarHBondContact O-CA 3.41Å; W84-K88 PolarHBondContact O-N 2.89Å; W84-P90 HydrophobicContact CD2-CB 3.86Å; W84-P90 HydrophobicContact CD2-CG 4.46Å; W84-P90 HydrophobicContact CE3-CB 4.15Å; W84-P90 HydrophobicContact CG-CB 4.13Å; W84-P90 HydrophobicContact CZ2-CB 4.47Å; W84-P90 HydrophobicContact CZ2-CG 4.29Å
85	R	87.4	Confident	87.6	Confident	154 Å²	154	67.7 Å²	67.7	58%	0.581	31%	0.305	S	S	*	.	H	α-helix	trans	-59.7	-43.3	179.4	-170.2	-175.4	69.6	-168.9	0.3	112.9	L81 F82 K88	L81-R85 PolarHBondContact O-N 3.35Å; F82-R85 PolarHBondContact O-N 2.84Å; F82-R85 VanDerWaalsContact O-N 3.12Å; R85-K88 PolarHBondContact O-NZ 3.46Å
86	E	82.6	Confident	87.7	Confident	88 Å²	88	66.2 Å²	66.2	41%	0.411	30%	0.295	S	S	.	.	H	α-helix	trans	-75.4	-40.5	-179	-61.7	-46.8	129.4	0	0	112.7	F82 L83 W84	F82-E86 HydrophobicContact CD1-CG 3.6Å; F82-E86 HydrophobicContact CE1-CG 3.33Å; F82-E86 HydrophobicContact CZ-CG 4.08Å; F82-E86 WeakPolarHBondContact O-CG 3.46Å; F82-E86 PolarHBondContact O-N 2.87Å; L83-E86 PolarHBondContact O-N 2.79Å; W84-E86 VanDerWaalsContact C-N 3.34Å; W84-E86 PolarHBondContact O-N 2.79Å
87	L	81.5	Confident	87.6	Confident	10 Å²	10	66.5 Å²	66.5	5%	0.052	30%	0.296	C	S	.	.	H	α-helix	trans	-81.8	-14.2	-178.6	-62.7	175.8	0	0	0	113.2	L83 W84 Y89 P111 I114	L83-L87 HydrophobicContact CB-CD1 4.42Å; L83-L87 HydrophobicContact CD2-CD1 4.02Å; L83-L87 HydrophobicContact CD2-CG 4.49Å; L83-L87 WeakPolarHBondContact O-CB 3.46Å; L83-L87 WeakPolarHBondContact O-CG 3.31Å; L83-L87 PolarHBondContact O-N 3.43Å; W84-L87 PolarHBondContact O-N 2.89Å; L87-Y89 HydrophobicContact CB-CD1 4.46Å; L87-Y89 HydrophobicContact CB-CE1 4.2Å; L87-Y89 HydrophobicContact CB-CE2 4.39Å; L87-Y89 WeakPolarHBondContact O-CD1 3.38Å; L87-Y89 WeakPolarHBondContact O-CE1 3.4Å; L87-Y89 PolarHBondContact O-N 2.88Å; L87-Y89 VanDerWaalsContact O-N 3.16Å; L87-P111 HydrophobicContact CD1-CG 4.09Å; L87-I114 HydrophobicContact CD2-CD1 4.38Å
88	K	85.5	Confident	87.5	Confident	173 Å²	173	62 Å²	62	75%	0.752	28%	0.275	S	S	*	.	S	Bend	trans	66.1	-2.3	-173.4	-52	-60.5	-179.8	-165.7	0	115.5	W84 R85	W84-K88 WeakPolarHBondContact O-CA 3.41Å; W84-K88 PolarHBondContact O-N 2.89Å; R85-K88 PolarHBondContact O-NZ 3.46Å
89	Y	85.1	Confident	87.4	Confident	124 Å²	124	55.2 Å²	55.2	49%	0.486	25%	0.249	S	C	.	.	S	Bend	trans	-137.7	146.4	172.2	54.8	-92.1	0	0	0	109.9	L87 P91	L87-Y89 HydrophobicContact CB-CD1 4.46Å; L87-Y89 HydrophobicContact CB-CE1 4.2Å; L87-Y89 HydrophobicContact CB-CE2 4.39Å; L87-Y89 WeakPolarHBondContact O-CD1 3.38Å; L87-Y89 WeakPolarHBondContact O-CE1 3.4Å; L87-Y89 PolarHBondContact O-N 2.88Å; L87-Y89 VanDerWaalsContact O-N 3.16Å; Y89-P91 WeakPolarHBondContact O-CD 3.2Å
90	P	84.2	Confident	87.3	Confident	35 Å²	35	55.2 Å²	55.2	23%	0.227	25%	0.247	C	C	.	.			trans	-69.2	124.8	176.8	26.9	-30.7	0	0	0	109.4	W84	W84-P90 HydrophobicContact CD2-CB 3.86Å; W84-P90 HydrophobicContact CD2-CG 4.46Å; W84-P90 HydrophobicContact CE3-CB 4.15Å; W84-P90 HydrophobicContact CG-CB 4.13Å; W84-P90 HydrophobicContact CZ2-CB 4.47Å; W84-P90 HydrophobicContact CZ2-CG 4.29Å
91	P	85.3	Confident	86.9	Confident	8 Å²	8	54.2 Å²	54.2	5%	0.052	24%	0.242	C	C	.	.			trans	-66.2	137.9	173.4	26.9	-32.3	0	0	0	109.6	H45 L80 L83 Y89 T93 L94 P111	H45-P91 PolarHBondContact CE1-O 2.88Å; H45-P91 PolarHBondContact ND1-O 2.9Å; L80-P91 HydrophobicContact CD1-CG 3.73Å; L83-P91 HydrophobicContact CB-CG 4.24Å; Y89-P91 WeakPolarHBondContact O-CD 3.2Å; P91-T93 PolarHBondContact O-N 2.95Å; P91-L94 HydrophobicContact CB-CD2 4.11Å; P91-L94 HydrophobicContact CG-CD2 3.57Å; P91-P111 HydrophobicContact CB-CB 3.97Å; P91-P111 HydrophobicContact CB-CG 3.98Å; P91-P111 HydrophobicContact CG-CG 4.35Å
92	K	86.4	Confident	86.5	Confident	172 Å²	172	59 Å²	59	75%	0.748	25%	0.254	S	S	*	.	S	Bend	trans	-54.9	-29.1	-178.2	-68.1	-171.6	174.9	-172.5	0	115.1	H45 R46	H45-K92 PolarHBondContact ND1-O 3.38Å; R46-K92 PolarHBondContact N-O 2.84Å
93	T	90.5	Very high	86.2	Confident	27 Å²	27	61.4 Å²	61.4	17%	0.166	28%	0.279	C	S	.	.			trans	-164.7	150.7	178.4	-174.8	0	0	0	0	108.8	R46 P48 P91	R46-T93 PolarHBondContact O-OG1 3.25Å; P48-T93 VanDerWaalsContact CD-OG1 3.26Å; P48-T93 WeakPolarHBondContact CD-OG1 3.34Å; P91-T93 PolarHBondContact O-N 2.95Å
94	L	91.2	Very high	86.1	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	147	161.5	-48.4	-175.6	0	0	0	109.6	P48 Y76 A79 L80 L83 P91 R109 L110 P111	P48-L94 WeakPolarHBondContact CD-O 3.49Å; P48-L94 WeakPolarHBondContact CG-O 3.41Å; Y76-L94 HydrophobicContact CE1-CD1 4.28Å; Y76-L94 HydrophobicContact CE1-CG 4.31Å; Y76-L94 HydrophobicContact CE2-CB 3.72Å; Y76-L94 HydrophobicContact CE2-CG 4.38Å; Y76-L94 PolarHBondContact OH-N 2.88Å; A79-L94 HydrophobicContact CB-CD1 3.91Å; L80-L94 HydrophobicContact CB-CD1 4.01Å; L80-L94 HydrophobicContact CD1-CD1 4.47Å; L80-L94 HydrophobicContact CD1-CG 4.42Å; L83-L94 HydrophobicContact CD1-CD1 3.78Å; L83-L94 HydrophobicContact CD1-CD2 3.28Å; L83-L94 HydrophobicContact CD1-CG 4.17Å; P91-L94 HydrophobicContact CB-CD2 4.11Å; P91-L94 HydrophobicContact CG-CD2 3.57Å; L94-R109 HydrophobicContact CB-CB 4.16Å; L94-R109 HydrophobicContact CD1-CB 4.18Å; L94-L110 WeakPolarHBondContact CA-O 3.45Å; L94-P111 HydrophobicContact CD2-CB 4.44Å; L94-P111 HydrophobicContact CD2-CG 4Å
95	L	90.5	Very high	85.9	Confident	30 Å²	30	60.9 Å²	60.9	16%	0.157	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	143.4	171	-64	179.9	0	0	0	109.7	P48 Y97 R109 L110 W112	P48-L95 HydrophobicContact CG-CD2 3.82Å; L95-Y97 HydrophobicContact CB-CE2 3.91Å; L95-Y97 WeakPolarHBondContact CD1-OH 3.38Å; L95-Y97 WeakPolarHBondContact O-CD2 3.31Å; L95-Y97 WeakPolarHBondContact O-CE2 3.35Å; L95-R109 VanDerWaalsContact O-CA 3.28Å; L95-R109 WeakPolarHBondContact O-CA 3.25Å; L95-L110 PolarHBondContact N-O 3.37Å; L95-L110 PolarHBondContact O-N 2.89Å; L95-L110 VanDerWaalsContact O-N 3.08Å; L95-W112 HydrophobicContact CD1-CD2 4.18Å; L95-W112 HydrophobicContact CD1-CE3 3.52Å; L95-W112 HydrophobicContact CD1-CZ3 3.99Å; L95-W112 HydrophobicContact CG-CE3 4.38Å
96	S	90.6	Very high	85.9	Confident	13 Å²	13	55.5 Å²	55.5	9%	0.091	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	139	170.2	-62.7	0	0	0	0	110.8	D50 F72 I108	D50-S96 PolarHBondContact O-OG 3.12Å; F72-S96 WeakPolarHBondContact CE2-OG 3.13Å; S96-I108 CarbonylContact C-O 3.49Å
97	Y	89.5	Confident	86.2	Confident	10 Å²	10	53.9 Å²	53.9	4%	0.039	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	119	171.3	-59.9	-76.8	0	0	0	107.7	L95 Y99 S107 I108 L110 R141 A144 V148	L95-Y97 HydrophobicContact CB-CE2 3.91Å; L95-Y97 WeakPolarHBondContact CD1-OH 3.38Å; L95-Y97 WeakPolarHBondContact O-CD2 3.31Å; L95-Y97 WeakPolarHBondContact O-CE2 3.35Å; Y97-Y99 WeakPolarHBondContact CB-OH 3.22Å; Y97-Y99 WeakPolarHBondContact O-CD2 3.27Å; Y97-Y99 VanDerWaalsContact O-CE2 3.28Å; Y97-Y99 WeakPolarHBondContact O-CE2 3.33Å; Y97-S107 WeakPolarHBondContact O-CA 3.44Å; Y97-I108 PolarHBondContact N-O 2.8Å; Y97-I108 PolarHBondContact O-N 2.8Å; Y97-L110 HydrophobicContact CD2-CB 4.12Å; Y97-L110 HydrophobicContact CD2-CD1 4.34Å; Y97-L110 HydrophobicContact CD2-CG 4.44Å; Y97-L110 HydrophobicContact CE2-CB 3.82Å; Y97-R141 PolarHBondContact OH-NH1 3.48Å; Y97-A144 HydrophobicContact CD1-CB 4.33Å; Y97-V148 HydrophobicContact CD1-CG2 3.69Å; Y97-V148 HydrophobicContact CE1-CB 4.14Å; Y97-V148 HydrophobicContact CE1-CG1 3.73Å; Y97-V148 HydrophobicContact CE1-CG2 3.42Å; Y97-V148 VanDerWaalsContact CE1-CG2 3.42Å
98	H	89.3	Confident	86.5	Confident	6 Å²	6	53.8 Å²	53.8	3%	0.028	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	140.7	-178	-54.6	-73.9	0	0	0	109.7	D50 I52 Y106 S107 A144 L145	D50-H98 IonicContact OD1-NE2 3.9Å; D50-H98 PolarHBondContact OD1-NE2 3.4Å; D50-H98 IonicContact OD2-NE2 3.46Å; I52-H98 HydrophobicContact CD1-CB 3.52Å; I52-H98 WeakPolarHBondContact CD1-ND1 3.41Å; H98-Y106 CarbonylContact C-O 3.55Å; H98-Y106 WeakPolarHBondContact CA-O 3.44Å; H98-S107 PolarHBondContact CE1-OG 2.79Å; H98-S107 PolarHBondContact ND1-OG 3.37Å; H98-A144 CarbonylContact O-C 3.58Å; H98-A144 VanDerWaalsContact O-CA 3.25Å; H98-A144 WeakPolarHBondContact O-CA 3.46Å; H98-L145 HydrophobicContact CB-CB 4.2Å; H98-L145 WeakPolarHBondContact O-CB 3.47Å; H98-L145 PolarHBondContact O-N 2.91Å
99	Y	87.8	Confident	86.7	Confident	2 Å²	2	46.4 Å²	46.4	1%	0.008	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	144.6	-177.2	-60.3	-88.4	0	0	0	109	Y97 M105 Y106 I108 V139 R140 Q143 A144	Y97-Y99 WeakPolarHBondContact CB-OH 3.22Å; Y97-Y99 WeakPolarHBondContact O-CD2 3.27Å; Y97-Y99 VanDerWaalsContact O-CE2 3.28Å; Y97-Y99 WeakPolarHBondContact O-CE2 3.33Å; Y99-M105 CarbonylContact O-C 3.59Å; Y99-M105 VanDerWaalsContact O-CA 3.29Å; Y99-M105 WeakPolarHBondContact O-CA 3.31Å; Y99-Y106 PolarHBondContact N-O 3.24Å; Y99-Y106 PolarHBondContact O-N 3.22Å; Y99-I108 HydrophobicContact CD2-CD1 3.74Å; Y99-I108 HydrophobicContact CD2-CG1 4.06Å; Y99-I108 HydrophobicContact CE2-CB 4.1Å; Y99-I108 HydrophobicContact CE2-CD1 3.55Å; Y99-I108 HydrophobicContact CE2-CG1 3.97Å; Y99-V139 HydrophobicContact CD1-CB 4.3Å; Y99-V139 HydrophobicContact CD1-CG1 4.39Å; Y99-V139 HydrophobicContact CD2-CB 4.41Å; Y99-V139 HydrophobicContact CD2-CG1 4.33Å; Y99-V139 HydrophobicContact CE1-CB 4.22Å; Y99-V139 HydrophobicContact CE2-CB 4.34Å; Y99-V139 HydrophobicContact CG-CB 4.39Å; Y99-V139 HydrophobicContact CG-CG1 4.14Å; Y99-V139 PolarHBondContact OH-O 2.71Å; Y99-R140 WeakPolarHBondContact CE1-O 3.45Å; Y99-Q143 HydrophobicContact CD1-CB 4.42Å; Y99-Q143 HydrophobicContact CE1-CB 4.34Å; Y99-A144 HydrophobicContact CD1-CB 4.42Å; Y99-A144 VanDerWaalsContact CE1-CA 3.47Å; Y99-A144 HydrophobicContact CE1-CB 3.82Å
100	V	85	Confident	86.9	Confident	16 Å²	16	40.7 Å²	40.7	10%	0.097	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	118.2	170.5	178.1	0	0	0	0	108.4	L8 S104 M105 L145	L8-V100 HydrophobicContact CD1-CB 3.78Å; L8-V100 HydrophobicContact CD1-CG1 3.96Å; L8-V100 HydrophobicContact CD1-CG2 3.76Å; L8-V100 HydrophobicContact CD2-CG1 4.15Å; L8-V100 HydrophobicContact CD2-CG2 4.3Å; V100-S104 WeakPolarHBondContact CA-O 3.4Å; V100-M105 HydrophobicContact CG2-CE 4.23Å; V100-M105 HydrophobicContact CG2-CG 4.4Å; V100-L145 HydrophobicContact CG2-CD1 4.01Å
101	V	83.1	Confident	87	Confident	4 Å²	4	39.2 Å²	39.2	2%	0.024	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	118.5	-179.4	-178.8	0	0	0	0	107.6	S103 S104 Y106 L132 L138	V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.4Å; V101-S104 PolarHBondContact N-O 3.03Å; V101-S104 WeakPolarHBondContact O-CB 3.3Å; V101-S104 PolarHBondContact O-N 3.1Å; V101-Y106 HydrophobicContact CB-CD2 4.1Å; V101-Y106 HydrophobicContact CB-CE2 3.81Å; V101-Y106 HydrophobicContact CG2-CD2 4.23Å; V101-Y106 HydrophobicContact CG2-CE2 4.41Å; V101-L132 HydrophobicContact CG1-CD2 4.06Å; V101-L138 HydrophobicContact CG1-CD1 4Å; V101-L138 HydrophobicContact CG1-CD2 4.07Å; V101-L138 HydrophobicContact CG1-CG 4.45Å; V101-L138 HydrophobicContact CG2-CB 4.1Å; V101-L138 HydrophobicContact CG2-CD2 4.46Å
102	R	80.9	Confident	86.8	Confident	185 Å²	185	44 Å²	44	70%	0.698	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.6	51.6	179.7	-58.7	177.9	178.9	172.2	-1.6	112.4	S104	R102-S104 PolarHBondContact O-N 2.94Å
103	S	79.4	Confident	86.5	Confident	109 Å²	109	45.1 Å²	45.1	76%	0.762	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.2	2.3	-178.4	-45.4	0	0	0	0	116.1	V101	V101-S103 VanDerWaalsContact C-N 3.34Å; V101-S103 PolarHBondContact O-N 3.4Å
104	S	83.6	Confident	86	Confident	58 Å²	58	45.1 Å²	45.1	41%	0.406	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	140.2	174.4	-63.5	0	0	0	0	110.3	V100 V101 R102	V100-S104 WeakPolarHBondContact CA-O 3.4Å; V101-S104 PolarHBondContact N-O 3.03Å; V101-S104 WeakPolarHBondContact O-CB 3.3Å; V101-S104 PolarHBondContact O-N 3.1Å; R102-S104 PolarHBondContact O-N 2.94Å
105	M	85.3	Confident	85.5	Confident	55 Å²	55	51.2 Å²	51.2	27%	0.271	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	131.3	178.4	-169.2	-179	-72.9	0	0	111	I12 I52 Y99 V100 L145	I12-M105 HydrophobicContact CD1-CE 4.49Å; I52-M105 HydrophobicContact CB-SD 3.82Å; I52-M105 HydrophobicContact CD1-CE 4.1Å; I52-M105 HydrophobicContact CD1-SD 3.42Å; I52-M105 WeakPolarHBondContact CD1-SD 3.5Å; I52-M105 HydrophobicContact CG1-SD 4.21Å; I52-M105 HydrophobicContact CG2-CE 3.98Å; I52-M105 HydrophobicContact CG2-SD 3.48Å; I52-M105 WeakPolarHBondContact CG2-SD 3.42Å; Y99-M105 CarbonylContact O-C 3.59Å; Y99-M105 VanDerWaalsContact O-CA 3.29Å; Y99-M105 WeakPolarHBondContact O-CA 3.31Å; V100-M105 HydrophobicContact CG2-CE 4.23Å; V100-M105 HydrophobicContact CG2-CG 4.4Å; M105-L145 HydrophobicContact CE-CD2 4.32Å
106	Y	87.3	Confident	85.1	Confident	40 Å²	40	53.5 Å²	53.5	16%	0.157	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.1	179.2	-58.6	-88.8	0	0	0	109.6	H98 Y99 V101 F130 L132	H98-Y106 CarbonylContact C-O 3.55Å; H98-Y106 WeakPolarHBondContact CA-O 3.44Å; Y99-Y106 PolarHBondContact N-O 3.24Å; Y99-Y106 PolarHBondContact O-N 3.22Å; V101-Y106 HydrophobicContact CB-CD2 4.1Å; V101-Y106 HydrophobicContact CB-CE2 3.81Å; V101-Y106 HydrophobicContact CG2-CD2 4.23Å; V101-Y106 HydrophobicContact CG2-CE2 4.41Å; Y106-F130 HydrophobicContact CD1-CB 4.18Å; Y106-F130 AromaticContact CD1-CD1 3.79Å; Y106-F130 HydrophobicContact CD1-CD1 3.79Å; Y106-F130 AromaticContact CD1-CD2 3.73Å; Y106-F130 HydrophobicContact CD1-CD2 3.73Å; Y106-F130 HydrophobicContact CD1-CE1 4.02Å; Y106-F130 AromaticContact CD1-CE2 3.96Å; Y106-F130 HydrophobicContact CD1-CE2 3.96Å; Y106-F130 AromaticContact CD1-CG 3.64Å; Y106-F130 HydrophobicContact CD1-CG 3.64Å; Y106-F130 HydrophobicContact CD1-CZ 4.1Å; Y106-F130 HydrophobicContact CE1-CB 3.7Å; Y106-F130 AromaticContact CE1-CD1 3.65Å; Y106-F130 HydrophobicContact CE1-CD1 3.65Å; Y106-F130 HydrophobicContact CE1-CD2 4.13Å; Y106-F130 HydrophobicContact CE1-CE1 4.26Å; Y106-F130 AromaticContact CE1-CG 3.57Å; Y106-F130 HydrophobicContact CE1-CG 3.57Å; Y106-L132 HydrophobicContact CE2-CD2 4.41Å
107	S	88.2	Confident	84.7	Confident	54 Å²	54	57 Å²	57	38%	0.378	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	121.7	175.8	-57	0	0	0	0	109.2	Y97 H98	Y97-S107 WeakPolarHBondContact O-CA 3.44Å; H98-S107 PolarHBondContact CE1-OG 2.79Å; H98-S107 PolarHBondContact ND1-OG 3.37Å
108	I	88.6	Confident	84.4	Confident	8 Å²	8	61.1 Å²	61.1	4%	0.041	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	140.9	-178.4	-52.8	172.7	0	0	0	108.1	S96 Y97 Y99 L110 I126 V139	S96-I108 CarbonylContact C-O 3.49Å; Y97-I108 PolarHBondContact N-O 2.8Å; Y97-I108 PolarHBondContact O-N 2.8Å; Y99-I108 HydrophobicContact CD2-CD1 3.74Å; Y99-I108 HydrophobicContact CD2-CG1 4.06Å; Y99-I108 HydrophobicContact CE2-CB 4.1Å; Y99-I108 HydrophobicContact CE2-CD1 3.55Å; Y99-I108 HydrophobicContact CE2-CG1 3.97Å; I108-L110 HydrophobicContact CG2-CD1 4.32Å; I108-L110 HydrophobicContact CG2-CD2 4.31Å; I108-L110 HydrophobicContact CG2-CG 3.99Å; I108-I126 HydrophobicContact CD1-CB 4.4Å; I108-I126 HydrophobicContact CD1-CG1 4.16Å; I108-I126 HydrophobicContact CD1-CG2 3.58Å; I108-I126 HydrophobicContact CG1-CD1 4.28Å; I108-I126 HydrophobicContact CG1-CG1 4.43Å; I108-I126 HydrophobicContact CG1-CG2 4.21Å; I108-I126 HydrophobicContact CG2-CD1 4.14Å; I108-I126 HydrophobicContact CG2-CG1 4.16Å; I108-V139 HydrophobicContact CD1-CB 3.54Å; I108-V139 HydrophobicContact CD1-CG1 3.71Å; I108-V139 HydrophobicContact CD1-CG2 4.04Å
109	R	89.5	Confident	84.3	Confident	19 Å²	19	61.6 Å²	61.6	7%	0.072	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	121	176.9	-61.9	-173.9	-166.4	85.8	-0.1	110.4	F72 S75 Y76 A79 L94 L95	F72-R109 PolarHBondContact O-NH2 3.33Å; S75-R109 PolarHBondContact O-NH1 3.46Å; S75-R109 PolarHBondContact OG-NH1 3.49Å; Y76-R109 VanDerWaalsContact CD2-CD 3.46Å; Y76-R109 VanDerWaalsContact N-CZ 3.31Å; A79-R109 HydrophobicContact CB-CB 4.1Å; L94-R109 HydrophobicContact CB-CB 4.16Å; L94-R109 HydrophobicContact CD1-CB 4.18Å; L95-R109 VanDerWaalsContact O-CA 3.28Å; L95-R109 WeakPolarHBondContact O-CA 3.25Å
110	L	88.2	Confident	84.2	Confident	3 Å²	3	65.6 Å²	65.6	2%	0.016	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.1	-179.1	-63.2	168.6	0	0	0	110.5	L94 L95 Y97 I108 E119 W122	L94-L110 WeakPolarHBondContact CA-O 3.45Å; L95-L110 PolarHBondContact N-O 3.37Å; L95-L110 PolarHBondContact O-N 2.89Å; L95-L110 VanDerWaalsContact O-N 3.08Å; Y97-L110 HydrophobicContact CD2-CB 4.12Å; Y97-L110 HydrophobicContact CD2-CD1 4.34Å; Y97-L110 HydrophobicContact CD2-CG 4.44Å; Y97-L110 HydrophobicContact CE2-CB 3.82Å; I108-L110 HydrophobicContact CG2-CD1 4.32Å; I108-L110 HydrophobicContact CG2-CD2 4.31Å; I108-L110 HydrophobicContact CG2-CG 3.99Å; L110-E119 HydrophobicContact CD1-CG 4.23Å; L110-W122 HydrophobicContact CD2-CB 4.02Å; L110-W122 HydrophobicContact CD2-CD2 4.35Å; L110-W122 HydrophobicContact CD2-CG 4.05Å
111	P	87.7	Confident	84.1	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.032	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	151	171.8	-17.7	31.1	0	0	0	111	L83 L87 P91 L94 R113 R141	L83-P111 HydrophobicContact CD1-CG 3.93Å; L83-P111 HydrophobicContact CD2-CG 3.89Å; L87-P111 HydrophobicContact CD1-CG 4.09Å; P91-P111 HydrophobicContact CB-CB 3.97Å; P91-P111 HydrophobicContact CB-CG 3.98Å; P91-P111 HydrophobicContact CG-CG 4.35Å; L94-P111 HydrophobicContact CD2-CB 4.44Å; L94-P111 HydrophobicContact CD2-CG 4Å; P111-R113 VanDerWaalsContact C-N 3.28Å; P111-R113 PolarHBondContact O-N 3.49Å; P111-R141 PolarHBondContact O-NH2 2.8Å
112	W	80.3	Confident	84.1	Confident	108 Å²	108	70.1 Å²	70.1	41%	0.409	33%	0.332	S	S	.	.	S	Bend	trans	-53.7	-46.7	174.2	-175.1	-62.8	0	0	0	111.8	L95 R141 P149 R150	L95-W112 HydrophobicContact CD1-CD2 4.18Å; L95-W112 HydrophobicContact CD1-CE3 3.52Å; L95-W112 HydrophobicContact CD1-CZ3 3.99Å; L95-W112 HydrophobicContact CG-CE3 4.38Å; W112-R141 PolarHBondContact O-NH1 2.92Å; W112-P149 HydrophobicContact CH2-CB 4.48Å; W112-R150 HydrophobicContact CZ2-CB 4.15Å
113	R	79.7	Confident	84.5	Confident	195 Å²	195	61.7 Å²	61.7	74%	0.736	30%	0.3	S	S	*	.	S	Bend	trans	-114.4	119.6	176.3	-62.5	-171.2	-178.7	-176.5	-0.8	109.6	P111	P111-R113 VanDerWaalsContact C-N 3.28Å; P111-R113 PolarHBondContact O-N 3.49Å
114	I	80.3	Confident	84.9	Confident	28 Å²	28	60.4 Å²	60.4	14%	0.144	28%	0.281	C	S	.	.			trans	-145.6	141.9	166.5	179.6	165.6	0	0	0	106.9	L87 R118 E119	L87-I114 HydrophobicContact CD2-CD1 4.38Å; I114-R118 HydrophobicContact CD1-CB 3.82Å; I114-R118 HydrophobicContact CG1-CB 3.66Å; I114-E119 HydrophobicContact CD1-CB 4.35Å; I114-E119 HydrophobicContact CG1-CB 4.22Å; I114-E119 HydrophobicContact CG2-CB 3.93Å; I114-E119 HydrophobicContact CG2-CG 4.06Å; I114-E119 WeakPolarHBondContact CG2-OE2 3.41Å
115	E	81.2	Confident	85	Confident	128 Å²	128	60 Å²	60	60%	0.598	27%	0.274	S	S	*	.			trans	-74.1	148.7	178.3	-65.6	170.2	178.3	0	0	110.3	P117 R118 E119	E115-P117 VanDerWaalsContact C-CD 3.49Å; E115-R118 PolarHBondContact O-N 3.12Å; E115-E119 PolarHBondContact O-N 2.85Å
116	E	81.8	Confident	85.1	Confident	78 Å²	78	58.3 Å²	58.3	36%	0.364	27%	0.265	S	S	.	.	H	α-helix	trans	-51.7	-46.8	-175.1	-160.6	-67.6	144.3	0	0	113.2	R118 E119 R120 R123 R140	E116-R118 PolarHBondContact O-N 3.15Å; E116-E119 PolarHBondContact O-N 3.11Å; E116-E119 VanDerWaalsContact O-N 3.16Å; E116-R120 WeakPolarHBondContact O-CB 3.26Å; E116-R120 PolarHBondContact O-N 2.65Å; E116-R123 IonicContact OE1-CZ 3.45Å; E116-R123 IonicContact OE1-NH1 2.75Å; E116-R123 IonicContact OE1-NH2 3.47Å; E116-R123 PolarHBondContact OE1-NH2 3.4Å; E116-R140 IonicContact OE1-CZ 3.46Å; E116-R140 IonicContact OE1-NH1 3.47Å; E116-R140 PolarHBondContact OE1-NH1 2.8Å; E116-R140 IonicContact OE1-NH2 3.6Å
117	P	82.3	Confident	85.2	Confident	85 Å²	85	56.4 Å²	56.4	55%	0.552	26%	0.258	S	S	*	.	H	α-helix	trans	-60.7	-34.3	-178.5	-25	35.7	0	0	0	113	E115 R120 I121	E115-P117 VanDerWaalsContact C-CD 3.49Å; P117-R120 WeakPolarHBondContact O-CB 3.28Å; P117-I121 PolarHBondContact O-N 2.9Å
118	R	83.3	Confident	85.4	Confident	97 Å²	97	59.7 Å²	59.7	37%	0.366	27%	0.267	S	S	.	.	H	α-helix	trans	-77.5	-42.6	177.7	-62.7	-174.6	-175.9	-173	2.6	111.2	I114 E115 E116 R120 I121 W122	I114-R118 HydrophobicContact CD1-CB 3.82Å; I114-R118 HydrophobicContact CG1-CB 3.66Å; E115-R118 PolarHBondContact O-N 3.12Å; E116-R118 PolarHBondContact O-N 3.15Å; R118-R120 PolarHBondContact O-N 3.26Å; R118-I121 PolarHBondContact O-N 2.92Å; R118-W122 VanDerWaalsContact O-CD1 3.31Å; R118-W122 PolarHBondContact O-N 3.45Å
119	E	85.8	Confident	85.3	Confident	16 Å²	16	66.5 Å²	66.5	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-62	-30.3	174.8	-163.8	175.7	126.8	0	0	111.4	L110 I114 E115 E116 W122 R123 R141	L110-E119 HydrophobicContact CD1-CG 4.23Å; I114-E119 HydrophobicContact CD1-CB 4.35Å; I114-E119 HydrophobicContact CG1-CB 4.22Å; I114-E119 HydrophobicContact CG2-CB 3.93Å; I114-E119 HydrophobicContact CG2-CG 4.06Å; I114-E119 WeakPolarHBondContact CG2-OE2 3.41Å; E115-E119 PolarHBondContact O-N 2.85Å; E116-E119 PolarHBondContact O-N 3.11Å; E116-E119 VanDerWaalsContact O-N 3.16Å; E119-W122 VanDerWaalsContact O-CB 3.28Å; E119-W122 WeakPolarHBondContact O-CB 3.18Å; E119-W122 PolarHBondContact O-N 3.27Å; E119-R123 WeakPolarHBondContact O-CG 3.36Å; E119-R123 PolarHBondContact O-N 3.48Å; E119-R123 IonicContact OE1-NH1 2.68Å; E119-R123 PolarHBondContact OE1-NH1 2.95Å; E119-R141 IonicContact OE1-NE 3.54Å; E119-R141 PolarHBondContact OE1-NE 3.38Å; E119-R141 IonicContact OE2-CZ 2.92Å; E119-R141 VanDerWaalsContact OE2-CZ 3.25Å; E119-R141 IonicContact OE2-NE 3.25Å; E119-R141 PolarHBondContact OE2-NE 2.87Å; E119-R141 IonicContact OE2-NH2 3.49Å; E119-R141 PolarHBondContact OE2-NH2 3.36Å
120	R	85.7	Confident	85.2	Confident	86 Å²	86	68.8 Å²	68.8	33%	0.325	31%	0.307	S	S	.	.	H	α-helix	trans	-61.8	-45.1	174.1	-166.8	179.1	179	-167.8	-2.2	113.4	E116 P117 R118 W122 R123 K124 N378 V380	E116-R120 WeakPolarHBondContact O-CB 3.26Å; E116-R120 PolarHBondContact O-N 2.65Å; P117-R120 WeakPolarHBondContact O-CB 3.28Å; R118-R120 PolarHBondContact O-N 3.26Å; R120-W122 PolarHBondContact O-N 2.81Å; R120-R123 VanDerWaalsContact CA-NH2 3.25Å; R120-R123 PolarHBondContact O-N 3.5Å; R120-K124 PolarHBondContact O-N 3.22Å; R120-N378 PolarHBondContact NH2-O 2.92Å; R120-N378 VanDerWaalsContact NH2-O 3.08Å; R120-V380 WeakPolarHBondContact CG-O 3.48Å; R120-V380 PolarHBondContact NE-O 3.34Å
121	I	84.3	Confident	85.3	Confident	95 Å²	95	73.8 Å²	73.8	49%	0.487	34%	0.342	S	S	.	.	H	α-helix	trans	-56.5	-43.2	175.1	-64.2	167.5	0	0	0	109.6	P117 R118 K124 I125	P117-I121 PolarHBondContact O-N 2.9Å; R118-I121 PolarHBondContact O-N 2.92Å; I121-K124 WeakPolarHBondContact O-CB 3.48Å; I121-K124 PolarHBondContact O-N 2.84Å; I121-I125 HydrophobicContact CG2-CD1 3.96Å; I121-I125 WeakPolarHBondContact O-CD1 3.46Å; I121-I125 WeakPolarHBondContact O-CG1 3.37Å; I121-I125 PolarHBondContact O-N 3.21Å; I121-I125 VanDerWaalsContact O-N 3.12Å
122	W	83.6	Confident	85.3	Confident	21 Å²	21	74.2 Å²	74.2	8%	0.08	34%	0.344	C	S	.	.	H	α-helix	trans	-61.3	-48.3	176.6	-83.7	101.4	0	0	0	113.9	F82 L83 L110 R118 E119 R120 K124 I125 I126	F82-W122 HydrophobicContact CB-CH2 3.86Å; F82-W122 HydrophobicContact CB-CZ2 4.46Å; F82-W122 AromaticContact CD1-CE2 4Å; F82-W122 AromaticContact CD1-CH2 2.88Å; F82-W122 HydrophobicContact CD1-CH2 2.88Å; F82-W122 AromaticContact CD1-CZ2 2.98Å; F82-W122 HydrophobicContact CD1-CZ2 2.98Å; F82-W122 AromaticContact CD1-CZ3 3.79Å; F82-W122 HydrophobicContact CD1-CZ3 3.79Å; F82-W122 HydrophobicContact CE1-CD2 4.45Å; F82-W122 AromaticContact CE1-CE2 3.88Å; F82-W122 HydrophobicContact CE1-CE3 4.39Å; F82-W122 AromaticContact CE1-CH2 3.36Å; F82-W122 HydrophobicContact CE1-CH2 3.36Å; F82-W122 AromaticContact CE1-CZ2 3.3Å; F82-W122 HydrophobicContact CE1-CZ2 3.3Å; F82-W122 AromaticContact CE1-CZ3 3.89Å; F82-W122 HydrophobicContact CE1-CZ3 3.89Å; F82-W122 AromaticContact CG-CH2 3.53Å; F82-W122 HydrophobicContact CG-CH2 3.53Å; F82-W122 HydrophobicContact CG-CZ2 4.03Å; F82-W122 HydrophobicContact CG-CZ3 4.33Å; F82-W122 HydrophobicContact CZ-CH2 4.41Å; L83-W122 HydrophobicContact CB-CZ2 4.04Å; L83-W122 HydrophobicContact CD1-CZ2 4.28Å; L83-W122 HydrophobicContact CD2-CD2 4.21Å; L83-W122 HydrophobicContact CD2-CH2 4.09Å; L83-W122 HydrophobicContact CD2-CZ2 3.12Å; L83-W122 HydrophobicContact CG-CH2 3.7Å; L83-W122 HydrophobicContact CG-CZ2 3.15Å; L110-W122 HydrophobicContact CD2-CB 4.02Å; L110-W122 HydrophobicContact CD2-CD2 4.35Å; L110-W122 HydrophobicContact CD2-CG 4.05Å; R118-W122 VanDerWaalsContact O-CD1 3.31Å; R118-W122 PolarHBondContact O-N 3.45Å; E119-W122 VanDerWaalsContact O-CB 3.28Å; E119-W122 WeakPolarHBondContact O-CB 3.18Å; E119-W122 PolarHBondContact O-N 3.27Å; R120-W122 PolarHBondContact O-N 2.81Å; W122-K124 PolarHBondContact O-N 2.85Å; W122-I125 PolarHBondContact O-N 3.05Å; W122-I126 VanDerWaalsContact O-CG1 3.32Å; W122-I126 WeakPolarHBondContact O-CG1 3.42Å; W122-I126 PolarHBondContact O-N 2.89Å
123	R	87.7	Confident	85.6	Confident	8 Å²	8	70.8 Å²	70.8	3%	0.03	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-38.5	178	-65.4	-172.5	-53.7	-94	-11	110.2	E116 E119 R120 I126 H127 V139 V380	E116-R123 IonicContact OE1-CZ 3.45Å; E116-R123 IonicContact OE1-NH1 2.75Å; E116-R123 IonicContact OE1-NH2 3.47Å; E116-R123 PolarHBondContact OE1-NH2 3.4Å; E119-R123 WeakPolarHBondContact O-CG 3.36Å; E119-R123 PolarHBondContact O-N 3.48Å; E119-R123 IonicContact OE1-NH1 2.68Å; E119-R123 PolarHBondContact OE1-NH1 2.95Å; R120-R123 VanDerWaalsContact CA-NH2 3.25Å; R120-R123 PolarHBondContact O-N 3.5Å; R123-I126 PolarHBondContact O-N 3.13Å; R123-H127 PolarHBondContact O-CD2 3.12Å; R123-H127 PolarHBondContact O-N 2.88Å; R123-V139 HydrophobicContact CB-CG2 4.07Å; R123-V139 HydrophobicContact CG-CG2 3.93Å; R123-V380 HydrophobicContact CB-CG1 3.4Å; R123-V380 VanDerWaalsContact CB-CG1 3.4Å; R123-V380 VanDerWaalsContact CZ-OXT 3.23Å; R123-V380 PolarHBondContact NE-OXT 3.17Å; R123-V380 PolarHBondContact NH2-OXT 3.4Å; R123-V380 WeakPolarHBondContact O-CG1 3.45Å
124	K	88.6	Confident	86	Confident	82 Å²	82	64.8 Å²	64.8	36%	0.357	32%	0.318	S	S	.	.	H	α-helix	trans	-58.6	-51	177.1	-76.2	-177.6	176.7	-170.8	0	111.8	R120 I121 W122 I126 H127 E128 M134 V380	R120-K124 PolarHBondContact O-N 3.22Å; I121-K124 WeakPolarHBondContact O-CB 3.48Å; I121-K124 PolarHBondContact O-N 2.84Å; W122-K124 PolarHBondContact O-N 2.85Å; K124-I126 VanDerWaalsContact C-N 3.26Å; K124-I126 PolarHBondContact O-N 3.45Å; K124-H127 PolarHBondContact O-N 2.85Å; K124-H127 VanDerWaalsContact O-N 3.12Å; K124-E128 WeakPolarHBondContact O-CG 3.49Å; K124-E128 PolarHBondContact O-N 3.34Å; K124-M134 HydrophobicContact CB-CE 4.4Å; K124-M134 HydrophobicContact CG-CE 4.19Å; K124-V380 VanDerWaalsContact CA-CG1 3.45Å; K124-V380 HydrophobicContact CB-CG1 4.29Å; K124-V380 HydrophobicContact CG-CB 3.78Å; K124-V380 HydrophobicContact CG-CG1 3.88Å
125	I	86.4	Confident	86	Confident	50 Å²	50	68 Å²	68	26%	0.256	34%	0.335	S	S	.	.	H	α-helix	trans	-59.2	-40.2	178	-65.8	156.7	0	0	0	111.2	F82 I121 W122 K129	F82-I125 HydrophobicContact CE1-CD1 3.92Å; F82-I125 HydrophobicContact CE2-CD1 4.48Å; F82-I125 HydrophobicContact CZ-CD1 3.46Å; F82-I125 VanDerWaalsContact CZ-CD1 3.46Å; I121-I125 HydrophobicContact CG2-CD1 3.96Å; I121-I125 WeakPolarHBondContact O-CD1 3.46Å; I121-I125 WeakPolarHBondContact O-CG1 3.37Å; I121-I125 PolarHBondContact O-N 3.21Å; I121-I125 VanDerWaalsContact O-N 3.12Å; W122-I125 PolarHBondContact O-N 3.05Å; I125-K129 WeakPolarHBondContact O-CB 3.4Å; I125-K129 PolarHBondContact O-N 2.78Å
126	I	86.3	Confident	85.9	Confident	18 Å²	18	64.7 Å²	64.7	9%	0.092	32%	0.324	C	S	.	.	H	α-helix	trans	-65.6	-44.8	177	-68.5	-62.8	0	0	0	111.1	I108 W122 R123 K124 K129 F130 V139	I108-I126 HydrophobicContact CD1-CB 4.4Å; I108-I126 HydrophobicContact CD1-CG1 4.16Å; I108-I126 HydrophobicContact CD1-CG2 3.58Å; I108-I126 HydrophobicContact CG1-CD1 4.28Å; I108-I126 HydrophobicContact CG1-CG1 4.43Å; I108-I126 HydrophobicContact CG1-CG2 4.21Å; I108-I126 HydrophobicContact CG2-CD1 4.14Å; I108-I126 HydrophobicContact CG2-CG1 4.16Å; W122-I126 VanDerWaalsContact O-CG1 3.32Å; W122-I126 WeakPolarHBondContact O-CG1 3.42Å; W122-I126 PolarHBondContact O-N 2.89Å; R123-I126 PolarHBondContact O-N 3.13Å; K124-I126 VanDerWaalsContact C-N 3.26Å; K124-I126 PolarHBondContact O-N 3.45Å; I126-K129 PolarHBondContact O-N 3.12Å; I126-F130 HydrophobicContact CD1-CE2 4.15Å; I126-F130 HydrophobicContact CG2-CD2 3.72Å; I126-F130 HydrophobicContact CG2-CE2 4.01Å; I126-F130 VanDerWaalsContact O-CD2 3.28Å; I126-F130 WeakPolarHBondContact O-CD2 3.44Å; I126-F130 PolarHBondContact O-N 3.36Å; I126-V139 HydrophobicContact CG2-CG1 4.26Å; I126-V139 HydrophobicContact CG2-CG2 4.17Å
127	H	90.6	Very high	85.8	Confident	1 Å²	1	61.2 Å²	61.2	1%	0.005	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-45.5	178	-84.9	-119.8	0	0	0	111.3	R123 K124 S131 L132 S133 M134 T136 V380	R123-H127 PolarHBondContact O-CD2 3.12Å; R123-H127 PolarHBondContact O-N 2.88Å; K124-H127 PolarHBondContact O-N 2.85Å; K124-H127 VanDerWaalsContact O-N 3.12Å; H127-S131 CarbonylContact O-C 3.46Å; H127-S131 WeakPolarHBondContact O-CA 3.33Å; H127-S131 PolarHBondContact O-N 3.23Å; H127-L132 HydrophobicContact CB-CB 4.23Å; H127-L132 PolarHBondContact O-N 3.21Å; H127-S133 PolarHBondContact CE1-O 2.73Å; H127-S133 PolarHBondContact ND1-O 3.03Å; H127-M134 HydrophobicContact CB-SD 3.54Å; H127-M134 VanDerWaalsContact CB-SD 3.54Å; H127-T136 PolarHBondContact CE1-O 3.05Å; H127-T136 VanDerWaalsContact CE1-O 3.26Å; H127-V380 HydrophobicContact CB-CG1 4.15Å; H127-V380 HydrophobicContact CB-CG2 4.17Å; H127-V380 VanDerWaalsContact CD2-CG1 3.49Å; H127-V380 WeakPolarHBondContact CD2-CG1 3.49Å
128	E	90.9	Very high	85.9	Confident	123 Å²	123	58.2 Å²	58.2	58%	0.575	29%	0.287	S	S	*	.	H	α-helix	trans	-61.4	-49.4	175.3	-71.5	166.8	-173.3	0	0	111.5	K124 F130 S131 M134	K124-E128 WeakPolarHBondContact O-CG 3.49Å; K124-E128 PolarHBondContact O-N 3.34Å; E128-F130 VanDerWaalsContact C-N 3.27Å; E128-F130 PolarHBondContact O-N 3.28Å; E128-S131 PolarHBondContact O-N 3.06Å; E128-M134 HydrophobicContact CG-CE 4.23Å; E128-M134 HydrophobicContact CG-SD 4.34Å
129	K	86.9	Confident	86.1	Confident	150 Å²	150	53.6 Å²	53.6	65%	0.652	27%	0.27	S	S	*	.	H	α-helix	trans	-59.5	-36.6	-177.9	179.4	176.7	-179.3	177.8	0	113.1	I125 I126	I125-K129 WeakPolarHBondContact O-CB 3.4Å; I125-K129 PolarHBondContact O-N 2.78Å; I126-K129 PolarHBondContact O-N 3.12Å
130	F	86.7	Confident	86.1	Confident	68 Å²	68	53.8 Å²	53.8	30%	0.298	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.2	10.6	-177.6	-63.7	-57.9	0	0	0	113.2	Y106 I126 E128 L132	Y106-F130 HydrophobicContact CD1-CB 4.18Å; Y106-F130 AromaticContact CD1-CD1 3.79Å; Y106-F130 HydrophobicContact CD1-CD1 3.79Å; Y106-F130 AromaticContact CD1-CD2 3.73Å; Y106-F130 HydrophobicContact CD1-CD2 3.73Å; Y106-F130 HydrophobicContact CD1-CE1 4.02Å; Y106-F130 AromaticContact CD1-CE2 3.96Å; Y106-F130 HydrophobicContact CD1-CE2 3.96Å; Y106-F130 AromaticContact CD1-CG 3.64Å; Y106-F130 HydrophobicContact CD1-CG 3.64Å; Y106-F130 HydrophobicContact CD1-CZ 4.1Å; Y106-F130 HydrophobicContact CE1-CB 3.7Å; Y106-F130 AromaticContact CE1-CD1 3.65Å; Y106-F130 HydrophobicContact CE1-CD1 3.65Å; Y106-F130 HydrophobicContact CE1-CD2 4.13Å; Y106-F130 HydrophobicContact CE1-CE1 4.26Å; Y106-F130 AromaticContact CE1-CG 3.57Å; Y106-F130 HydrophobicContact CE1-CG 3.57Å; I126-F130 HydrophobicContact CD1-CE2 4.15Å; I126-F130 HydrophobicContact CG2-CD2 3.72Å; I126-F130 HydrophobicContact CG2-CE2 4.01Å; I126-F130 VanDerWaalsContact O-CD2 3.28Å; I126-F130 WeakPolarHBondContact O-CD2 3.44Å; I126-F130 PolarHBondContact O-N 3.36Å; E128-F130 VanDerWaalsContact C-N 3.27Å; E128-F130 PolarHBondContact O-N 3.28Å; F130-L132 HydrophobicContact CB-CD1 4.29Å; F130-L132 HydrophobicContact CB-CD2 4.31Å; F130-L132 HydrophobicContact CB-CG 3.89Å; F130-L132 PolarHBondContact O-N 3.23Å
131	S	90.7	Very high	86.1	Confident	107 Å²	107	51.2 Å²	51.2	75%	0.748	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.7	39.9	-177.8	-54.7	0	0	0	0	113.2	H127 E128	H127-S131 CarbonylContact O-C 3.46Å; H127-S131 WeakPolarHBondContact O-CA 3.33Å; H127-S131 PolarHBondContact O-N 3.23Å; E128-S131 PolarHBondContact O-N 3.06Å
132	L	88.1	Confident	85.9	Confident	15 Å²	15	46.9 Å²	46.9	8%	0.079	24%	0.238	C	C	.	.			trans	-81.8	153	175.4	-54.7	179.8	0	0	0	110.2	V101 Y106 H127 F130 M134 L138 V139	V101-L132 HydrophobicContact CG1-CD2 4.06Å; Y106-L132 HydrophobicContact CE2-CD2 4.41Å; H127-L132 HydrophobicContact CB-CB 4.23Å; H127-L132 PolarHBondContact O-N 3.21Å; F130-L132 HydrophobicContact CB-CD1 4.29Å; F130-L132 HydrophobicContact CB-CD2 4.31Å; F130-L132 HydrophobicContact CB-CG 3.89Å; F130-L132 PolarHBondContact O-N 3.23Å; L132-M134 PolarHBondContact O-N 3.06Å; L132-L138 HydrophobicContact CB-CD1 3.99Å; L132-V139 HydrophobicContact CD1-CG1 4.2Å
133	S	87.3	Confident	85.9	Confident	35 Å²	35	46.8 Å²	46.8	25%	0.245	24%	0.239	C	C	.	.			trans	-58	129.5	176.7	170.3	0	0	0	0	110.7	H127 D135	H127-S133 PolarHBondContact CE1-O 2.73Å; H127-S133 PolarHBondContact ND1-O 3.03Å; S133-D135 PolarHBondContact O-N 3.03Å; S133-D135 PolarHBondContact OG-N 3.48Å
134	M	86.6	Confident	85.8	Confident	70 Å²	70	46.5 Å²	46.5	35%	0.345	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-14.1	175.2	-62.4	-66	-84.8	0	0	112.5	K124 H127 E128 L132 V380	K124-M134 HydrophobicContact CB-CE 4.4Å; K124-M134 HydrophobicContact CG-CE 4.19Å; H127-M134 HydrophobicContact CB-SD 3.54Å; H127-M134 VanDerWaalsContact CB-SD 3.54Å; E128-M134 HydrophobicContact CG-CE 4.23Å; E128-M134 HydrophobicContact CG-SD 4.34Å; L132-M134 PolarHBondContact O-N 3.06Å; M134-V380 HydrophobicContact CB-CG2 4.05Å; M134-V380 HydrophobicContact CE-CG2 4Å; M134-V380 HydrophobicContact CG-CG2 4.46Å; M134-V380 VanDerWaalsContact O-CG2 3.28Å; M134-V380 WeakPolarHBondContact O-CG2 3.45Å; M134-V380 HydrophobicContact SD-CG2 3.63Å
135	D	82.2	Confident	85.5	Confident	96 Å²	96	43 Å²	43	51%	0.513	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.9	-172.8	-48.6	-50.5	0	0	0	113.3	S133 S377	S133-D135 PolarHBondContact O-N 3.03Å; S133-D135 PolarHBondContact OG-N 3.48Å; D135-S377 CarbonylContact C-O 3.55Å; D135-S377 WeakPolarHBondContact CA-O 3.32Å; D135-S377 VanDerWaalsContact CB-O 3.26Å; D135-S377 WeakPolarHBondContact CB-O 3.36Å; D135-S377 CarbonylContact O-C 3.39Å; D135-S377 VanDerWaalsContact O-CA 3.31Å; D135-S377 WeakPolarHBondContact O-CA 3.4Å; D135-S377 VanDerWaalsContact O-O 3.14Å
136	T	77.2	Confident	85.2	Confident	58 Å²	58	44.2 Å²	44.2	36%	0.356	23%	0.228	S	C	.	.	S	Bend	trans	-121.7	123.6	-177.9	-55	0	0	0	0	109.4	H127 L138	H127-T136 PolarHBondContact CE1-O 3.05Å; H127-T136 VanDerWaalsContact CE1-O 3.26Å; T136-L138 HydrophobicContact CG2-CD2 3.92Å; T136-L138 HydrophobicContact CG2-CG 4.11Å; T136-L138 WeakPolarHBondContact O-CG 3.14Å; T136-L138 PolarHBondContact O-N 3.16Å
137	P	81.2	Confident	84.8	Confident	4 Å²	4	45 Å²	45	3%	0.026	23%	0.234	C	C	.	.			trans	-66	119.1	171.2	25.9	-31.7	0	0	0	109.5	R140 Q143 R375	P137-R140 HydrophobicContact CB-CG 3.87Å; P137-Q143 PolarHBondContact O-NE2 3.36Å; P137-Q143 PolarHBondContact O-OE1 3.06Å; P137-R375 HydrophobicContact CG-CB 4.37Å
138	L	83.5	Confident	84.3	Confident	22 Å²	22	45.1 Å²	45.1	12%	0.115	23%	0.234	C	C	.	.			trans	-121.7	-19.5	-176	-68.3	166.5	0	0	0	113.9	V101 L132 T136	V101-L138 HydrophobicContact CG1-CD1 4Å; V101-L138 HydrophobicContact CG1-CD2 4.07Å; V101-L138 HydrophobicContact CG1-CG 4.45Å; V101-L138 HydrophobicContact CG2-CB 4.1Å; V101-L138 HydrophobicContact CG2-CD2 4.46Å; L132-L138 HydrophobicContact CB-CD1 3.99Å; T136-L138 HydrophobicContact CG2-CD2 3.92Å; T136-L138 HydrophobicContact CG2-CG 4.11Å; T136-L138 WeakPolarHBondContact O-CG 3.14Å; T136-L138 PolarHBondContact O-N 3.16Å
139	V	87.1	Confident	83.7	Confident	1 Å²	1	43 Å²	43	1%	0.006	23%	0.231	C	C	.	.	S	Bend	trans	-130.3	30.7	-172.8	-59	0	0	0	0	112.9	Y99 I108 R123 I126 L132	Y99-V139 HydrophobicContact CD1-CB 4.3Å; Y99-V139 HydrophobicContact CD1-CG1 4.39Å; Y99-V139 HydrophobicContact CD2-CB 4.41Å; Y99-V139 HydrophobicContact CD2-CG1 4.33Å; Y99-V139 HydrophobicContact CE1-CB 4.22Å; Y99-V139 HydrophobicContact CE2-CB 4.34Å; Y99-V139 HydrophobicContact CG-CB 4.39Å; Y99-V139 HydrophobicContact CG-CG1 4.14Å; Y99-V139 PolarHBondContact OH-O 2.71Å; I108-V139 HydrophobicContact CD1-CB 3.54Å; I108-V139 HydrophobicContact CD1-CG1 3.71Å; I108-V139 HydrophobicContact CD1-CG2 4.04Å; R123-V139 HydrophobicContact CB-CG2 4.07Å; R123-V139 HydrophobicContact CG-CG2 3.93Å; I126-V139 HydrophobicContact CG2-CG1 4.26Å; I126-V139 HydrophobicContact CG2-CG2 4.17Å; L132-V139 HydrophobicContact CD1-CG1 4.2Å
140	R	85.7	Confident	83.3	Confident	19 Å²	19	40.4 Å²	40.4	7%	0.072	22%	0.217	C	C	.	.			trans	-71.5	144.3	171.3	-63.1	-81.4	178.4	168.4	-11	109.2	Y99 E116 P137 G142 Q143 G218 C379 V380	Y99-R140 WeakPolarHBondContact CE1-O 3.45Å; E116-R140 IonicContact OE1-CZ 3.46Å; E116-R140 IonicContact OE1-NH1 3.47Å; E116-R140 PolarHBondContact OE1-NH1 2.8Å; E116-R140 IonicContact OE1-NH2 3.6Å; P137-R140 HydrophobicContact CB-CG 3.87Å; R140-G142 VanDerWaalsContact C-N 3.27Å; R140-G142 PolarHBondContact O-N 2.97Å; R140-Q143 HydrophobicContact CB-CG 4.07Å; R140-Q143 WeakPolarHBondContact O-CA 3.42Å; R140-Q143 VanDerWaalsContact O-CB 3.26Å; R140-Q143 WeakPolarHBondContact O-CB 3.42Å; R140-Q143 PolarHBondContact O-N 2.69Å; R140-G218 PolarHBondContact NH1-O 3.07Å; R140-C379 PolarHBondContact NH2-O 3.22Å; R140-V380 PolarHBondContact NH2-OXT 3.19Å; R140-V380 VanDerWaalsContact NH2-OXT 3.1Å
141	R	86.1	Confident	83.3	Confident	33 Å²	33	37.4 Å²	37.4	13%	0.125	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-45.8	-44.8	-178.9	-72.4	-178.3	-172.7	-130.3	-5.6	115	Y97 P111 W112 E119 Q143 A144 V148 I151	Y97-R141 PolarHBondContact OH-NH1 3.48Å; P111-R141 PolarHBondContact O-NH2 2.8Å; W112-R141 PolarHBondContact O-NH1 2.92Å; E119-R141 IonicContact OE1-NE 3.54Å; E119-R141 PolarHBondContact OE1-NE 3.38Å; E119-R141 IonicContact OE2-CZ 2.92Å; E119-R141 VanDerWaalsContact OE2-CZ 3.25Å; E119-R141 IonicContact OE2-NE 3.25Å; E119-R141 PolarHBondContact OE2-NE 2.87Å; E119-R141 IonicContact OE2-NH2 3.49Å; E119-R141 PolarHBondContact OE2-NH2 3.36Å; R141-Q143 PolarHBondContact O-N 3.05Å; R141-A144 WeakPolarHBondContact O-CB 3.27Å; R141-A144 PolarHBondContact O-N 3.23Å; R141-A144 VanDerWaalsContact O-N 3.12Å; R141-V148 HydrophobicContact CB-CG2 4.06Å; R141-V148 WeakPolarHBondContact O-CG2 3.39Å; R141-I151 HydrophobicContact CB-CD1 3.92Å
142	G	80.8	Confident	83.2	Confident	3 Å²	3	34.2 Å²	34.2	3%	0.031	18%	0.181	C	C	.	.	G	3₁₀ helix	trans	-75	-6	-179.2	0	0	0	0	0	114.8	R140 R184 W216	R140-G142 VanDerWaalsContact C-N 3.27Å; R140-G142 PolarHBondContact O-N 2.97Å; G142-R184 PolarHBondContact O-NH1 3.05Å; G142-W216 CarbonylContact C-O 3.59Å; G142-W216 WeakPolarHBondContact CA-O 3.3Å
143	Q	83.3	Confident	83.2	Confident	20 Å²	20	38.3 Å²	38.3	9%	0.093	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-91.6	-7	169.6	-57.3	176.4	-50.1	0	0	112.7	Y99 P137 R140 R141	Y99-Q143 HydrophobicContact CD1-CB 4.42Å; Y99-Q143 HydrophobicContact CE1-CB 4.34Å; P137-Q143 PolarHBondContact O-NE2 3.36Å; P137-Q143 PolarHBondContact O-OE1 3.06Å; R140-Q143 HydrophobicContact CB-CG 4.07Å; R140-Q143 WeakPolarHBondContact O-CA 3.42Å; R140-Q143 VanDerWaalsContact O-CB 3.26Å; R140-Q143 WeakPolarHBondContact O-CB 3.42Å; R140-Q143 PolarHBondContact O-N 2.69Å; R141-Q143 PolarHBondContact O-N 3.05Å
144	A	86.6	Confident	83.5	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.008	21%	0.207	C	C	.	.	S	Bend	trans	-57.8	145.5	175.3	0	0	0	0	0	110.4	Y97 H98 Y99 R141 H146 V148 R184	Y97-A144 HydrophobicContact CD1-CB 4.33Å; H98-A144 CarbonylContact O-C 3.58Å; H98-A144 VanDerWaalsContact O-CA 3.25Å; H98-A144 WeakPolarHBondContact O-CA 3.46Å; Y99-A144 HydrophobicContact CD1-CB 4.42Å; Y99-A144 VanDerWaalsContact CE1-CA 3.47Å; Y99-A144 HydrophobicContact CE1-CB 3.82Å; R141-A144 WeakPolarHBondContact O-CB 3.27Å; R141-A144 PolarHBondContact O-N 3.23Å; R141-A144 VanDerWaalsContact O-N 3.12Å; A144-H146 VanDerWaalsContact C-N 3.3Å; A144-H146 PolarHBondContact O-N 3.13Å; A144-V148 HydrophobicContact CB-CG2 4.48Å; A144-R184 PolarHBondContact O-NH1 2.62Å; A144-R184 PolarHBondContact O-NH2 3.47Å
145	L	82.3	Confident	83.9	Confident	9 Å²	9	36.5 Å²	36.5	5%	0.047	19%	0.19	C	C	.	.	S	Bend	trans	-54.4	-47.1	-177.8	-169.6	70.3	0	0	0	111.2	F5 L8 I52 H98 V100 M105 R184	F5-L145 HydrophobicContact CB-CD1 4.46Å; F5-L145 HydrophobicContact CD2-CB 4.47Å; F5-L145 HydrophobicContact CD2-CD1 3.41Å; F5-L145 VanDerWaalsContact CD2-CD1 3.41Å; F5-L145 HydrophobicContact CD2-CD2 4.25Å; F5-L145 HydrophobicContact CD2-CG 3.38Å; F5-L145 WeakPolarHBondContact CD2-O 3.23Å; F5-L145 HydrophobicContact CE2-CD1 4.09Å; F5-L145 HydrophobicContact CE2-CD2 4.08Å; F5-L145 HydrophobicContact CE2-CG 3.61Å; F5-L145 HydrophobicContact CG-CD1 4.39Å; F5-L145 VanDerWaalsContact CG-O 3.32Å; F5-L145 WeakPolarHBondContact CG-O 3.36Å; L8-L145 HydrophobicContact CB-CD1 4.48Å; L8-L145 HydrophobicContact CD1-CD1 3.73Å; I52-L145 HydrophobicContact CD1-CD2 4.27Å; H98-L145 HydrophobicContact CB-CB 4.2Å; H98-L145 WeakPolarHBondContact O-CB 3.47Å; H98-L145 PolarHBondContact O-N 2.91Å; V100-L145 HydrophobicContact CG2-CD1 4.01Å; M105-L145 HydrophobicContact CE-CD2 4.32Å; L145-R184 PolarHBondContact O-NH2 3.32Å
146	H	80.3	Confident	84.3	Confident	76 Å²	76	31.9 Å²	31.9	35%	0.352	17%	0.166	S	C	.	.	S	Bend	trans	-94.2	133	171.1	-65.6	-75.4	0	0	0	110.7	F5 A144 V148	F5-H146 AromaticContact CE2-CE1 3.67Å; F5-H146 AromaticContact CZ-CE1 3.41Å; F5-H146 VanDerWaalsContact CZ-CE1 3.41Å; F5-H146 WeakPolarHBondContact CZ-CE1 3.48Å; F5-H146 AromaticContact CZ-ND1 3.68Å; A144-H146 VanDerWaalsContact C-N 3.3Å; A144-H146 PolarHBondContact O-N 3.13Å; H146-V148 PolarHBondContact O-N 3.06Å
147	P	75.9	Confident	85	Confident	33 Å²	33	32.5 Å²	32.5	21%	0.214	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-52.4	126.3	170.8	-30.2	38.6	0	0	0	111.8	V152 P157 W216	P147-V152 HydrophobicContact CB-CG2 3.22Å; P147-V152 HydrophobicContact CG-CG2 4.49Å; P147-P157 HydrophobicContact CG-CG 4.38Å; P147-W216 HydrophobicContact CB-CH2 3.96Å; P147-W216 HydrophobicContact CB-CZ3 4.31Å
148	V	80	Confident	85.5	Confident	4 Å²	4	35 Å²	35	2%	0.024	19%	0.188	C	C	.	.	P	Polyproline II helix	trans	-65.5	127.9	-179.9	177.7	0	0	0	0	109.4	Y97 R141 A144 H146 R150 I151 V152	Y97-V148 HydrophobicContact CD1-CG2 3.69Å; Y97-V148 HydrophobicContact CE1-CB 4.14Å; Y97-V148 HydrophobicContact CE1-CG1 3.73Å; Y97-V148 HydrophobicContact CE1-CG2 3.42Å; Y97-V148 VanDerWaalsContact CE1-CG2 3.42Å; R141-V148 HydrophobicContact CB-CG2 4.06Å; R141-V148 WeakPolarHBondContact O-CG2 3.39Å; A144-V148 HydrophobicContact CB-CG2 4.48Å; H146-V148 PolarHBondContact O-N 3.06Å; V148-R150 VanDerWaalsContact C-N 3.25Å; V148-R150 PolarHBondContact O-N 2.85Å; V148-I151 HydrophobicContact CB-CB 4.22Å; V148-I151 HydrophobicContact CB-CD1 3.96Å; V148-I151 HydrophobicContact CB-CG1 3.99Å; V148-I151 HydrophobicContact CG1-CG1 4.35Å; V148-I151 HydrophobicContact CG2-CD1 4.19Å; V148-I151 WeakPolarHBondContact O-CA 3.14Å; V148-I151 WeakPolarHBondContact O-CB 3.36Å; V148-I151 PolarHBondContact O-N 2.98Å; V148-V152 WeakPolarHBondContact O-CG2 3.48Å; V148-V152 PolarHBondContact O-N 3.43Å
149	P	78.8	Confident	85.8	Confident	78 Å²	78	38.9 Å²	38.9	51%	0.506	22%	0.217	S	C	.	.	H	α-helix	trans	-50	-41.9	-173.6	-32	35.4	0	0	0	114.4	W112 I151 V152 T153	W112-P149 HydrophobicContact CH2-CB 4.48Å; P149-I151 PolarHBondContact O-N 3.18Å; P149-V152 WeakPolarHBondContact O-CB 3.38Å; P149-V152 PolarHBondContact O-N 3.3Å; P149-T153 PolarHBondContact O-N 3.36Å
150	R	79.3	Confident	85.9	Confident	96 Å²	96	43.4 Å²	43.4	36%	0.362	24%	0.238	S	C	.	.	H	α-helix	trans	-66.2	-32.8	176.4	-174.3	-178.5	176.7	-162.2	-6.9	113.7	W112 V148 T153 W154	W112-R150 HydrophobicContact CZ2-CB 4.15Å; V148-R150 VanDerWaalsContact C-N 3.25Å; V148-R150 PolarHBondContact O-N 2.85Å; R150-T153 PolarHBondContact O-OG1 3.18Å; R150-W154 HydrophobicContact CG-CH2 3.75Å; R150-W154 HydrophobicContact CG-CZ3 3.8Å; R150-W154 VanDerWaalsContact O-CZ3 3.25Å; R150-W154 WeakPolarHBondContact O-CZ3 3.13Å
151	I	86.6	Confident	86.4	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	24%	0.24	C	C	.	.	H	α-helix	trans	-76	-37.4	176.8	-60.5	-179.4	0	0	0	109.3	R141 V148 P149 T153 W154 L155 W216 P222	R141-I151 HydrophobicContact CB-CD1 3.92Å; V148-I151 HydrophobicContact CB-CB 4.22Å; V148-I151 HydrophobicContact CB-CD1 3.96Å; V148-I151 HydrophobicContact CB-CG1 3.99Å; V148-I151 HydrophobicContact CG1-CG1 4.35Å; V148-I151 HydrophobicContact CG2-CD1 4.19Å; V148-I151 WeakPolarHBondContact O-CA 3.14Å; V148-I151 WeakPolarHBondContact O-CB 3.36Å; V148-I151 PolarHBondContact O-N 2.98Å; P149-I151 PolarHBondContact O-N 3.18Å; I151-T153 PolarHBondContact O-N 2.89Å; I151-W154 PolarHBondContact O-N 3.15Å; I151-W154 VanDerWaalsContact O-N 3.07Å; I151-L155 HydrophobicContact CG2-CB 4.21Å; I151-L155 HydrophobicContact CG2-CD1 3.48Å; I151-L155 VanDerWaalsContact CG2-CD1 3.48Å; I151-L155 HydrophobicContact CG2-CG 3.96Å; I151-L155 PolarHBondContact O-N 2.93Å; I151-W216 HydrophobicContact CB-CH2 4.49Å; I151-W216 HydrophobicContact CB-CZ3 4.34Å; I151-W216 HydrophobicContact CG2-CD2 4.35Å; I151-W216 HydrophobicContact CG2-CE3 3.91Å; I151-W216 HydrophobicContact CG2-CH2 3.69Å; I151-W216 HydrophobicContact CG2-CZ2 4.19Å; I151-W216 HydrophobicContact CG2-CZ3 3.56Å; I151-P222 HydrophobicContact CD1-CB 4.46Å; I151-P222 HydrophobicContact CD1-CG 4Å; I151-P222 HydrophobicContact CG1-CB 4.08Å; I151-P222 HydrophobicContact CG1-CG 4.16Å
152	V	87.6	Confident	86.8	Confident	40 Å²	40	43.1 Å²	43.1	24%	0.242	24%	0.24	C	C	.	.	H	α-helix	trans	-58.2	-35.5	177.9	174.4	0	0	0	0	112.4	P147 V148 P149 W154 L155 G156 P157	P147-V152 HydrophobicContact CB-CG2 3.22Å; P147-V152 HydrophobicContact CG-CG2 4.49Å; V148-V152 WeakPolarHBondContact O-CG2 3.48Å; V148-V152 PolarHBondContact O-N 3.43Å; P149-V152 WeakPolarHBondContact O-CB 3.38Å; P149-V152 PolarHBondContact O-N 3.3Å; V152-W154 PolarHBondContact O-N 3.33Å; V152-W154 VanDerWaalsContact O-N 3.09Å; V152-L155 PolarHBondContact O-N 3.12Å; V152-G156 WeakPolarHBondContact CA-O 3.41Å; V152-G156 WeakPolarHBondContact O-CA 3.32Å; V152-G156 PolarHBondContact O-N 3.02Å; V152-P157 WeakPolarHBondContact CG1-O 3.38Å
153	T	90	Very high	87.5	Confident	101 Å²	101	44 Å²	44	62%	0.62	25%	0.245	S	C	*	.	H	α-helix	trans	-59.5	-23.6	178.2	56.2	0	0	0	0	113.6	P149 R150 I151	P149-T153 PolarHBondContact O-N 3.36Å; R150-T153 PolarHBondContact O-OG1 3.18Å; I151-T153 PolarHBondContact O-N 2.89Å
154	W	92.4	Very high	88	Confident	66 Å²	66	43.1 Å²	43.1	25%	0.25	24%	0.241	C	C	.	.	H	α-helix	trans	-109.8	-32.6	179.4	-55.2	-55.4	0	0	0	113.3	R150 I151 V152 P222 G223	R150-W154 HydrophobicContact CG-CH2 3.75Å; R150-W154 HydrophobicContact CG-CZ3 3.8Å; R150-W154 VanDerWaalsContact O-CZ3 3.25Å; R150-W154 WeakPolarHBondContact O-CZ3 3.13Å; I151-W154 PolarHBondContact O-N 3.15Å; I151-W154 VanDerWaalsContact O-N 3.07Å; V152-W154 PolarHBondContact O-N 3.33Å; V152-W154 VanDerWaalsContact O-N 3.09Å; W154-P222 HydrophobicContact CE3-CB 4.41Å; W154-P222 HydrophobicContact CZ3-CB 4.34Å; W154-P222 WeakPolarHBondContact CZ3-O 2.86Å; W154-G223 VanDerWaalsContact CB-O 3.27Å; W154-G223 WeakPolarHBondContact CB-O 3.36Å
155	L	94.2	Very high	88.5	Confident	0 Å²	0	43 Å²	43	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-113.6	-6	-168.2	-54.6	-171.1	0	0	0	113.7	I151 V152 V163 T186 M215 W216 I225	I151-L155 HydrophobicContact CG2-CB 4.21Å; I151-L155 HydrophobicContact CG2-CD1 3.48Å; I151-L155 VanDerWaalsContact CG2-CD1 3.48Å; I151-L155 HydrophobicContact CG2-CG 3.96Å; I151-L155 PolarHBondContact O-N 2.93Å; V152-L155 PolarHBondContact O-N 3.12Å; L155-V163 WeakPolarHBondContact O-CG2 3.46Å; L155-T186 WeakPolarHBondContact O-CB 3.47Å; L155-T186 WeakPolarHBondContact O-CG2 3.36Å; L155-T186 PolarHBondContact O-OG1 2.86Å; L155-M215 HydrophobicContact CD1-CB 3.61Å; L155-M215 HydrophobicContact CD1-SD 4.37Å; L155-M215 HydrophobicContact CD2-SD 3.84Å; L155-W216 HydrophobicContact CB-CH2 4.3Å; L155-W216 HydrophobicContact CB-CZ2 3.41Å; L155-W216 VanDerWaalsContact CB-CZ2 3.41Å; L155-W216 HydrophobicContact CD1-CD2 3.93Å; L155-W216 HydrophobicContact CD1-CG 4Å; L155-W216 HydrophobicContact CD1-CZ2 4.23Å; L155-W216 HydrophobicContact CG-CZ2 4.45Å; L155-I225 HydrophobicContact CD2-CD1 3.67Å; L155-I225 HydrophobicContact CD2-CG1 3.6Å
156	G	91.8	Very high	89.1	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.242	C	C	.	.			trans	75	-170.9	-172.1	0	0	0	0	0	113.7	V152 W216	V152-G156 WeakPolarHBondContact CA-O 3.41Å; V152-G156 WeakPolarHBondContact O-CA 3.32Å; V152-G156 PolarHBondContact O-N 3.02Å; G156-W216 WeakPolarHBondContact O-CH2 3.47Å; G156-W216 VanDerWaalsContact O-CZ2 3.23Å; G156-W216 WeakPolarHBondContact O-CZ2 3.38Å
157	P	91.4	Very high	89.7	Confident	70 Å²	70	42 Å²	42	46%	0.455	24%	0.236	S	C	.	.			cis	-66.9	142.2	4.3	29.2	-35.4	0	0	0	112.4	P147 V152 L161 V163	P147-P157 HydrophobicContact CG-CG 4.38Å; V152-P157 WeakPolarHBondContact CG1-O 3.38Å; P157-L161 WeakPolarHBondContact CA-O 3.45Å; P157-V163 HydrophobicContact CB-CG2 4.32Å
158	S	90.9	Very high	90.5	Very high	57 Å²	57	43.7 Å²	43.7	40%	0.399	25%	0.245	S	C	.	.	S	Bend	trans	-140.6	-177.4	172.7	71.4	0	0	0	0	110.1	E160 L161	S158-E160 PolarHBondContact O-N 2.88Å; S158-E160 PolarHBondContact OG-N 2.94Å; S158-L161 PolarHBondContact N-O 3.18Å; S158-L161 PolarHBondContact OG-N 3.29Å
159	S	89.9	Confident	91.2	Very high	103 Å²	103	44.1 Å²	44.1	72%	0.72	25%	0.247	S	C	*	.	S	Bend	trans	-59.8	-23.2	170.5	49.3	0	0	0	0	112.9
160	E	90.7	Very high	91.8	Very high	97 Å²	97	49.5 Å²	49.5	45%	0.453	26%	0.263	S	S	.	.	S	Bend	trans	-103.1	-43.6	-178.1	-65.4	-179.4	-171.7	0	0	112.9	S158 F341	S158-E160 PolarHBondContact O-N 2.88Å; S158-E160 PolarHBondContact OG-N 2.94Å; E160-F341 HydrophobicContact CB-CB 4.27Å; E160-F341 HydrophobicContact CG-CB 4.34Å; E160-F341 HydrophobicContact CG-CD2 4.02Å; E160-F341 HydrophobicContact CG-CG 4.45Å
161	L	94.6	Very high	92.2	Very high	21 Å²	21	50.1 Å²	50.1	11%	0.11	27%	0.27	C	S	.	.			trans	-100.5	113.6	-169.9	-63.9	178.5	0	0	0	111.2	P157 S158 T186 K188	P157-L161 WeakPolarHBondContact CA-O 3.45Å; S158-L161 PolarHBondContact N-O 3.18Å; S158-L161 PolarHBondContact OG-N 3.29Å; L161-T186 HydrophobicContact CB-CG2 3.97Å; L161-T186 HydrophobicContact CD1-CG2 4.29Å; L161-T186 HydrophobicContact CD2-CG2 4.11Å; L161-T186 HydrophobicContact CG-CG2 4.35Å; L161-K188 HydrophobicContact CD2-CD 3.95Å
162	L	95.7	Very high	92.2	Very high	24 Å²	24	50.7 Å²	50.7	13%	0.126	27%	0.274	C	S	.	.			trans	-83.9	136.9	170.9	-67.2	175.4	0	0	0	111	Y187 I344 I347	L162-Y187 PolarHBondContact O-N 3.44Å; L162-I344 HydrophobicContact CD1-CB 4.19Å; L162-I344 HydrophobicContact CD1-CD1 4.01Å; L162-I344 HydrophobicContact CD2-CB 4.36Å; L162-I347 HydrophobicContact CD1-CD1 3.34Å
163	V	94.7	Very high	92.1	Very high	22 Å²	22	52.2 Å²	52.2	13%	0.133	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-108.6	129.9	172.8	177.4	0	0	0	0	108.5	L155 P157 R184 Y185 W216	L155-V163 WeakPolarHBondContact O-CG2 3.46Å; P157-V163 HydrophobicContact CB-CG2 4.32Å; V163-R184 HydrophobicContact CG1-CB 4.11Å; V163-R184 HydrophobicContact CG1-CG 4.22Å; V163-Y185 WeakPolarHBondContact CA-O 3.24Å; V163-Y185 WeakPolarHBondContact CG1-O 3.47Å; V163-W216 HydrophobicContact CG1-CZ2 4.44Å; V163-W216 HydrophobicContact CG2-CZ2 4.01Å
164	C	95	Very high	91.4	Very high	1 Å²	1	55 Å²	55	1%	0.007	30%	0.296	C	S	.	.			trans	47.6	56.2	179.2	-61.7	0	0	0	0	114.9	R6 H166 E167 R184 Y185	R6-C164 PolarHBondContact NH1-O 2.91Å; C164-H166 PolarHBondContact O-N 3.4Å; C164-H166 VanDerWaalsContact O-N 3.07Å; C164-E167 HydrophobicContact CB-CG 3.86Å; C164-E167 VanDerWaalsContact CB-OE1 3.25Å; C164-E167 WeakPolarHBondContact CB-OE1 3.42Å; C164-E167 WeakPolarHBondContact O-CB 3.3Å; C164-E167 PolarHBondContact O-N 3.33Å; C164-E167 VanDerWaalsContact O-N 3.09Å; C164-R184 VanDerWaalsContact SG-CA 3.53Å; C164-Y185 PolarHBondContact N-O 2.92Å
165	P	96	Very high	90.8	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-57.5	-26.7	178.1	25.5	-35.3	0	0	0	112.9	E167 V168 Y185 Y187 L333 I344 I347 C353	P165-E167 PolarHBondContact O-N 2.68Å; P165-E167 VanDerWaalsContact O-N 3.12Å; P165-V168 VanDerWaalsContact O-CG2 3.31Å; P165-V168 WeakPolarHBondContact O-CG2 3.32Å; P165-V168 PolarHBondContact O-N 3.39Å; P165-Y185 HydrophobicContact CG-CE2 4.44Å; P165-Y187 HydrophobicContact CG-CD1 4.17Å; P165-Y187 HydrophobicContact CG-CG 4.21Å; P165-L333 HydrophobicContact CG-CD1 3.62Å; P165-I344 HydrophobicContact CB-CD1 3.47Å; P165-I344 VanDerWaalsContact CB-CD1 3.47Å; P165-I347 HydrophobicContact CB-CG2 4.47Å; P165-C353 HydrophobicContact CB-CB 4.31Å; P165-C353 HydrophobicContact CG-CB 4.36Å
166	H	95.7	Very high	90.3	Very high	15 Å²	15	54.6 Å²	54.6	7%	0.069	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-59.3	-21.4	176.9	78.2	-72.6	0	0	0	115.4	C164 V168 V169 Y185 I311 L331	C164-H166 PolarHBondContact O-N 3.4Å; C164-H166 VanDerWaalsContact O-N 3.07Å; H166-V168 PolarHBondContact O-N 3.4Å; H166-V169 WeakPolarHBondContact O-CB 3.33Å; H166-V169 PolarHBondContact O-N 3.07Å; H166-V169 VanDerWaalsContact O-N 3.13Å; H166-Y185 WeakPolarHBondContact CB-OH 3.36Å; H166-Y185 AromaticContact CE1-CE1 3.58Å; H166-Y185 AromaticContact ND1-CE1 3.39Å; H166-Y185 WeakPolarHBondContact ND1-CE1 3.45Å; H166-Y185 AromaticContact ND1-CZ 3.44Å; H166-Y185 PolarHBondContact ND1-OH 2.82Å; H166-I311 HydrophobicContact CB-CD1 3.58Å; H166-L331 HydrophobicContact CB-CD2 4.06Å
167	E	92.8	Very high	90.3	Very high	49 Å²	49	60.4 Å²	60.4	23%	0.229	33%	0.331	C	S	.	.	G	3₁₀ helix	trans	-66.9	-21.3	-178.7	-71.2	175.9	-171.8	0	0	113.1	S4 R6 C164 P165	S4-E167 WeakPolarHBondContact CB-OE1 3.17Å; R6-E167 HydrophobicContact CB-CB 4.43Å; R6-E167 VanDerWaalsContact CB-OE2 3.23Å; R6-E167 WeakPolarHBondContact CB-OE2 3.44Å; R6-E167 VanDerWaalsContact CD-OE2 3.31Å; R6-E167 WeakPolarHBondContact CD-OE2 3.44Å; R6-E167 VanDerWaalsContact CG-OE2 3.24Å; R6-E167 WeakPolarHBondContact CG-OE2 3.28Å; C164-E167 HydrophobicContact CB-CG 3.86Å; C164-E167 VanDerWaalsContact CB-OE1 3.25Å; C164-E167 WeakPolarHBondContact CB-OE1 3.42Å; C164-E167 WeakPolarHBondContact O-CB 3.3Å; C164-E167 PolarHBondContact O-N 3.33Å; C164-E167 VanDerWaalsContact O-N 3.09Å; P165-E167 PolarHBondContact O-N 2.68Å; P165-E167 VanDerWaalsContact O-N 3.12Å
168	V	92.9	Very high	90.5	Very high	67 Å²	67	59.1 Å²	59.1	41%	0.406	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-107.7	8.4	175.8	-63	0	0	0	0	112.5	P165 H166 I344 T348	P165-V168 VanDerWaalsContact O-CG2 3.31Å; P165-V168 WeakPolarHBondContact O-CG2 3.32Å; P165-V168 PolarHBondContact O-N 3.39Å; H166-V168 PolarHBondContact O-N 3.4Å; V168-I344 HydrophobicContact CG2-CD1 3.67Å; V168-I344 HydrophobicContact CG2-CG1 3.49Å; V168-I344 VanDerWaalsContact CG2-CG1 3.49Å; V168-T348 HydrophobicContact CG2-CG2 3.99Å
169	V	94.6	Very high	90.7	Very high	13 Å²	13	59.7 Å²	59.7	8%	0.079	32%	0.316	C	S	.	.	S	Bend	trans	-73.1	133.1	172.9	169.8	0	0	0	0	108.9	H166 Q171 L331 T348 C353	H166-V169 WeakPolarHBondContact O-CB 3.33Å; H166-V169 PolarHBondContact O-N 3.07Å; H166-V169 VanDerWaalsContact O-N 3.13Å; V169-Q171 PolarHBondContact O-N 3.09Å; V169-L331 HydrophobicContact CG1-CD1 4.18Å; V169-T348 HydrophobicContact CG2-CG2 3.6Å; V169-C353 HydrophobicContact CG2-CB 4.25Å; V169-C353 VanDerWaalsContact CG2-O 3.24Å; V169-C353 WeakPolarHBondContact CG2-O 3.4Å
170	K	91.7	Very high	90.9	Very high	191 Å²	191	57.3 Å²	57.3	83%	0.83	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-57.3	126.3	172.7	-172.5	177.3	179.5	179.4	0	109.4
171	Q	87.8	Confident	91.1	Very high	109 Å²	109	53 Å²	53	51%	0.509	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-62.8	148.4	179.1	-65.6	-56.8	-44.1	0	0	110.7	V169	V169-Q171 PolarHBondContact O-N 3.09Å
172	P	85.9	Confident	90.8	Very high	19 Å²	19	53.7 Å²	53.7	12%	0.123	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-69.5	166.7	176.5	32	-25.4	0	0	0	108.9	N174 W355	P172-N174 PolarHBondContact O-N 2.78Å; P172-W355 HydrophobicContact CB-CB 4.48Å; P172-W355 HydrophobicContact CB-CD2 4.24Å; P172-W355 HydrophobicContact CB-CG 4.05Å; P172-W355 HydrophobicContact CG-CD2 3.85Å; P172-W355 HydrophobicContact CG-CE3 4.38Å; P172-W355 HydrophobicContact CG-CG 4.1Å; P172-W355 HydrophobicContact CG-CZ2 4.17Å
173	P	84.5	Confident	90.5	Very high	71 Å²	71	53.8 Å²	53.8	46%	0.461	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-49.6	142.9	171.4	-25.2	34.3	0	0	0	111.1	V175 Q314	P173-V175 HydrophobicContact CB-CG1 4.08Å; P173-V175 HydrophobicContact CB-CG2 4.16Å; P173-V175 PolarHBondContact O-N 3.28Å; P173-Q314 PolarHBondContact O-NE2 3.16Å
174	N	76.8	Confident	90.3	Very high	161 Å²	161	53.9 Å²	53.9	86%	0.861	28%	0.284	S	S	*	.	S	Bend	trans	-78.4	59.3	-178	-168.7	24.3	0	0	0	111.9	P172	P172-N174 PolarHBondContact O-N 2.78Å
175	V	79	Confident	90.3	Very high	41 Å²	41	53.9 Å²	53.9	25%	0.248	28%	0.284	C	S	.	.	S	Bend	trans	-108.1	13.9	-174.6	-65.9	0	0	0	0	112.4	P173 G317 S325	P173-V175 HydrophobicContact CB-CG1 4.08Å; P173-V175 HydrophobicContact CB-CG2 4.16Å; P173-V175 PolarHBondContact O-N 3.28Å; V175-G317 WeakPolarHBondContact O-CA 3.41Å; V175-G317 PolarHBondContact O-N 3.46Å; V175-S325 WeakPolarHBondContact CB-O 3.25Å; V175-S325 WeakPolarHBondContact CG2-O 3.38Å
176	G	84.8	Confident	90.4	Very high	15 Å²	15	53.9 Å²	53.9	16%	0.155	28%	0.284	C	S	.	.	S	Bend	trans	167.6	168.3	176.1	0	0	0	0	0	114.2	T178 Q314 L315	G176-T178 PolarHBondContact O-N 2.84Å; G176-Q314 PolarHBondContact O-NE2 2.93Å; G176-L315 VanDerWaalsContact CA-O 3.3Å; G176-L315 WeakPolarHBondContact CA-O 3.28Å
177	Q	91.3	Very high	90.5	Very high	123 Å²	123	53.2 Å²	53.2	58%	0.575	28%	0.281	S	S	*	.			trans	-68.8	132.4	-173.4	-168	64.1	33.1	0	0	110.7	Y179 Q314 L315	Q177-Y179 HydrophobicContact CB-CE2 3.86Å; Q177-Y179 HydrophobicContact CG-CD2 4.35Å; Q177-Y179 HydrophobicContact CG-CE1 4.17Å; Q177-Y179 HydrophobicContact CG-CE2 3.53Å; Q177-Y179 VanDerWaalsContact CG-CZ 3.44Å; Q177-Y179 WeakPolarHBondContact CG-OH 3.32Å; Q177-Q314 WeakPolarHBondContact O-CA 3.48Å; Q177-L315 PolarHBondContact O-N 3.47Å
178	T	94.2	Very high	90.7	Very high	43 Å²	43	51 Å²	51	26%	0.264	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	132.8	-177.8	-61.4	0	0	0	0	110.6	G176 I180 W355	G176-T178 PolarHBondContact O-N 2.84Å; T178-I180 HydrophobicContact CG2-CG2 3.84Å; T178-W355 HydrophobicContact CG2-CH2 3.54Å; T178-W355 HydrophobicContact CG2-CZ2 3.74Å
179	Y	95.6	Very high	91	Very high	68 Å²	68	48 Å²	48	27%	0.267	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	117	177.8	-56	-91.8	0	0	0	108.1	Q177 A289 T293 G312 V313 L315	Q177-Y179 HydrophobicContact CB-CE2 3.86Å; Q177-Y179 HydrophobicContact CG-CD2 4.35Å; Q177-Y179 HydrophobicContact CG-CE1 4.17Å; Q177-Y179 HydrophobicContact CG-CE2 3.53Å; Q177-Y179 VanDerWaalsContact CG-CZ 3.44Å; Q177-Y179 WeakPolarHBondContact CG-OH 3.32Å; Y179-A289 HydrophobicContact CD1-CB 4.35Å; Y179-A289 HydrophobicContact CD2-CB 3.55Å; Y179-A289 HydrophobicContact CE2-CB 3.79Å; Y179-A289 HydrophobicContact CG-CB 3.84Å; Y179-T293 WeakPolarHBondContact CD1-OG1 3.31Å; Y179-T293 WeakPolarHBondContact CE1-OG1 3.24Å; Y179-G312 CarbonylContact O-C 3.52Å; Y179-G312 WeakPolarHBondContact O-CA 3.43Å; Y179-V313 HydrophobicContact CD2-CG1 4.42Å; Y179-V313 PolarHBondContact N-O 2.87Å; Y179-V313 PolarHBondContact O-N 2.65Å; Y179-L315 HydrophobicContact CD2-CD1 4.44Å; Y179-L315 HydrophobicContact CD2-CG 4.28Å; Y179-L315 HydrophobicContact CE2-CD1 3.74Å; Y179-L315 HydrophobicContact CE2-CG 3.95Å
180	I	95.3	Very high	91.2	Very high	54 Å²	54	47.7 Å²	47.7	28%	0.277	25%	0.25	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	158.3	-176.9	57.8	171.7	0	0	0	110.5	T178 L331 W355	T178-I180 HydrophobicContact CG2-CG2 3.84Å; I180-L331 HydrophobicContact CG2-CD2 4.06Å; I180-W355 HydrophobicContact CG2-CH2 4.04Å; I180-W355 HydrophobicContact CG2-CZ2 4.08Å
181	V	94.7	Very high	91.5	Very high	5 Å²	5	41 Å²	41	3%	0.03	22%	0.223	C	C	.	.			trans	-51.8	140.3	171.2	66.2	0	0	0	0	110.7	Y185 F292 P298 I311	V181-Y185 HydrophobicContact CG1-CD1 4.03Å; V181-Y185 HydrophobicContact CG1-CE1 3.64Å; V181-F292 HydrophobicContact CB-CD1 4.21Å; V181-F292 HydrophobicContact CB-CE1 4.03Å; V181-P298 HydrophobicContact CG2-CG 4.04Å; V181-I311 HydrophobicContact CB-CB 4.49Å; V181-I311 HydrophobicContact CG1-CB 3.89Å; V181-I311 HydrophobicContact CG1-CG2 4.29Å; V181-I311 PolarHBondContact N-O 3.38Å
182	T	88.9	Confident	91.9	Very high	37 Å²	37	36.1 Å²	36.1	23%	0.227	20%	0.2	C	C	.	.			trans	-107.2	146.1	175.4	53.2	0	0	0	0	110.5	W213 R375	T182-W213 PolarHBondContact O-NE1 3.29Å; T182-R375 PolarHBondContact OG1-NH2 2.74Å
183	G	87.6	Confident	92.3	Very high	25 Å²	25	39.3 Å²	39.3	26%	0.258	22%	0.216	S	C	.	.	S	Bend	trans	87.3	-165.6	-176.1	0	0	0	0	0	113.4
184	R	90.9	Very high	92.8	Very high	25 Å²	25	40 Å²	40	9%	0.094	24%	0.235	C	C	.	.			trans	-103.4	148	-175.5	-67.2	-175.7	-175.1	95	-1.8	112.4	G142 A144 L145 V163 C164 W213 W216 Q217	G142-R184 PolarHBondContact O-NH1 3.05Å; A144-R184 PolarHBondContact O-NH1 2.62Å; A144-R184 PolarHBondContact O-NH2 3.47Å; L145-R184 PolarHBondContact O-NH2 3.32Å; V163-R184 HydrophobicContact CG1-CB 4.11Å; V163-R184 HydrophobicContact CG1-CG 4.22Å; C164-R184 VanDerWaalsContact SG-CA 3.53Å; R184-W213 WeakPolarHBondContact O-CA 3.34Å; R184-W216 HydrophobicContact CB-CB 3.84Å; R184-W216 HydrophobicContact CB-CD2 3.7Å; R184-W216 HydrophobicContact CB-CE3 4.15Å; R184-W216 HydrophobicContact CB-CG 3.56Å; R184-W216 WeakPolarHBondContact O-CB 3.27Å; R184-Q217 PolarHBondContact O-NE2 2.97Å
185	Y	95.5	Very high	93.8	Very high	0 Å²	0	35 Å²	35	0%	0	21%	0.211	C	C	.	.			trans	-146.2	155.5	168	65	-93.1	0	0	0	109.3	V163 C164 P165 H166 V181 T209 P298 I311 L333	V163-Y185 WeakPolarHBondContact CA-O 3.24Å; V163-Y185 WeakPolarHBondContact CG1-O 3.47Å; C164-Y185 PolarHBondContact N-O 2.92Å; P165-Y185 HydrophobicContact CG-CE2 4.44Å; H166-Y185 WeakPolarHBondContact CB-OH 3.36Å; H166-Y185 AromaticContact CE1-CE1 3.58Å; H166-Y185 AromaticContact ND1-CE1 3.39Å; H166-Y185 WeakPolarHBondContact ND1-CE1 3.45Å; H166-Y185 AromaticContact ND1-CZ 3.44Å; H166-Y185 PolarHBondContact ND1-OH 2.82Å; V181-Y185 HydrophobicContact CG1-CD1 4.03Å; V181-Y185 HydrophobicContact CG1-CE1 3.64Å; Y185-T209 HydrophobicContact CD2-CG2 3.82Å; Y185-T209 HydrophobicContact CG-CG2 4.41Å; Y185-P298 HydrophobicContact CD1-CG 4.41Å; Y185-P298 HydrophobicContact CG-CG 4.37Å; Y185-I311 HydrophobicContact CE1-CG2 4.26Å; Y185-I311 WeakPolarHBondContact OH-CD1 3.46Å; Y185-L333 HydrophobicContact CD2-CD2 4.11Å; Y185-L333 HydrophobicContact CE2-CD2 3.53Å
186	T	97.1	Very high	94.6	Very high	0 Å²	0	37 Å²	37	0%	0	22%	0.22	C	C	.	.	B	Isolated β-bridge	trans	-99.3	130.5	176.5	-54.5	0	0	0	0	109.1	L155 L161 K188 T209 S212 W216	L155-T186 WeakPolarHBondContact O-CB 3.47Å; L155-T186 WeakPolarHBondContact O-CG2 3.36Å; L155-T186 PolarHBondContact O-OG1 2.86Å; L161-T186 HydrophobicContact CB-CG2 3.97Å; L161-T186 HydrophobicContact CD1-CG2 4.29Å; L161-T186 HydrophobicContact CD2-CG2 4.11Å; L161-T186 HydrophobicContact CG-CG2 4.35Å; T186-K188 HydrophobicContact CG2-CD 4.37Å; T186-K188 PolarHBondContact O-N 2.86Å; T186-T209 WeakPolarHBondContact O-CG2 3.48Å; T186-T209 PolarHBondContact O-OG1 3.38Å; T186-S212 PolarHBondContact N-OG 2.8Å; T186-S212 PolarHBondContact O-OG 2.81Å; T186-W216 PolarHBondContact OG1-NE1 3.25Å
187	Y	98.4	Very high	95.3	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	21%	0.213	C	C	.	.			trans	-78.5	111.4	177.3	176.6	-149.3	0	0	0	110.6	L162 P165 H189 Q192 L333 D334 Y337 I347	L162-Y187 PolarHBondContact O-N 3.44Å; P165-Y187 HydrophobicContact CG-CD1 4.17Å; P165-Y187 HydrophobicContact CG-CG 4.21Å; Y187-H189 AromaticContact CE1-CD2 3.78Å; Y187-H189 HydrophobicContact CE2-CB 3.88Å; Y187-H189 AromaticContact CZ-CD2 3.99Å; Y187-Q192 PolarHBondContact O-NE2 2.92Å; Y187-L333 HydrophobicContact CD1-CD1 4.23Å; Y187-L333 HydrophobicContact CD2-CD1 3.46Å; Y187-L333 VanDerWaalsContact CD2-CD1 3.46Å; Y187-L333 HydrophobicContact CD2-CD2 3.57Å; Y187-L333 HydrophobicContact CD2-CG 3.45Å; Y187-L333 VanDerWaalsContact CD2-CG 3.45Å; Y187-L333 HydrophobicContact CE1-CD1 4.4Å; Y187-L333 HydrophobicContact CE2-CD1 3.66Å; Y187-L333 HydrophobicContact CE2-CD2 4.22Å; Y187-L333 HydrophobicContact CE2-CG 3.61Å; Y187-L333 HydrophobicContact CG-CD1 3.75Å; Y187-L333 HydrophobicContact CG-CD2 4.24Å; Y187-L333 HydrophobicContact CG-CG 4.21Å; Y187-D334 PolarHBondContact OH-O 3.02Å; Y187-Y337 VanDerWaalsContact OH-CB 3.23Å; Y187-Y337 WeakPolarHBondContact OH-CB 3.28Å; Y187-I347 HydrophobicContact CD1-CD1 4.2Å; Y187-I347 HydrophobicContact CD1-CG2 4.47Å; Y187-I347 HydrophobicContact CE1-CD1 3.79Å; Y187-I347 HydrophobicContact CE1-CG1 4.16Å; Y187-I347 HydrophobicContact CE1-CG2 3.87Å
188	K	98.4	Very high	95.6	Very high	4 Å²	4	36.2 Å²	36.2	2%	0.017	21%	0.207	C	C	.	.			trans	-105.8	133	175.1	-62.2	-72.1	-63	165.4	0	109.7	L161 T186 Q192 D193 R205 Q208 T209 I225	L161-K188 HydrophobicContact CD2-CD 3.95Å; T186-K188 HydrophobicContact CG2-CD 4.37Å; T186-K188 PolarHBondContact O-N 2.86Å; K188-Q192 VanDerWaalsContact CA-OE1 3.3Å; K188-Q192 VanDerWaalsContact CD-OE1 3.23Å; K188-D193 IonicContact NZ-OD1 3.91Å; K188-D193 PolarHBondContact NZ-OD1 2.78Å; K188-D193 IonicContact NZ-OD2 3.71Å; K188-D193 PolarHBondContact NZ-OD2 3Å; K188-R205 WeakPolarHBondContact CB-O 3.42Å; K188-Q208 HydrophobicContact CB-CB 3.84Å; K188-Q208 HydrophobicContact CG-CB 3.72Å; K188-T209 PolarHBondContact N-OG1 2.83Å; K188-I225 HydrophobicContact CD-CD1 4.09Å; K188-I225 HydrophobicContact CG-CD1 4.42Å
189	H	98.4	Very high	95.7	Very high	3 Å²	3	41.1 Å²	41.1	1%	0.014	23%	0.232	C	C	.	.			trans	-148.6	177.1	-174.8	65	77.1	0	0	0	111.1	Y187 Q192 R205 P335 Y337 F341	Y187-H189 AromaticContact CE1-CD2 3.78Å; Y187-H189 HydrophobicContact CE2-CB 3.88Å; Y187-H189 AromaticContact CZ-CD2 3.99Å; H189-Q192 PolarHBondContact CD2-NE2 2.96Å; H189-Q192 PolarHBondContact NE2-NE2 3.42Å; H189-Q192 WeakPolarHBondContact O-CG 3.43Å; H189-R205 WeakPolarHBondContact O-CD 3.44Å; H189-R205 PolarHBondContact O-NE 2.76Å; H189-P335 CarbonylContact C-O 3.48Å; H189-P335 VanDerWaalsContact CA-O 3.27Å; H189-P335 WeakPolarHBondContact CA-O 3.4Å; H189-P335 WeakPolarHBondContact CB-O 3.32Å; H189-Y337 AromaticContact CD2-CD1 3.86Å; H189-Y337 AromaticContact CE1-CD1 3.51Å; H189-Y337 AromaticContact CE1-CE1 3.94Å; H189-Y337 AromaticContact CG-CD1 3.87Å; H189-Y337 AromaticContact ND1-CD1 3.65Å; H189-Y337 PolarHBondContact ND1-O 3.17Å; H189-Y337 AromaticContact NE2-CD1 3.66Å; H189-F341 AromaticContact CE1-CD1 3.75Å
190	Y	98.4	Very high	95.8	Very high	7 Å²	7	39.4 Å²	39.4	3%	0.027	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.1	152.4	-179.9	-72.4	-11.6	0	0	0	113.9	Q192 D197 R198 N199 C202 R205 P335 H336 Y337 T338	Y190-Q192 PolarHBondContact O-N 2.84Å; Y190-Q192 VanDerWaalsContact O-N 3.15Å; Y190-D197 WeakPolarHBondContact CA-OD1 3.43Å; Y190-D197 WeakPolarHBondContact CD1-OD2 3.46Å; Y190-D197 WeakPolarHBondContact CE1-O 3.22Å; Y190-R198 HydrophobicContact CD2-CB 4.45Å; Y190-R198 HydrophobicContact CD2-CG 4.09Å; Y190-N199 PolarHBondContact OH-N 3.03Å; Y190-C202 HydrophobicContact CE1-CB 4.13Å; Y190-C202 WeakPolarHBondContact OH-CB 3.48Å; Y190-C202 PolarHBondContact OH-N 3.48Å; Y190-R205 HydrophobicContact CD1-CG 4.25Å; Y190-P335 WeakPolarHBondContact CD1-O 3.2Å; Y190-P335 PolarHBondContact N-O 3.42Å; Y190-H336 VanDerWaalsContact CD2-CA 3.49Å; Y190-H336 HydrophobicContact CD2-CB 4.13Å; Y190-H336 WeakPolarHBondContact CD2-O 3.15Å; Y190-H336 HydrophobicContact CE2-CB 3.84Å; Y190-H336 AromaticContact CE2-CD2 3.56Å; Y190-H336 AromaticContact CZ-CD2 3.53Å; Y190-H336 PolarHBondContact OH-CD2 2.99Å; Y190-H336 VanDerWaalsContact OH-CD2 3.22Å; Y190-Y337 PolarHBondContact N-O 2.93Å; Y190-T338 HydrophobicContact CD2-CG2 3.97Å; Y190-T338 HydrophobicContact CG-CG2 4.45Å
191	L	97.6	Very high	95.9	Very high	50 Å²	50	36.9 Å²	36.9	26%	0.262	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.4	3.8	175.5	-50.7	-178	0	0	0	115.1	V195 D196 D197 R198 T338 F341	L191-V195 WeakPolarHBondContact CA-O 3.4Å; L191-D196 HydrophobicContact CD2-CB 4.2Å; L191-D196 WeakPolarHBondContact CD2-OD1 3.32Å; L191-D197 PolarHBondContact N-OD1 3.37Å; L191-R198 HydrophobicContact CD2-CG 3.84Å; L191-R198 HydrophobicContact CG-CG 4.38Å; L191-T338 HydrophobicContact CD1-CG2 4.06Å; L191-T338 HydrophobicContact CG-CG2 4.28Å; L191-F341 WeakPolarHBondContact O-CZ 3.46Å
192	Q	96.7	Very high	96.1	Very high	6 Å²	6	36.8 Å²	36.8	3%	0.028	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-75.9	161.4	171.9	-68.8	-175	-19	0	0	111.8	Y187 K188 H189 Y190 G194 V195 R205 F341	Y187-Q192 PolarHBondContact O-NE2 2.92Å; K188-Q192 VanDerWaalsContact CA-OE1 3.3Å; K188-Q192 VanDerWaalsContact CD-OE1 3.23Å; H189-Q192 PolarHBondContact CD2-NE2 2.96Å; H189-Q192 PolarHBondContact NE2-NE2 3.42Å; H189-Q192 WeakPolarHBondContact O-CG 3.43Å; Y190-Q192 PolarHBondContact O-N 2.84Å; Y190-Q192 VanDerWaalsContact O-N 3.15Å; Q192-G194 PolarHBondContact O-N 3.1Å; Q192-V195 PolarHBondContact O-N 3.47Å; Q192-R205 PolarHBondContact O-NH2 3.27Å; Q192-F341 HydrophobicContact CG-CD1 4.37Å; Q192-F341 HydrophobicContact CG-CE1 4.07Å
193	D	94.9	Very high	96.5	Very high	87 Å²	87	35.1 Å²	35.1	47%	0.465	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	60.4	23.6	176.8	-39.9	-49	0	0	0	113.6	K188 V195 R205	K188-D193 IonicContact NZ-OD1 3.91Å; K188-D193 PolarHBondContact NZ-OD1 2.78Å; K188-D193 IonicContact NZ-OD2 3.71Å; K188-D193 PolarHBondContact NZ-OD2 3Å; D193-V195 VanDerWaalsContact C-N 3.3Å; D193-V195 PolarHBondContact O-N 2.81Å; D193-R205 IonicContact OD2-CZ 3.79Å; D193-R205 IonicContact OD2-NH1 3.91Å; D193-R205 PolarHBondContact OD2-NH1 3.06Å
194	G	95.2	Very high	97.1	Very high	84 Å²	84	33.9 Å²	33.9	87%	0.866	19%	0.189	S	C	*	.	G	3₁₀ helix	trans	71.5	16.6	177.4	0	0	0	0	0	115.2	Q192	Q192-G194 PolarHBondContact O-N 3.1Å
195	V	96.2	Very high	97.4	Very high	57 Å²	57	32.8 Å²	32.8	35%	0.345	18%	0.184	S	C	.	.			trans	-114.7	130.1	-179.8	-175.7	0	0	0	0	110.8	L191 Q192 D193 D197 W200 L228	L191-V195 WeakPolarHBondContact CA-O 3.4Å; Q192-V195 PolarHBondContact O-N 3.47Å; D193-V195 VanDerWaalsContact C-N 3.3Å; D193-V195 PolarHBondContact O-N 2.81Å; V195-D197 HydrophobicContact CG1-CB 4.44Å; V195-D197 PolarHBondContact O-N 2.9Å; V195-W200 HydrophobicContact CG1-CZ2 4.32Å; V195-L228 HydrophobicContact CB-CD1 3.79Å; V195-L228 HydrophobicContact CG1-CD1 3.51Å; V195-L228 HydrophobicContact CG2-CD1 4.23Å
196	D	97.8	Very high	97.6	Very high	83 Å²	83	32.8 Å²	32.8	44%	0.444	18%	0.184	S	C	.	.			trans	-81.3	91.9	169.5	-172.6	-0.1	0	0	0	110.8	L191 R198 W200	L191-D196 HydrophobicContact CD2-CB 4.2Å; L191-D196 WeakPolarHBondContact CD2-OD1 3.32Å; D196-R198 WeakPolarHBondContact OD1-CB 3.27Å; D196-R198 VanDerWaalsContact OD1-CG 3.3Å; D196-R198 WeakPolarHBondContact OD1-CG 3.44Å; D196-R198 IonicContact OD1-CZ 3.39Å; D196-R198 PolarHBondContact OD1-N 3.02Å; D196-R198 IonicContact OD1-NE 3.33Å; D196-R198 PolarHBondContact OD1-NE 3.41Å; D196-R198 IonicContact OD1-NH2 2.66Å; D196-R198 IonicContact OD2-CZ 2.79Å; D196-R198 IonicContact OD2-NE 2.8Å; D196-R198 PolarHBondContact OD2-NE 3.04Å; D196-R198 IonicContact OD2-NH2 3.98Å; D196-R198 PolarHBondContact OD2-NH2 3.27Å; D196-W200 PolarHBondContact O-NE1 3.25Å
197	D	98.1	Very high	97.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	18%	0.184	C	C	.	.			trans	-103.4	18.9	-178.2	68.9	-57.3	0	0	0	113.8	Y190 L191 V195 N199 W200 G201 R205 L228	Y190-D197 WeakPolarHBondContact CA-OD1 3.43Å; Y190-D197 WeakPolarHBondContact CD1-OD2 3.46Å; Y190-D197 WeakPolarHBondContact CE1-O 3.22Å; L191-D197 PolarHBondContact N-OD1 3.37Å; V195-D197 HydrophobicContact CG1-CB 4.44Å; V195-D197 PolarHBondContact O-N 2.9Å; D197-N199 PolarHBondContact O-N 3.35Å; D197-W200 HydrophobicContact CB-CD2 4.49Å; D197-W200 HydrophobicContact CB-CH2 4.43Å; D197-W200 HydrophobicContact CB-CZ2 3.89Å; D197-W200 PolarHBondContact O-N 3.37Å; D197-G201 WeakPolarHBondContact O-CA 3.43Å; D197-G201 PolarHBondContact O-N 2.95Å; D197-G201 WeakPolarHBondContact OD2-CA 3.46Å; D197-R205 VanDerWaalsContact CG-NE 3.31Å; D197-R205 IonicContact OD1-CZ 2.8Å; D197-R205 IonicContact OD1-NE 2.65Å; D197-R205 PolarHBondContact OD1-NE 3.08Å; D197-R205 IonicContact OD1-NH2 2.79Å; D197-R205 PolarHBondContact OD1-NH2 3.4Å; D197-R205 WeakPolarHBondContact OD2-CG 3.47Å; D197-R205 IonicContact OD2-CZ 3.31Å; D197-R205 IonicContact OD2-NE 3.8Å; D197-R205 PolarHBondContact OD2-NE 3.41Å; D197-R205 IonicContact OD2-NH2 3.87Å; D197-R205 PolarHBondContact OD2-NH2 3.44Å; D197-L228 HydrophobicContact CB-CD1 3.86Å
198	R	97.7	Very high	97.7	Very high	122 Å²	122	32.8 Å²	32.8	46%	0.46	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	135.2	178.5	-70.4	177.6	-68.5	175.1	-0.5	110.7	Y190 L191 D196 W200 T338	Y190-R198 HydrophobicContact CD2-CB 4.45Å; Y190-R198 HydrophobicContact CD2-CG 4.09Å; L191-R198 HydrophobicContact CD2-CG 3.84Å; L191-R198 HydrophobicContact CG-CG 4.38Å; D196-R198 WeakPolarHBondContact OD1-CB 3.27Å; D196-R198 VanDerWaalsContact OD1-CG 3.3Å; D196-R198 WeakPolarHBondContact OD1-CG 3.44Å; D196-R198 IonicContact OD1-CZ 3.39Å; D196-R198 PolarHBondContact OD1-N 3.02Å; D196-R198 IonicContact OD1-NE 3.33Å; D196-R198 PolarHBondContact OD1-NE 3.41Å; D196-R198 IonicContact OD1-NH2 2.66Å; D196-R198 IonicContact OD2-CZ 2.79Å; D196-R198 IonicContact OD2-NE 2.8Å; D196-R198 PolarHBondContact OD2-NE 3.04Å; D196-R198 IonicContact OD2-NH2 3.98Å; D196-R198 PolarHBondContact OD2-NH2 3.27Å; R198-W200 PolarHBondContact O-N 3.42Å; R198-T338 HydrophobicContact CG-CG2 3.95Å
199	N	95.9	Very high	97.7	Very high	146 Å²	146	32.6 Å²	32.6	78%	0.781	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.9	-3.9	178.1	-48.7	-47	0	0	0	116.8	Y190 D197	Y190-N199 PolarHBondContact OH-N 3.03Å; D197-N199 PolarHBondContact O-N 3.35Å
200	W	97.4	Very high	97.7	Very high	32 Å²	32	32.4 Å²	32.4	12%	0.121	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-18.5	178.6	66.8	-89.1	0	0	0	114.5	V195 D196 D197 R198 Y204 L228 C249	V195-W200 HydrophobicContact CG1-CZ2 4.32Å; D196-W200 PolarHBondContact O-NE1 3.25Å; D197-W200 HydrophobicContact CB-CD2 4.49Å; D197-W200 HydrophobicContact CB-CH2 4.43Å; D197-W200 HydrophobicContact CB-CZ2 3.89Å; D197-W200 PolarHBondContact O-N 3.37Å; R198-W200 PolarHBondContact O-N 3.42Å; W200-Y204 HydrophobicContact CE3-CD2 4.44Å; W200-Y204 AromaticContact CE3-CE2 3.9Å; W200-Y204 HydrophobicContact CE3-CE2 3.9Å; W200-Y204 HydrophobicContact CZ3-CD2 4.49Å; W200-Y204 AromaticContact CZ3-CE2 4Å; W200-Y204 HydrophobicContact CZ3-CE2 4Å; W200-L228 HydrophobicContact CH2-CB 4.47Å; W200-L228 HydrophobicContact CH2-CD1 4.04Å; W200-L228 HydrophobicContact CH2-CD2 4.5Å; W200-L228 HydrophobicContact CZ3-CD2 4.41Å; W200-C249 WeakPolarHBondContact CB-O 3.48Å; W200-C249 HydrophobicContact CD2-CB 3.82Å; W200-C249 HydrophobicContact CE3-CB 4.4Å; W200-C249 HydrophobicContact CG-CB 3.97Å; W200-C249 HydrophobicContact CZ2-CB 4.28Å
201	G	98.2	Very high	97.7	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.182	C	C	.	.			trans	-85.2	-5.5	-174.5	0	0	0	0	0	116.3	D197 A203 Y204 R205	D197-G201 WeakPolarHBondContact O-CA 3.43Å; D197-G201 PolarHBondContact O-N 2.95Å; D197-G201 WeakPolarHBondContact OD2-CA 3.46Å; G201-A203 VanDerWaalsContact C-N 3.34Å; G201-A203 PolarHBondContact O-N 3.48Å; G201-Y204 WeakPolarHBondContact O-CA 3.27Å; G201-Y204 VanDerWaalsContact O-CB 3.3Å; G201-Y204 WeakPolarHBondContact O-CB 3.46Å; G201-Y204 PolarHBondContact O-N 3.13Å; G201-R205 WeakPolarHBondContact O-CG 3.44Å; G201-R205 PolarHBondContact O-N 3.08Å
202	C	98.3	Very high	97.7	Very high	4 Å²	4	29.7 Å²	29.7	3%	0.027	17%	0.169	C	C	.	.	H	α-helix	trans	-58.3	-45.2	-162.6	52.7	0	0	0	0	112.8	Y190 R205 S206 A307 P335 H336	Y190-C202 HydrophobicContact CE1-CB 4.13Å; Y190-C202 WeakPolarHBondContact OH-CB 3.48Å; Y190-C202 PolarHBondContact OH-N 3.48Å; C202-R205 PolarHBondContact O-N 2.98Å; C202-S206 PolarHBondContact O-N 3.3Å; C202-A307 HydrophobicContact CB-CB 4.14Å; C202-A307 PolarHBondContact SG-N 3.43Å; C202-A307 VanDerWaalsContact SG-N 3.36Å; C202-P335 HydrophobicContact CB-CG 3.89Å; C202-P335 WeakPolarHBondContact O-CG 3.39Å; C202-H336 VanDerWaalsContact CB-NE2 3.31Å; C202-H336 WeakPolarHBondContact CB-NE2 3.28Å
203	A	98.6	Very high	97.6	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.008	17%	0.168	C	C	.	.	H	α-helix	trans	-67.6	-34.7	177.4	0	0	0	0	0	112.6	G201 S206 L207 I252 M300 A307	G201-A203 VanDerWaalsContact C-N 3.34Å; G201-A203 PolarHBondContact O-N 3.48Å; A203-S206 PolarHBondContact O-N 2.9Å; A203-L207 WeakPolarHBondContact O-CB 3.18Å; A203-L207 PolarHBondContact O-N 2.78Å; A203-I252 HydrophobicContact CB-CD1 4.37Å; A203-I252 HydrophobicContact CB-CG1 3.56Å; A203-I252 WeakPolarHBondContact CB-O 3.23Å; A203-M300 HydrophobicContact CB-CE 3.38Å; A203-A307 HydrophobicContact CB-CB 3.89Å
204	Y	98.8	Very high	97.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65	-44.6	175.1	-62.4	-100.2	0	0	0	111.6	W200 G201 S206 L207 Q208 L228 I231 Q232 F245 Q250 I252	W200-Y204 HydrophobicContact CE3-CD2 4.44Å; W200-Y204 AromaticContact CE3-CE2 3.9Å; W200-Y204 HydrophobicContact CE3-CE2 3.9Å; W200-Y204 HydrophobicContact CZ3-CD2 4.49Å; W200-Y204 AromaticContact CZ3-CE2 4Å; W200-Y204 HydrophobicContact CZ3-CE2 4Å; G201-Y204 WeakPolarHBondContact O-CA 3.27Å; G201-Y204 VanDerWaalsContact O-CB 3.3Å; G201-Y204 WeakPolarHBondContact O-CB 3.46Å; G201-Y204 PolarHBondContact O-N 3.13Å; Y204-S206 VanDerWaalsContact C-N 3.35Å; Y204-L207 WeakPolarHBondContact O-CB 3.32Å; Y204-L207 PolarHBondContact O-N 3.49Å; Y204-Q208 WeakPolarHBondContact O-CG 3.48Å; Y204-Q208 PolarHBondContact O-N 3.49Å; Y204-L228 HydrophobicContact CD1-CD2 3.58Å; Y204-L228 HydrophobicContact CD2-CD2 4.06Å; Y204-L228 HydrophobicContact CE1-CD2 4.4Å; Y204-L228 HydrophobicContact CG-CD2 3.37Å; Y204-I231 HydrophobicContact CD1-CB 3.89Å; Y204-I231 HydrophobicContact CD1-CD1 4.02Å; Y204-I231 HydrophobicContact CD1-CG2 3.5Å; Y204-I231 HydrophobicContact CE1-CB 4.18Å; Y204-I231 HydrophobicContact CE1-CG2 3.7Å; Y204-Q232 HydrophobicContact CE1-CG 3.83Å; Y204-Q232 PolarHBondContact OH-NE2 3.02Å; Y204-F245 WeakPolarHBondContact OH-CZ 3.34Å; Y204-Q250 WeakPolarHBondContact CE2-O 3.34Å; Y204-Q250 PolarHBondContact OH-O 3.5Å; Y204-I252 HydrophobicContact CD1-CD1 3.89Å; Y204-I252 HydrophobicContact CD2-CD1 4.1Å; Y204-I252 HydrophobicContact CD2-CG1 3.97Å; Y204-I252 HydrophobicContact CE1-CD1 3.91Å; Y204-I252 HydrophobicContact CE1-CG1 4.47Å; Y204-I252 HydrophobicContact CE1-CG2 4.36Å; Y204-I252 HydrophobicContact CE2-CB 4.43Å; Y204-I252 HydrophobicContact CE2-CD1 4.15Å; Y204-I252 HydrophobicContact CE2-CG1 3.84Å; Y204-I252 HydrophobicContact CE2-CG2 4.04Å; Y204-I252 HydrophobicContact CG-CD1 3.99Å; Y204-I252 HydrophobicContact CG-CG1 4.37Å; Y204-I252 WeakPolarHBondContact OH-CG2 3.25Å
205	R	98.7	Very high	97.5	Very high	1 Å²	1	21.6 Å²	21.6	0%	0.004	11%	0.106	C	C	.	.	H	α-helix	trans	-66.3	-37.4	177.9	-59.8	-50.8	-176.5	173	8.6	112	K188 H189 Y190 Q192 D193 D197 G201 C202 Q208 T209 P335	K188-R205 WeakPolarHBondContact CB-O 3.42Å; H189-R205 WeakPolarHBondContact O-CD 3.44Å; H189-R205 PolarHBondContact O-NE 2.76Å; Y190-R205 HydrophobicContact CD1-CG 4.25Å; Q192-R205 PolarHBondContact O-NH2 3.27Å; D193-R205 IonicContact OD2-CZ 3.79Å; D193-R205 IonicContact OD2-NH1 3.91Å; D193-R205 PolarHBondContact OD2-NH1 3.06Å; D197-R205 VanDerWaalsContact CG-NE 3.31Å; D197-R205 IonicContact OD1-CZ 2.8Å; D197-R205 IonicContact OD1-NE 2.65Å; D197-R205 PolarHBondContact OD1-NE 3.08Å; D197-R205 IonicContact OD1-NH2 2.79Å; D197-R205 PolarHBondContact OD1-NH2 3.4Å; D197-R205 WeakPolarHBondContact OD2-CG 3.47Å; D197-R205 IonicContact OD2-CZ 3.31Å; D197-R205 IonicContact OD2-NE 3.8Å; D197-R205 PolarHBondContact OD2-NE 3.41Å; D197-R205 IonicContact OD2-NH2 3.87Å; D197-R205 PolarHBondContact OD2-NH2 3.44Å; G201-R205 WeakPolarHBondContact O-CG 3.44Å; G201-R205 PolarHBondContact O-N 3.08Å; C202-R205 PolarHBondContact O-N 2.98Å; R205-Q208 PolarHBondContact O-N 3.47Å; R205-T209 PolarHBondContact O-N 3.26Å; R205-T209 PolarHBondContact O-OG1 3.18Å; R205-T209 VanDerWaalsContact O-OG1 3.12Å; R205-P335 HydrophobicContact CB-CB 3.7Å
206	S	98.8	Very high	97.2	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-61.2	-47.1	169.9	-171.6	0	0	0	0	111.5	C202 A203 Y204 Q208 T209 L210 M300 T309	C202-S206 PolarHBondContact O-N 3.3Å; A203-S206 PolarHBondContact O-N 2.9Å; Y204-S206 VanDerWaalsContact C-N 3.35Å; S206-Q208 PolarHBondContact O-N 3.46Å; S206-T209 WeakPolarHBondContact O-CA 3.46Å; S206-T209 VanDerWaalsContact O-CB 3.28Å; S206-T209 WeakPolarHBondContact O-CB 3.45Å; S206-T209 PolarHBondContact O-N 2.89Å; S206-L210 WeakPolarHBondContact O-CD1 3.47Å; S206-L210 PolarHBondContact O-N 2.87Å; S206-M300 WeakPolarHBondContact OG-CB 3.21Å; S206-M300 VanDerWaalsContact OG-CG 3.25Å; S206-M300 WeakPolarHBondContact OG-CG 3.18Å; S206-T309 WeakPolarHBondContact CB-OG1 3.47Å; S206-T309 PolarHBondContact OG-OG1 2.76Å
207	L	98.8	Very high	96.7	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-58.2	-44.3	174.9	170.2	60.2	0	0	0	112.4	A203 Y204 T209 L210 I211 I231 V257 C260 L261	A203-L207 WeakPolarHBondContact O-CB 3.18Å; A203-L207 PolarHBondContact O-N 2.78Å; Y204-L207 WeakPolarHBondContact O-CB 3.32Å; Y204-L207 PolarHBondContact O-N 3.49Å; L207-T209 VanDerWaalsContact C-N 3.25Å; L207-T209 PolarHBondContact O-N 2.95Å; L207-L210 WeakPolarHBondContact O-CB 3.25Å; L207-L210 PolarHBondContact O-N 3.06Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L207-I211 HydrophobicContact CD1-CD1 3.76Å; L207-I211 HydrophobicContact CD1-CG1 3.93Å; L207-I211 HydrophobicContact CG-CD1 3.83Å; L207-I211 HydrophobicContact CG-CG1 4.43Å; L207-I211 WeakPolarHBondContact O-CG1 3.31Å; L207-I211 PolarHBondContact O-N 3.05Å; L207-I231 HydrophobicContact CD2-CD1 3.99Å; L207-I231 HydrophobicContact CD2-CG1 4Å; L207-I231 HydrophobicContact CD2-CG2 3.7Å; L207-I231 HydrophobicContact CG-CD1 4.47Å; L207-V257 HydrophobicContact CB-CG1 4.27Å; L207-V257 HydrophobicContact CB-CG2 4.12Å; L207-V257 HydrophobicContact CD1-CG1 4Å; L207-C260 HydrophobicContact CD1-CB 4.47Å; L207-C260 HydrophobicContact CD2-CB 3.62Å; L207-L261 HydrophobicContact CD1-CD1 4.04Å; L207-L261 HydrophobicContact CD1-CD2 3.79Å; L207-L261 HydrophobicContact CD1-CG 3.64Å
208	Q	98.8	Very high	96	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.078	C	C	.	.	H	α-helix	trans	-59.3	-38	175.1	-70.8	-176.7	-40	0	0	111.7	K188 Y204 R205 S206 I211 S212 I225 P226 I231	K188-Q208 HydrophobicContact CB-CB 3.84Å; K188-Q208 HydrophobicContact CG-CB 3.72Å; Y204-Q208 WeakPolarHBondContact O-CG 3.48Å; Y204-Q208 PolarHBondContact O-N 3.49Å; R205-Q208 PolarHBondContact O-N 3.47Å; S206-Q208 PolarHBondContact O-N 3.46Å; Q208-I211 PolarHBondContact O-N 2.94Å; Q208-S212 WeakPolarHBondContact O-CB 3.18Å; Q208-S212 PolarHBondContact O-N 2.78Å; Q208-I225 HydrophobicContact CB-CG2 3.72Å; Q208-I225 HydrophobicContact CG-CG2 3.66Å; Q208-P226 PolarHBondContact NE2-O 3.29Å; Q208-I231 HydrophobicContact CG-CD1 4.05Å
209	T	98.7	Very high	95.4	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.066	C	C	.	.	H	α-helix	trans	-63.2	-45.4	173	-61.2	0	0	0	0	111.4	Y185 T186 K188 R205 S206 L207 I211 S212 W213 T309 L333	Y185-T209 HydrophobicContact CD2-CG2 3.82Å; Y185-T209 HydrophobicContact CG-CG2 4.41Å; T186-T209 WeakPolarHBondContact O-CG2 3.48Å; T186-T209 PolarHBondContact O-OG1 3.38Å; K188-T209 PolarHBondContact N-OG1 2.83Å; R205-T209 PolarHBondContact O-N 3.26Å; R205-T209 PolarHBondContact O-OG1 3.18Å; R205-T209 VanDerWaalsContact O-OG1 3.12Å; S206-T209 WeakPolarHBondContact O-CA 3.46Å; S206-T209 VanDerWaalsContact O-CB 3.28Å; S206-T209 WeakPolarHBondContact O-CB 3.45Å; S206-T209 PolarHBondContact O-N 2.89Å; L207-T209 VanDerWaalsContact C-N 3.25Å; L207-T209 PolarHBondContact O-N 2.95Å; T209-I211 PolarHBondContact O-N 3.3Å; T209-S212 PolarHBondContact O-N 3.45Å; T209-S212 PolarHBondContact O-OG 2.83Å; T209-W213 PolarHBondContact O-N 3.03Å; T209-W213 VanDerWaalsContact O-N 3.12Å; T209-T309 HydrophobicContact CG2-CG2 4.37Å; T209-L333 HydrophobicContact CG2-CD2 3.86Å
210	L	98.7	Very high	95	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-59.4	-47	175.9	-89.2	65.4	0	0	0	111.6	S206 L207 S212 W213 L214 V257 L261 P298 M300 T309 L372	S206-L210 WeakPolarHBondContact O-CD1 3.47Å; S206-L210 PolarHBondContact O-N 2.87Å; L207-L210 WeakPolarHBondContact O-CB 3.25Å; L207-L210 PolarHBondContact O-N 3.06Å; L207-L210 VanDerWaalsContact O-N 3.12Å; L210-S212 VanDerWaalsContact C-N 3.33Å; L210-S212 PolarHBondContact O-N 2.88Å; L210-W213 WeakPolarHBondContact O-CB 3.21Å; L210-W213 PolarHBondContact O-N 3.43Å; L210-L214 PolarHBondContact O-N 3.16Å; L210-L214 VanDerWaalsContact O-N 3.15Å; L210-V257 HydrophobicContact CD2-CG1 4.48Å; L210-L261 HydrophobicContact CD2-CD1 4.21Å; L210-P298 HydrophobicContact CD1-CB 4Å; L210-P298 HydrophobicContact CG-CB 4.47Å; L210-M300 HydrophobicContact CD1-CB 4.21Å; L210-M300 HydrophobicContact CD2-CB 4.11Å; L210-T309 HydrophobicContact CD1-CG2 4Å; L210-L372 HydrophobicContact CB-CD1 4.2Å; L210-L372 HydrophobicContact CD2-CD1 4.46Å; L210-L372 HydrophobicContact CD2-CD2 4.27Å; L210-L372 HydrophobicContact CD2-CG 4.13Å; L210-L372 HydrophobicContact CG-CD1 4.03Å; L210-L372 HydrophobicContact CG-CG 4.25Å
211	I	98.2	Very high	94.5	Very high	0 Å²	0	9.8 Å²	9.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-60.2	-43.7	177.2	-67.6	166.8	0	0	0	110.8	L207 Q208 T209 W213 L214 M215 I220 P226 L261 Y265	L207-I211 HydrophobicContact CD1-CD1 3.76Å; L207-I211 HydrophobicContact CD1-CG1 3.93Å; L207-I211 HydrophobicContact CG-CD1 3.83Å; L207-I211 HydrophobicContact CG-CG1 4.43Å; L207-I211 WeakPolarHBondContact O-CG1 3.31Å; L207-I211 PolarHBondContact O-N 3.05Å; Q208-I211 PolarHBondContact O-N 2.94Å; T209-I211 PolarHBondContact O-N 3.3Å; I211-W213 VanDerWaalsContact C-N 3.27Å; I211-W213 PolarHBondContact O-N 2.89Å; I211-L214 WeakPolarHBondContact O-CB 3.11Å; I211-L214 PolarHBondContact O-N 3.01Å; I211-M215 HydrophobicContact CG2-CE 3.76Å; I211-M215 HydrophobicContact CG2-SD 4.41Å; I211-M215 WeakPolarHBondContact O-CG 3.32Å; I211-M215 PolarHBondContact O-N 3.09Å; I211-I220 HydrophobicContact CG2-CD1 4.1Å; I211-P226 HydrophobicContact CD1-CG 4.05Å; I211-L261 HydrophobicContact CG1-CD2 3.85Å; I211-Y265 HydrophobicContact CB-CE2 4.48Å; I211-Y265 HydrophobicContact CD1-CE2 3.87Å; I211-Y265 HydrophobicContact CG1-CD2 4.48Å; I211-Y265 HydrophobicContact CG1-CE2 3.82Å; I211-Y265 HydrophobicContact CG2-CE2 3.86Å
212	S	97	Very high	93.9	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-59.4	-39.8	177.8	79.4	0	0	0	0	111.8	T186 Q208 T209 L210 M215 W216	T186-S212 PolarHBondContact N-OG 2.8Å; T186-S212 PolarHBondContact O-OG 2.81Å; Q208-S212 WeakPolarHBondContact O-CB 3.18Å; Q208-S212 PolarHBondContact O-N 2.78Å; T209-S212 PolarHBondContact O-N 3.45Å; T209-S212 PolarHBondContact O-OG 2.83Å; L210-S212 VanDerWaalsContact C-N 3.33Å; L210-S212 PolarHBondContact O-N 2.88Å; S212-M215 PolarHBondContact O-N 3.07Å; S212-W216 WeakPolarHBondContact O-CB 3.42Å; S212-W216 PolarHBondContact O-N 2.88Å
213	W	95.7	Very high	93.6	Very high	1 Å²	1	11.8 Å²	11.8	0%	0.004	7%	0.074	C	C	.	.	H	α-helix	trans	-63.1	-44.8	177.3	-178.2	87.8	0	0	0	111.3	T182 R184 T209 L210 I211 M215 W216 Q217 G297 P298 L372 R375	T182-W213 PolarHBondContact O-NE1 3.29Å; R184-W213 WeakPolarHBondContact O-CA 3.34Å; T209-W213 PolarHBondContact O-N 3.03Å; T209-W213 VanDerWaalsContact O-N 3.12Å; L210-W213 WeakPolarHBondContact O-CB 3.21Å; L210-W213 PolarHBondContact O-N 3.43Å; I211-W213 VanDerWaalsContact C-N 3.27Å; I211-W213 PolarHBondContact O-N 2.89Å; W213-M215 VanDerWaalsContact C-N 3.29Å; W213-M215 PolarHBondContact O-N 2.82Å; W213-W216 PolarHBondContact O-N 3.35Å; W213-Q217 HydrophobicContact CD2-CG 3.74Å; W213-Q217 HydrophobicContact CE3-CG 4.16Å; W213-Q217 HydrophobicContact CG-CG 4.3Å; W213-Q217 HydrophobicContact CH2-CG 4Å; W213-Q217 HydrophobicContact CZ2-CG 3.55Å; W213-Q217 HydrophobicContact CZ3-CG 4.27Å; W213-Q217 WeakPolarHBondContact O-CG 3.24Å; W213-Q217 PolarHBondContact O-N 2.82Å; W213-G297 VanDerWaalsContact CE2-CA 3.44Å; W213-G297 VanDerWaalsContact CZ2-CA 3.42Å; W213-P298 HydrophobicContact CB-CG 3.94Å; W213-P298 HydrophobicContact CG-CG 3.99Å; W213-L372 HydrophobicContact CE3-CD1 3.72Å; W213-L372 HydrophobicContact CZ3-CD1 4.11Å; W213-R375 HydrophobicContact CH2-CG 3.8Å; W213-R375 HydrophobicContact CZ2-CG 4.42Å
214	L	94.2	Very high	93.4	Very high	3 Å²	3	16.2 Å²	16.2	2%	0.016	10%	0.103	C	C	.	.	H	α-helix	trans	-58.8	-41.4	176.7	-68	164	0	0	0	111.7	L210 I211 Q217 G218 E219 I220 L261 I267 L372	L210-L214 PolarHBondContact O-N 3.16Å; L210-L214 VanDerWaalsContact O-N 3.15Å; I211-L214 WeakPolarHBondContact O-CB 3.11Å; I211-L214 PolarHBondContact O-N 3.01Å; L214-Q217 PolarHBondContact O-N 3.27Å; L214-G218 PolarHBondContact O-N 2.88Å; L214-G218 VanDerWaalsContact O-N 3.13Å; L214-E219 HydrophobicContact CB-CB 4.35Å; L214-E219 HydrophobicContact CD2-CB 3.83Å; L214-E219 HydrophobicContact CD2-CG 4.18Å; L214-E219 PolarHBondContact O-N 2.85Å; L214-I220 HydrophobicContact CB-CD1 3.74Å; L214-I220 HydrophobicContact CB-CG1 3.77Å; L214-I220 HydrophobicContact CB-CG2 4.37Å; L214-I220 HydrophobicContact CD1-CD1 4.49Å; L214-I220 PolarHBondContact O-N 3.13Å; L214-L261 HydrophobicContact CD1-CD2 3.83Å; L214-I267 HydrophobicContact CD1-CD1 3.39Å; L214-I267 HydrophobicContact CD2-CD1 3.71Å; L214-I267 HydrophobicContact CG-CD1 4.07Å; L214-L372 HydrophobicContact CD1-CD2 3.95Å; L214-L372 HydrophobicContact CD2-CD1 4.29Å; L214-L372 HydrophobicContact CD2-CD2 4.35Å; L214-L372 HydrophobicContact CG-CD1 4.19Å; L214-L372 HydrophobicContact CG-CD2 4.36Å
215	M	92.1	Very high	93.3	Very high	3 Å²	3	17.4 Å²	17.4	2%	0.015	11%	0.109	C	C	.	.	H	α-helix	trans	-66.2	-45.6	175.1	-66.6	-178.2	176.2	0	0	111.7	L155 I211 S212 W213 Q217 G218 I220 P222 G223	L155-M215 HydrophobicContact CD1-CB 3.61Å; L155-M215 HydrophobicContact CD1-SD 4.37Å; L155-M215 HydrophobicContact CD2-SD 3.84Å; I211-M215 HydrophobicContact CG2-CE 3.76Å; I211-M215 HydrophobicContact CG2-SD 4.41Å; I211-M215 WeakPolarHBondContact O-CG 3.32Å; I211-M215 PolarHBondContact O-N 3.09Å; S212-M215 PolarHBondContact O-N 3.07Å; W213-M215 VanDerWaalsContact C-N 3.29Å; W213-M215 PolarHBondContact O-N 2.82Å; M215-Q217 VanDerWaalsContact C-N 3.29Å; M215-Q217 PolarHBondContact O-N 3.47Å; M215-G218 PolarHBondContact O-N 2.77Å; M215-G218 VanDerWaalsContact O-N 3.08Å; M215-I220 HydrophobicContact CB-CG1 4.36Å; M215-I220 HydrophobicContact CE-CD1 4.2Å; M215-I220 HydrophobicContact CG-CD1 3.67Å; M215-I220 HydrophobicContact CG-CG1 3.61Å; M215-P222 HydrophobicContact CB-CB 4.28Å; M215-P222 HydrophobicContact CB-CG 4.39Å; M215-G223 VanDerWaalsContact SD-O 3.39Å
216	W	90.3	Very high	93.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-62	-34.9	176.8	-82.7	119.1	0	0	0	112.8	G142 P147 I151 L155 G156 V163 R184 T186 S212 W213 G218	G142-W216 CarbonylContact C-O 3.59Å; G142-W216 WeakPolarHBondContact CA-O 3.3Å; P147-W216 HydrophobicContact CB-CH2 3.96Å; P147-W216 HydrophobicContact CB-CZ3 4.31Å; I151-W216 HydrophobicContact CB-CH2 4.49Å; I151-W216 HydrophobicContact CB-CZ3 4.34Å; I151-W216 HydrophobicContact CG2-CD2 4.35Å; I151-W216 HydrophobicContact CG2-CE3 3.91Å; I151-W216 HydrophobicContact CG2-CH2 3.69Å; I151-W216 HydrophobicContact CG2-CZ2 4.19Å; I151-W216 HydrophobicContact CG2-CZ3 3.56Å; L155-W216 HydrophobicContact CB-CH2 4.3Å; L155-W216 HydrophobicContact CB-CZ2 3.41Å; L155-W216 VanDerWaalsContact CB-CZ2 3.41Å; L155-W216 HydrophobicContact CD1-CD2 3.93Å; L155-W216 HydrophobicContact CD1-CG 4Å; L155-W216 HydrophobicContact CD1-CZ2 4.23Å; L155-W216 HydrophobicContact CG-CZ2 4.45Å; G156-W216 WeakPolarHBondContact O-CH2 3.47Å; G156-W216 VanDerWaalsContact O-CZ2 3.23Å; G156-W216 WeakPolarHBondContact O-CZ2 3.38Å; V163-W216 HydrophobicContact CG1-CZ2 4.44Å; V163-W216 HydrophobicContact CG2-CZ2 4.01Å; R184-W216 HydrophobicContact CB-CB 3.84Å; R184-W216 HydrophobicContact CB-CD2 3.7Å; R184-W216 HydrophobicContact CB-CE3 4.15Å; R184-W216 HydrophobicContact CB-CG 3.56Å; R184-W216 WeakPolarHBondContact O-CB 3.27Å; T186-W216 PolarHBondContact OG1-NE1 3.25Å; S212-W216 WeakPolarHBondContact O-CB 3.42Å; S212-W216 PolarHBondContact O-N 2.88Å; W213-W216 PolarHBondContact O-N 3.35Å; W216-G218 VanDerWaalsContact C-N 3.26Å
217	Q	86.9	Confident	93.3	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.005	13%	0.129	C	C	.	.	H	α-helix	trans	-82.2	-8.9	177.6	-62.3	-33.7	-72.2	0	0	112.5	R184 W213 L214 M215 E219	R184-Q217 PolarHBondContact O-NE2 2.97Å; W213-Q217 HydrophobicContact CD2-CG 3.74Å; W213-Q217 HydrophobicContact CE3-CG 4.16Å; W213-Q217 HydrophobicContact CG-CG 4.3Å; W213-Q217 HydrophobicContact CH2-CG 4Å; W213-Q217 HydrophobicContact CZ2-CG 3.55Å; W213-Q217 HydrophobicContact CZ3-CG 4.27Å; W213-Q217 WeakPolarHBondContact O-CG 3.24Å; W213-Q217 PolarHBondContact O-N 2.82Å; L214-Q217 PolarHBondContact O-N 3.27Å; M215-Q217 VanDerWaalsContact C-N 3.29Å; M215-Q217 PolarHBondContact O-N 3.47Å; Q217-E219 HydrophobicContact CB-CG 4.02Å; Q217-E219 PolarHBondContact O-N 2.76Å
218	G	83.3	Confident	93.3	Very high	19 Å²	19	20.7 Å²	20.7	20%	0.196	13%	0.131	C	C	.	.	T	Hydrogen-bonded Turn	trans	69.9	22.8	-176.8	0	0	0	0	0	113	R140 L214 M215 W216 I220	R140-G218 PolarHBondContact NH1-O 3.07Å; L214-G218 PolarHBondContact O-N 2.88Å; L214-G218 VanDerWaalsContact O-N 3.13Å; M215-G218 PolarHBondContact O-N 2.77Å; M215-G218 VanDerWaalsContact O-N 3.08Å; W216-G218 VanDerWaalsContact C-N 3.26Å; G218-I220 VanDerWaalsContact C-N 3.3Å
219	E	85.7	Confident	93.2	Very high	45 Å²	45	28.6 Å²	28.6	21%	0.21	16%	0.161	C	C	.	.	S	Bend	trans	-72.1	-30.3	170.5	-64.2	-61.7	149.4	0	0	110.7	L214 Q217 R375	L214-E219 HydrophobicContact CB-CB 4.35Å; L214-E219 HydrophobicContact CD2-CB 3.83Å; L214-E219 HydrophobicContact CD2-CG 4.18Å; L214-E219 PolarHBondContact O-N 2.85Å; Q217-E219 HydrophobicContact CB-CG 4.02Å; Q217-E219 PolarHBondContact O-N 2.76Å; E219-R375 WeakPolarHBondContact OE1-CB 3.31Å; E219-R375 VanDerWaalsContact OE1-CG 3.31Å; E219-R375 WeakPolarHBondContact OE1-CG 3.25Å
220	I	88.3	Confident	93.2	Very high	19 Å²	19	32.4 Å²	32.4	10%	0.097	18%	0.181	C	C	.	.	S	Bend	trans	-128.6	157.6	170.3	66.6	-179.8	0	0	0	109.9	I211 L214 M215 G218 P222 Y265 I267	I211-I220 HydrophobicContact CG2-CD1 4.1Å; L214-I220 HydrophobicContact CB-CD1 3.74Å; L214-I220 HydrophobicContact CB-CG1 3.77Å; L214-I220 HydrophobicContact CB-CG2 4.37Å; L214-I220 HydrophobicContact CD1-CD1 4.49Å; L214-I220 PolarHBondContact O-N 3.13Å; M215-I220 HydrophobicContact CB-CG1 4.36Å; M215-I220 HydrophobicContact CE-CD1 4.2Å; M215-I220 HydrophobicContact CG-CD1 3.67Å; M215-I220 HydrophobicContact CG-CG1 3.61Å; G218-I220 VanDerWaalsContact C-N 3.3Å; I220-P222 WeakPolarHBondContact O-CD 3.34Å; I220-Y265 HydrophobicContact CB-CD1 4.34Å; I220-Y265 HydrophobicContact CD1-CD1 3.79Å; I220-Y265 HydrophobicContact CD1-CD2 4.11Å; I220-Y265 HydrophobicContact CD1-CE1 3.81Å; I220-Y265 HydrophobicContact CD1-CE2 4.13Å; I220-Y265 HydrophobicContact CD1-CG 3.95Å; I220-Y265 HydrophobicContact CG2-CD1 4.25Å; I220-Y265 HydrophobicContact CG2-CG 4.19Å; I220-I267 HydrophobicContact CG2-CD1 3.55Å
221	T	85.4	Confident	93.2	Very high	108 Å²	108	32.4 Å²	32.4	66%	0.663	18%	0.181	S	C	*	.			trans	-66.2	125.3	177.7	-63.4	0	0	0	0	109.8
222	P	87.2	Confident	93.3	Very high	33 Å²	33	32.5 Å²	32.5	21%	0.214	18%	0.182	C	C	.	.			trans	-63.1	138.2	177.4	-23.2	33.5	0	0	0	112.6	I151 W154 M215 I220	I151-P222 HydrophobicContact CD1-CB 4.46Å; I151-P222 HydrophobicContact CD1-CG 4Å; I151-P222 HydrophobicContact CG1-CB 4.08Å; I151-P222 HydrophobicContact CG1-CG 4.16Å; W154-P222 HydrophobicContact CE3-CB 4.41Å; W154-P222 HydrophobicContact CZ3-CB 4.34Å; W154-P222 WeakPolarHBondContact CZ3-O 2.86Å; M215-P222 HydrophobicContact CB-CB 4.28Å; M215-P222 HydrophobicContact CB-CG 4.39Å; I220-P222 WeakPolarHBondContact O-CD 3.34Å
223	G	91.2	Very high	93.3	Very high	12 Å²	12	33.4 Å²	33.4	12%	0.124	19%	0.189	C	C	.	.			trans	-164.4	-169.1	177.1	0	0	0	0	0	110.7	W154 M215 I225	W154-G223 VanDerWaalsContact CB-O 3.27Å; W154-G223 WeakPolarHBondContact CB-O 3.36Å; M215-G223 VanDerWaalsContact SD-O 3.39Å; G223-I225 PolarHBondContact O-N 3.25Å
224	P	94.3	Very high	93.5	Very high	94 Å²	94	33.4 Å²	33.4	61%	0.61	19%	0.189	S	C	*	.	P	Polyproline II helix	trans	-54.9	135.2	170.9	-22.1	32.8	0	0	0	111
225	I	97.1	Very high	93.7	Very high	25 Å²	25	33.2 Å²	33.2	13%	0.128	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-67.5	133.5	171.6	-61.5	177.2	0	0	0	107.8	L155 K188 Q208 G223 S227	L155-I225 HydrophobicContact CD2-CD1 3.67Å; L155-I225 HydrophobicContact CD2-CG1 3.6Å; K188-I225 HydrophobicContact CD-CD1 4.09Å; K188-I225 HydrophobicContact CG-CD1 4.42Å; Q208-I225 HydrophobicContact CB-CG2 3.72Å; Q208-I225 HydrophobicContact CG-CG2 3.66Å; G223-I225 PolarHBondContact O-N 3.25Å; I225-S227 PolarHBondContact O-N 3.12Å
226	P	98.2	Very high	94	Very high	12 Å²	12	34.3 Å²	34.3	8%	0.078	20%	0.195	C	C	.	.	P	Polyproline II helix	trans	-53.6	135.9	177.9	-27.9	36.2	0	0	0	112.4	Q208 I211 D230 I231 L264 Y265	Q208-P226 PolarHBondContact NE2-O 3.29Å; I211-P226 HydrophobicContact CD1-CG 4.05Å; P226-D230 HydrophobicContact CB-CB 3.92Å; P226-I231 HydrophobicContact CB-CG1 4.12Å; P226-L264 HydrophobicContact CB-CD1 4.39Å; P226-L264 HydrophobicContact CG-CD1 4.02Å; P226-Y265 WeakPolarHBondContact CD-OH 3.39Å; P226-Y265 WeakPolarHBondContact CG-OH 3.31Å
227	S	98.4	Very high	94.4	Very high	48 Å²	48	40.9 Å²	40.9	34%	0.336	22%	0.22	S	C	.	.	P	Polyproline II helix	trans	-69.2	165.5	172.4	70.3	0	0	0	0	111	I225 R229 D230 I231	I225-S227 PolarHBondContact O-N 3.12Å; S227-R229 PolarHBondContact O-N 2.92Å; S227-R229 PolarHBondContact OG-N 2.95Å; S227-D230 VanDerWaalsContact CB-OD2 3.3Å; S227-D230 WeakPolarHBondContact CB-OD2 3.42Å; S227-D230 PolarHBondContact N-OD2 3.05Å; S227-D230 PolarHBondContact O-N 2.93Å; S227-D230 VanDerWaalsContact O-N 3.09Å; S227-D230 PolarHBondContact OG-N 3.16Å; S227-D230 VanDerWaalsContact OG-N 3.12Å; S227-D230 PolarHBondContact OG-OD2 3.08Å; S227-I231 WeakPolarHBondContact O-CG1 3.37Å; S227-I231 PolarHBondContact O-N 3.49Å
228	L	98.6	Very high	94.9	Very high	11 Å²	11	44.7 Å²	44.7	6%	0.058	24%	0.237	C	C	.	.	H	α-helix	trans	-52.6	-40.1	172.2	-69.9	161.8	0	0	0	111.6	V195 D197 W200 Y204 I231 Q232	V195-L228 HydrophobicContact CB-CD1 3.79Å; V195-L228 HydrophobicContact CG1-CD1 3.51Å; V195-L228 HydrophobicContact CG2-CD1 4.23Å; D197-L228 HydrophobicContact CB-CD1 3.86Å; W200-L228 HydrophobicContact CH2-CB 4.47Å; W200-L228 HydrophobicContact CH2-CD1 4.04Å; W200-L228 HydrophobicContact CH2-CD2 4.5Å; W200-L228 HydrophobicContact CZ3-CD2 4.41Å; Y204-L228 HydrophobicContact CD1-CD2 3.58Å; Y204-L228 HydrophobicContact CD2-CD2 4.06Å; Y204-L228 HydrophobicContact CE1-CD2 4.4Å; Y204-L228 HydrophobicContact CG-CD2 3.37Å; L228-I231 PolarHBondContact O-N 3.2Å; L228-Q232 VanDerWaalsContact O-CG 3.31Å; L228-Q232 WeakPolarHBondContact O-CG 3.3Å; L228-Q232 PolarHBondContact O-N 2.81Å
229	R	98.3	Very high	95.6	Very high	166 Å²	166	46.9 Å²	46.9	63%	0.626	26%	0.259	S	S	*	.	H	α-helix	trans	-70	-37.5	178.4	-167.6	175.9	-177.1	160.9	1.6	112.7	S227 I231 Q232 A233 I246	S227-R229 PolarHBondContact O-N 2.92Å; S227-R229 PolarHBondContact OG-N 2.95Å; R229-I231 VanDerWaalsContact C-N 3.32Å; R229-Q232 PolarHBondContact O-N 3.1Å; R229-A233 WeakPolarHBondContact O-CB 3.4Å; R229-A233 PolarHBondContact O-N 3.45Å; R229-I246 HydrophobicContact CG-CG2 3.71Å
230	D	98.6	Very high	96.2	Very high	80 Å²	80	47.5 Å²	47.5	43%	0.428	26%	0.264	S	S	.	.	H	α-helix	trans	-64.7	-39.6	174.9	-61.4	-46	0	0	0	111.4	P226 S227 A233 S234	P226-D230 HydrophobicContact CB-CB 3.92Å; S227-D230 VanDerWaalsContact CB-OD2 3.3Å; S227-D230 WeakPolarHBondContact CB-OD2 3.42Å; S227-D230 PolarHBondContact N-OD2 3.05Å; S227-D230 PolarHBondContact O-N 2.93Å; S227-D230 VanDerWaalsContact O-N 3.09Å; S227-D230 PolarHBondContact OG-N 3.16Å; S227-D230 VanDerWaalsContact OG-N 3.12Å; S227-D230 PolarHBondContact OG-OD2 3.08Å; D230-A233 PolarHBondContact O-N 2.75Å; D230-S234 WeakPolarHBondContact O-CB 3.45Å; D230-S234 PolarHBondContact O-N 3.44Å
231	I	98.8	Very high	96.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-61.5	-48.8	174.6	-66.4	165.1	0	0	0	109.7	Y204 L207 Q208 P226 S227 L228 R229 A233 S234 I235 I252	Y204-I231 HydrophobicContact CD1-CB 3.89Å; Y204-I231 HydrophobicContact CD1-CD1 4.02Å; Y204-I231 HydrophobicContact CD1-CG2 3.5Å; Y204-I231 HydrophobicContact CE1-CB 4.18Å; Y204-I231 HydrophobicContact CE1-CG2 3.7Å; L207-I231 HydrophobicContact CD2-CD1 3.99Å; L207-I231 HydrophobicContact CD2-CG1 4Å; L207-I231 HydrophobicContact CD2-CG2 3.7Å; L207-I231 HydrophobicContact CG-CD1 4.47Å; Q208-I231 HydrophobicContact CG-CD1 4.05Å; P226-I231 HydrophobicContact CB-CG1 4.12Å; S227-I231 WeakPolarHBondContact O-CG1 3.37Å; S227-I231 PolarHBondContact O-N 3.49Å; L228-I231 PolarHBondContact O-N 3.2Å; R229-I231 VanDerWaalsContact C-N 3.32Å; I231-A233 VanDerWaalsContact C-N 3.34Å; I231-A233 PolarHBondContact O-N 2.87Å; I231-S234 VanDerWaalsContact O-CB 3.24Å; I231-S234 WeakPolarHBondContact O-CB 3.35Å; I231-S234 PolarHBondContact O-N 3.45Å; I231-S234 VanDerWaalsContact O-N 3.14Å; I231-I235 HydrophobicContact CG2-CD1 4.25Å; I231-I235 WeakPolarHBondContact O-CG1 3.48Å; I231-I235 PolarHBondContact O-N 2.92Å; I231-I235 VanDerWaalsContact O-N 3.1Å; I231-I252 HydrophobicContact CG2-CD1 4.13Å
232	Q	98.8	Very high	97.3	Very high	3 Å²	3	48.3 Å²	48.3	1%	0.014	27%	0.265	C	S	.	.	H	α-helix	trans	-59.5	-44.5	176.3	-67.7	167.4	-16.4	0	0	112.2	Y204 L228 R229 S234 I235 V236 F245 I246 S248	Y204-Q232 HydrophobicContact CE1-CG 3.83Å; Y204-Q232 PolarHBondContact OH-NE2 3.02Å; L228-Q232 VanDerWaalsContact O-CG 3.31Å; L228-Q232 WeakPolarHBondContact O-CG 3.3Å; L228-Q232 PolarHBondContact O-N 2.81Å; R229-Q232 PolarHBondContact O-N 3.1Å; Q232-S234 VanDerWaalsContact C-N 3.26Å; Q232-S234 PolarHBondContact O-N 2.75Å; Q232-I235 PolarHBondContact O-N 3.49Å; Q232-V236 WeakPolarHBondContact O-CG2 3.48Å; Q232-V236 PolarHBondContact O-N 3.4Å; Q232-V236 VanDerWaalsContact O-N 3.08Å; Q232-F245 HydrophobicContact CB-CD1 3.83Å; Q232-F245 HydrophobicContact CB-CE1 3.91Å; Q232-F245 HydrophobicContact CG-CD1 3.99Å; Q232-F245 HydrophobicContact CG-CE1 3.66Å; Q232-F245 HydrophobicContact CG-CZ 4.4Å; Q232-I246 HydrophobicContact CB-CG1 4.41Å; Q232-S248 PolarHBondContact NE2-O 3.03Å
233	A	98.7	Very high	97.8	Very high	19 Å²	19	55.3 Å²	55.3	16%	0.157	29%	0.293	C	S	.	.	H	α-helix	trans	-62.8	-34.8	177.3	0	0	0	0	0	112.1	R229 D230 I231 V236 R237 I246	R229-A233 WeakPolarHBondContact O-CB 3.4Å; R229-A233 PolarHBondContact O-N 3.45Å; D230-A233 PolarHBondContact O-N 2.75Å; I231-A233 VanDerWaalsContact C-N 3.34Å; I231-A233 PolarHBondContact O-N 2.87Å; A233-V236 PolarHBondContact O-N 3.11Å; A233-R237 WeakPolarHBondContact O-CG 3.41Å; A233-R237 PolarHBondContact O-N 3.08Å; A233-I246 HydrophobicContact CB-CD1 3.91Å; A233-I246 HydrophobicContact CB-CG1 4.3Å
234	S	98.7	Very high	98.2	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	32%	0.319	C	S	.	.	H	α-helix	trans	-61.2	-48.4	173.4	-168.9	0	0	0	0	112	D230 I231 Q232 V236 R237 F238 E263 L264	D230-S234 WeakPolarHBondContact O-CB 3.45Å; D230-S234 PolarHBondContact O-N 3.44Å; I231-S234 VanDerWaalsContact O-CB 3.24Å; I231-S234 WeakPolarHBondContact O-CB 3.35Å; I231-S234 PolarHBondContact O-N 3.45Å; I231-S234 VanDerWaalsContact O-N 3.14Å; Q232-S234 VanDerWaalsContact C-N 3.26Å; Q232-S234 PolarHBondContact O-N 2.75Å; S234-V236 VanDerWaalsContact C-N 3.29Å; S234-V236 PolarHBondContact O-N 3.13Å; S234-R237 PolarHBondContact O-N 2.87Å; S234-R237 VanDerWaalsContact O-N 3.15Å; S234-F238 PolarHBondContact O-N 2.71Å; S234-E263 WeakPolarHBondContact OG-CB 3.43Å; S234-E263 WeakPolarHBondContact OG-CG 3.08Å; S234-L264 WeakPolarHBondContact OG-CG 3.37Å
235	I	98.7	Very high	98.3	Very high	0 Å²	0	55 Å²	55	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-61.3	-40.1	178.9	-61.1	164.9	0	0	0	110.9	I231 Q232 F238 G239 D240 K241 F245 I252 E256 C260	I231-I235 HydrophobicContact CG2-CD1 4.25Å; I231-I235 WeakPolarHBondContact O-CG1 3.48Å; I231-I235 PolarHBondContact O-N 2.92Å; I231-I235 VanDerWaalsContact O-N 3.1Å; Q232-I235 PolarHBondContact O-N 3.49Å; I235-F238 PolarHBondContact O-N 3.29Å; I235-G239 PolarHBondContact O-N 2.97Å; I235-D240 HydrophobicContact CG2-CB 3.9Å; I235-D240 PolarHBondContact O-N 2.87Å; I235-K241 HydrophobicContact CG2-CB 4.01Å; I235-K241 HydrophobicContact CG2-CG 3.41Å; I235-K241 VanDerWaalsContact CG2-CG 3.41Å; I235-F245 HydrophobicContact CB-CE1 4.43Å; I235-F245 HydrophobicContact CD1-CE1 3.86Å; I235-F245 HydrophobicContact CD1-CZ 4.46Å; I235-I252 HydrophobicContact CD1-CD1 4.22Å; I235-I252 HydrophobicContact CD1-CG2 3.81Å; I235-E256 HydrophobicContact CD1-CB 3.89Å; I235-E256 HydrophobicContact CD1-CG 4.44Å; I235-E256 HydrophobicContact CG1-CB 4.31Å; I235-E256 HydrophobicContact CG2-CG 4.3Å; I235-C260 WeakPolarHBondContact CG1-SG 3.09Å
236	V	98.6	Very high	98.4	Very high	25 Å²	25	56.4 Å²	56.4	15%	0.152	30%	0.298	C	S	.	.	H	α-helix	trans	-65.8	-42.8	175.6	173.8	0	0	0	0	111.8	Q232 A233 S234 F238 G239 K241 P242 K243 F245 I246	Q232-V236 WeakPolarHBondContact O-CG2 3.48Å; Q232-V236 PolarHBondContact O-N 3.4Å; Q232-V236 VanDerWaalsContact O-N 3.08Å; A233-V236 PolarHBondContact O-N 3.11Å; S234-V236 VanDerWaalsContact C-N 3.29Å; S234-V236 PolarHBondContact O-N 3.13Å; V236-F238 VanDerWaalsContact C-N 3.32Å; V236-F238 PolarHBondContact O-N 3.31Å; V236-G239 PolarHBondContact O-N 3.3Å; V236-G239 VanDerWaalsContact O-N 3.08Å; V236-K241 HydrophobicContact CG2-CB 4.25Å; V236-P242 VanDerWaalsContact CG2-O 3.29Å; V236-P242 WeakPolarHBondContact CG2-O 3.39Å; V236-K243 HydrophobicContact CG1-CG 4.15Å; V236-F245 HydrophobicContact CG2-CB 4.02Å; V236-F245 HydrophobicContact CG2-CD1 4.37Å; V236-I246 HydrophobicContact CB-CD1 4.23Å; V236-I246 HydrophobicContact CB-CG1 4.4Å; V236-I246 HydrophobicContact CG1-CD1 4.38Å; V236-I246 HydrophobicContact CG2-CD1 4.16Å; V236-I246 HydrophobicContact CG2-CG1 3.82Å
237	R	98.5	Very high	98.4	Very high	139 Å²	139	58.4 Å²	58.4	53%	0.525	32%	0.321	S	S	.	.	H	α-helix	trans	-64.8	-36.6	176.7	-75.6	-167.3	-52.4	-85.8	-1.1	112.7	A233 S234 G239 E263	A233-R237 WeakPolarHBondContact O-CG 3.41Å; A233-R237 PolarHBondContact O-N 3.08Å; S234-R237 PolarHBondContact O-N 2.87Å; S234-R237 VanDerWaalsContact O-N 3.15Å; R237-G239 PolarHBondContact O-N 2.89Å; R237-E263 HydrophobicContact CB-CG 4.48Å; R237-E263 WeakPolarHBondContact CB-OE1 3.43Å; R237-E263 IonicContact CZ-OE1 3.65Å; R237-E263 IonicContact NE-OE1 3.69Å; R237-E263 PolarHBondContact NE-OE1 3.5Å; R237-E263 IonicContact NH2-OE1 3.89Å
238	F	97.7	Very high	98.4	Very high	81 Å²	81	57.2 Å²	57.2	36%	0.355	31%	0.313	S	S	.	.	H	α-helix	trans	-63.6	-21.6	173.8	-166.6	-92.7	0	0	0	112.4	S234 I235 V236 Y259 Q262 E263	S234-F238 PolarHBondContact O-N 2.71Å; I235-F238 PolarHBondContact O-N 3.29Å; V236-F238 VanDerWaalsContact C-N 3.32Å; V236-F238 PolarHBondContact O-N 3.31Å; F238-Y259 AromaticContact CD1-CD1 3.95Å; F238-Y259 HydrophobicContact CD1-CD1 3.95Å; F238-Y259 AromaticContact CD1-CD2 3.83Å; F238-Y259 HydrophobicContact CD1-CD2 3.83Å; F238-Y259 HydrophobicContact CD1-CE1 4.48Å; F238-Y259 HydrophobicContact CD1-CE2 4.38Å; F238-Y259 AromaticContact CD1-CG 3.58Å; F238-Y259 HydrophobicContact CD1-CG 3.58Å; F238-Y259 AromaticContact CE1-CD1 3.29Å; F238-Y259 HydrophobicContact CE1-CD1 3.29Å; F238-Y259 AromaticContact CE1-CD2 3.9Å; F238-Y259 HydrophobicContact CE1-CD2 3.9Å; F238-Y259 AromaticContact CE1-CE1 3.6Å; F238-Y259 HydrophobicContact CE1-CE1 3.6Å; F238-Y259 HydrophobicContact CE1-CE2 4.17Å; F238-Y259 AromaticContact CE1-CG 3.45Å; F238-Y259 HydrophobicContact CE1-CG 3.45Å; F238-Y259 VanDerWaalsContact CE1-CG 3.45Å; F238-Y259 HydrophobicContact CE2-CD1 4.35Å; F238-Y259 HydrophobicContact CG-CG 4.24Å; F238-Y259 AromaticContact CZ-CD1 3.53Å; F238-Y259 HydrophobicContact CZ-CD1 3.53Å; F238-Y259 AromaticContact CZ-CE1 4Å; F238-Y259 HydrophobicContact CZ-CE1 4Å; F238-Y259 HydrophobicContact CZ-CG 4Å; F238-Q262 HydrophobicContact CE2-CB 4.3Å; F238-Q262 HydrophobicContact CE2-CG 4.06Å; F238-E263 HydrophobicContact CB-CB 4.47Å; F238-E263 HydrophobicContact CD2-CB 4.11Å
239	G	97.7	Very high	98.3	Very high	64 Å²	64	60.9 Å²	60.9	66%	0.66	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	99	10.4	175	0	0	0	0	0	115.2	I235 V236 R237	I235-G239 PolarHBondContact O-N 2.97Å; V236-G239 PolarHBondContact O-N 3.3Å; V236-G239 VanDerWaalsContact O-N 3.08Å; R237-G239 PolarHBondContact O-N 2.89Å
240	D	98.2	Very high	98.3	Very high	59 Å²	59	58.1 Å²	58.1	32%	0.316	33%	0.332	S	S	.	.	S	Bend	trans	-88.6	-28.9	-173.7	179.6	71.9	0	0	0	113.9	I235 E256 Y259	I235-D240 HydrophobicContact CG2-CB 3.9Å; I235-D240 PolarHBondContact O-N 2.87Å; D240-E256 WeakPolarHBondContact OD2-CG 3.35Å; D240-Y259 HydrophobicContact CB-CD2 3.94Å; D240-Y259 HydrophobicContact CB-CE2 4.04Å; D240-Y259 WeakPolarHBondContact OD1-CE2 3.23Å
241	K	98.1	Very high	98.2	Very high	62 Å²	62	60.8 Å²	60.8	27%	0.27	34%	0.336	S	S	.	.	S	Bend	trans	-128.7	153.8	-177.5	-60.1	-72.4	173.2	164.7	0	111.8	I235 V236 F245 E256	I235-K241 HydrophobicContact CG2-CB 4.01Å; I235-K241 HydrophobicContact CG2-CG 3.41Å; I235-K241 VanDerWaalsContact CG2-CG 3.41Å; V236-K241 HydrophobicContact CG2-CB 4.25Å; K241-F245 HydrophobicContact CB-CB 3.79Å; K241-F245 HydrophobicContact CB-CD1 3.96Å; K241-F245 HydrophobicContact CB-CD2 4.19Å; K241-F245 HydrophobicContact CB-CG 3.72Å; K241-F245 HydrophobicContact CD-CD2 4.23Å; K241-F245 HydrophobicContact CD-CE2 4.32Å; K241-F245 HydrophobicContact CG-CD1 4.09Å; K241-F245 HydrophobicContact CG-CD2 4.12Å; K241-F245 HydrophobicContact CG-CE1 4.31Å; K241-F245 HydrophobicContact CG-CE2 4.34Å; K241-F245 HydrophobicContact CG-CG 4.02Å; K241-F245 HydrophobicContact CG-CZ 4.45Å; K241-E256 VanDerWaalsContact CE-OE1 3.3Å; K241-E256 WeakPolarHBondContact CE-OE1 3.16Å; K241-E256 IonicContact NZ-OE1 2.87Å; K241-E256 PolarHBondContact NZ-OE1 3.47Å
242	P	98.2	Very high	98.1	Very high	81 Å²	81	61 Å²	61	53%	0.526	34%	0.338	S	S	.	.			trans	-70	161.1	176.3	30.6	-36.8	0	0	0	112	V236 S244 F245	V236-P242 VanDerWaalsContact CG2-O 3.29Å; V236-P242 WeakPolarHBondContact CG2-O 3.39Å; P242-S244 PolarHBondContact O-N 3.05Å; P242-S244 VanDerWaalsContact O-N 3.09Å; P242-F245 WeakPolarHBondContact O-CB 3.13Å; P242-F245 PolarHBondContact O-N 2.83Å
243	K	98.4	Very high	98	Very high	180 Å²	180	61.6 Å²	61.6	78%	0.783	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-55.4	-30	178.1	-69	-176.7	179.4	178.3	0	114	V236 F245 I246	V236-K243 HydrophobicContact CG1-CG 4.15Å; K243-F245 PolarHBondContact O-N 2.79Å; K243-I246 PolarHBondContact O-N 3.28Å
244	S	98.4	Very high	98	Very high	97 Å²	97	60.8 Å²	60.8	68%	0.678	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-65.2	-13.6	176.1	51.5	0	0	0	0	114	P242 I246	P242-S244 PolarHBondContact O-N 3.05Å; P242-S244 VanDerWaalsContact O-N 3.09Å; S244-I246 VanDerWaalsContact C-N 3.27Å; S244-I246 PolarHBondContact O-N 3.42Å
245	F	98.5	Very high	97.9	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.009	36%	0.356	C	S	.	.	G	3₁₀ helix	trans	-66	-30.3	174.6	-172	-108.4	0	0	0	112.6	Y204 Q232 I235 V236 K241 P242 K243 G247 S248 Q250 I252	Y204-F245 WeakPolarHBondContact OH-CZ 3.34Å; Q232-F245 HydrophobicContact CB-CD1 3.83Å; Q232-F245 HydrophobicContact CB-CE1 3.91Å; Q232-F245 HydrophobicContact CG-CD1 3.99Å; Q232-F245 HydrophobicContact CG-CE1 3.66Å; Q232-F245 HydrophobicContact CG-CZ 4.4Å; I235-F245 HydrophobicContact CB-CE1 4.43Å; I235-F245 HydrophobicContact CD1-CE1 3.86Å; I235-F245 HydrophobicContact CD1-CZ 4.46Å; V236-F245 HydrophobicContact CG2-CB 4.02Å; V236-F245 HydrophobicContact CG2-CD1 4.37Å; K241-F245 HydrophobicContact CB-CB 3.79Å; K241-F245 HydrophobicContact CB-CD1 3.96Å; K241-F245 HydrophobicContact CB-CD2 4.19Å; K241-F245 HydrophobicContact CB-CG 3.72Å; K241-F245 HydrophobicContact CD-CD2 4.23Å; K241-F245 HydrophobicContact CD-CE2 4.32Å; K241-F245 HydrophobicContact CG-CD1 4.09Å; K241-F245 HydrophobicContact CG-CD2 4.12Å; K241-F245 HydrophobicContact CG-CE1 4.31Å; K241-F245 HydrophobicContact CG-CE2 4.34Å; K241-F245 HydrophobicContact CG-CG 4.02Å; K241-F245 HydrophobicContact CG-CZ 4.45Å; P242-F245 WeakPolarHBondContact O-CB 3.13Å; P242-F245 PolarHBondContact O-N 2.83Å; K243-F245 PolarHBondContact O-N 2.79Å; F245-G247 PolarHBondContact O-N 3.27Å; F245-S248 VanDerWaalsContact O-CB 3.23Å; F245-S248 WeakPolarHBondContact O-CB 3.42Å; F245-S248 PolarHBondContact O-N 3.12Å; F245-S248 VanDerWaalsContact O-N 3.11Å; F245-S248 PolarHBondContact O-OG 2.76Å; F245-Q250 HydrophobicContact CD2-CB 4.21Å; F245-Q250 HydrophobicContact CE2-CB 3.56Å; F245-Q250 HydrophobicContact CE2-CG 4.42Å; F245-Q250 HydrophobicContact CZ-CB 4.42Å; F245-I252 HydrophobicContact CE1-CG2 4.27Å; F245-I252 HydrophobicContact CZ-CG2 3.59Å
246	I	98.6	Very high	97.9	Very high	55 Å²	55	65.5 Å²	65.5	28%	0.282	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.9	124.2	179.3	-56.7	172.8	0	0	0	109.4	R229 Q232 A233 V236 K243 S244 S248	R229-I246 HydrophobicContact CG-CG2 3.71Å; Q232-I246 HydrophobicContact CB-CG1 4.41Å; A233-I246 HydrophobicContact CB-CD1 3.91Å; A233-I246 HydrophobicContact CB-CG1 4.3Å; V236-I246 HydrophobicContact CB-CD1 4.23Å; V236-I246 HydrophobicContact CB-CG1 4.4Å; V236-I246 HydrophobicContact CG1-CD1 4.38Å; V236-I246 HydrophobicContact CG2-CD1 4.16Å; V236-I246 HydrophobicContact CG2-CG1 3.82Å; K243-I246 PolarHBondContact O-N 3.28Å; S244-I246 VanDerWaalsContact C-N 3.27Å; S244-I246 PolarHBondContact O-N 3.42Å; I246-S248 VanDerWaalsContact C-N 3.3Å
247	G	97.8	Very high	97.9	Very high	55 Å²	55	64.3 Å²	64.3	57%	0.567	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	1.7	-174.9	0	0	0	0	0	114.1	F245	F245-G247 PolarHBondContact O-N 3.27Å
248	S	98	Very high	97.9	Very high	23 Å²	23	58.3 Å²	58.3	16%	0.161	33%	0.334	C	S	.	.			trans	-76.1	166.6	173.6	77.4	0	0	0	0	112.1	Q232 F245 I246 Q250	Q232-S248 PolarHBondContact NE2-O 3.03Å; F245-S248 VanDerWaalsContact O-CB 3.23Å; F245-S248 WeakPolarHBondContact O-CB 3.42Å; F245-S248 PolarHBondContact O-N 3.12Å; F245-S248 VanDerWaalsContact O-N 3.11Å; F245-S248 PolarHBondContact O-OG 2.76Å; I246-S248 VanDerWaalsContact C-N 3.3Å; S248-Q250 PolarHBondContact OG-N 2.69Å
249	C	97.7	Very high	97.9	Very high	88 Å²	88	57.1 Å²	57.1	60%	0.595	33%	0.327	S	S	*	.			trans	-102.9	32	170	-58.8	0	0	0	0	111.8	W200	W200-C249 WeakPolarHBondContact CB-O 3.48Å; W200-C249 HydrophobicContact CD2-CB 3.82Å; W200-C249 HydrophobicContact CE3-CB 4.4Å; W200-C249 HydrophobicContact CG-CB 3.97Å; W200-C249 HydrophobicContact CZ2-CB 4.28Å
250	Q	97.2	Very high	97.9	Very high	107 Å²	107	54.1 Å²	54.1	50%	0.5	30%	0.296	S	S	.	.			trans	-81.1	137.6	-179.8	-67.9	-174.5	-72.3	0	0	111.2	Y204 F245 S248	Y204-Q250 WeakPolarHBondContact CE2-O 3.34Å; Y204-Q250 PolarHBondContact OH-O 3.5Å; F245-Q250 HydrophobicContact CD2-CB 4.21Å; F245-Q250 HydrophobicContact CE2-CB 3.56Å; F245-Q250 HydrophobicContact CE2-CG 4.42Å; F245-Q250 HydrophobicContact CZ-CB 4.42Å; S248-Q250 PolarHBondContact OG-N 2.69Å
251	W	96	Very high	97.9	Very high	136 Å²	136	51.3 Å²	51.3	52%	0.515	28%	0.281	S	S	.	.			trans	-70.9	158	173.2	62.7	-91	0	0	0	111.2
252	I	97.5	Very high	97.9	Very high	6 Å²	6	51.3 Å²	51.3	3%	0.031	28%	0.282	C	S	.	.			trans	-127	159.5	175.9	64	175.3	0	0	0	110.3	A203 Y204 I231 I235 F245 E256 V257	A203-I252 HydrophobicContact CB-CD1 4.37Å; A203-I252 HydrophobicContact CB-CG1 3.56Å; A203-I252 WeakPolarHBondContact CB-O 3.23Å; Y204-I252 HydrophobicContact CD1-CD1 3.89Å; Y204-I252 HydrophobicContact CD2-CD1 4.1Å; Y204-I252 HydrophobicContact CD2-CG1 3.97Å; Y204-I252 HydrophobicContact CE1-CD1 3.91Å; Y204-I252 HydrophobicContact CE1-CG1 4.47Å; Y204-I252 HydrophobicContact CE1-CG2 4.36Å; Y204-I252 HydrophobicContact CE2-CB 4.43Å; Y204-I252 HydrophobicContact CE2-CD1 4.15Å; Y204-I252 HydrophobicContact CE2-CG1 3.84Å; Y204-I252 HydrophobicContact CE2-CG2 4.04Å; Y204-I252 HydrophobicContact CG-CD1 3.99Å; Y204-I252 HydrophobicContact CG-CG1 4.37Å; Y204-I252 WeakPolarHBondContact OH-CG2 3.25Å; I231-I252 HydrophobicContact CG2-CD1 4.13Å; I235-I252 HydrophobicContact CD1-CD1 4.22Å; I235-I252 HydrophobicContact CD1-CG2 3.81Å; F245-I252 HydrophobicContact CE1-CG2 4.27Å; F245-I252 HydrophobicContact CZ-CG2 3.59Å; I252-E256 HydrophobicContact CB-CB 3.94Å; I252-E256 HydrophobicContact CB-CG 4.4Å; I252-E256 HydrophobicContact CG2-CB 4.31Å; I252-V257 HydrophobicContact CD1-CG2 4.13Å
253	G	97	Very high	97.9	Very high	14 Å²	14	50.9 Å²	50.9	14%	0.144	27%	0.273	C	S	.	.			trans	-108.9	-172.8	177.7	0	0	0	0	0	113.6	L255 E256 V257	G253-L255 PolarHBondContact O-N 2.92Å; G253-E256 WeakPolarHBondContact CA-OE2 3.49Å; G253-E256 PolarHBondContact N-OE2 2.84Å; G253-E256 PolarHBondContact O-N 2.78Å; G253-V257 WeakPolarHBondContact O-CG2 3.5Å; G253-V257 PolarHBondContact O-N 2.82Å; G253-V257 VanDerWaalsContact O-N 3.1Å
254	S	97.6	Very high	97.9	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.021	25%	0.248	C	C	.	.	H	α-helix	trans	-63.1	-28	178.6	-49.7	0	0	0	0	113.1	S258 M300 G302 N368	S254-S258 PolarHBondContact O-N 3.26Å; S254-S258 VanDerWaalsContact O-N 3.11Å; S254-M300 PolarHBondContact OG-SD 2.9Å; S254-G302 PolarHBondContact OG-N 3.34Å; S254-N368 PolarHBondContact OG-O 3.21Å
255	L	97.3	Very high	97.8	Very high	74 Å²	74	43 Å²	43	39%	0.387	23%	0.227	S	C	.	.	H	α-helix	trans	-69.6	-52.1	178.1	-173.4	62.9	0	0	0	110.7	G253 V257 S258 Y259 L271	G253-L255 PolarHBondContact O-N 2.92Å; L255-V257 VanDerWaalsContact C-N 3.27Å; L255-V257 PolarHBondContact O-N 3.4Å; L255-S258 WeakPolarHBondContact O-CA 3.46Å; L255-S258 WeakPolarHBondContact O-CB 3.39Å; L255-S258 PolarHBondContact O-N 3.32Å; L255-S258 PolarHBondContact O-OG 2.83Å; L255-Y259 HydrophobicContact CD1-CE1 3.79Å; L255-Y259 HydrophobicContact CD1-CE2 4.35Å; L255-Y259 WeakPolarHBondContact CD1-OH 3.39Å; L255-Y259 HydrophobicContact CD2-CE2 4.14Å; L255-Y259 WeakPolarHBondContact CD2-OH 3.49Å; L255-Y259 HydrophobicContact CG-CD2 4.49Å; L255-Y259 HydrophobicContact CG-CE1 4.07Å; L255-Y259 HydrophobicContact CG-CE2 3.72Å; L255-Y259 VanDerWaalsContact CG-CZ 3.48Å; L255-Y259 WeakPolarHBondContact CG-OH 3.48Å; L255-Y259 PolarHBondContact O-N 3.46Å; L255-L271 HydrophobicContact CD1-CD1 3.56Å
256	E	98.4	Very high	97.6	Very high	24 Å²	24	48.6 Å²	48.6	11%	0.112	26%	0.257	C	S	.	.	H	α-helix	trans	-62.7	-33.8	176.1	-65.6	96.8	152	0	0	112.4	I235 D240 K241 I252 G253 S258 Y259 C260	I235-E256 HydrophobicContact CD1-CB 3.89Å; I235-E256 HydrophobicContact CD1-CG 4.44Å; I235-E256 HydrophobicContact CG1-CB 4.31Å; I235-E256 HydrophobicContact CG2-CG 4.3Å; D240-E256 WeakPolarHBondContact OD2-CG 3.35Å; K241-E256 VanDerWaalsContact CE-OE1 3.3Å; K241-E256 WeakPolarHBondContact CE-OE1 3.16Å; K241-E256 IonicContact NZ-OE1 2.87Å; K241-E256 PolarHBondContact NZ-OE1 3.47Å; I252-E256 HydrophobicContact CB-CB 3.94Å; I252-E256 HydrophobicContact CB-CG 4.4Å; I252-E256 HydrophobicContact CG2-CB 4.31Å; G253-E256 WeakPolarHBondContact CA-OE2 3.49Å; G253-E256 PolarHBondContact N-OE2 2.84Å; G253-E256 PolarHBondContact O-N 2.78Å; E256-S258 VanDerWaalsContact C-N 3.31Å; E256-S258 PolarHBondContact O-N 3.47Å; E256-Y259 PolarHBondContact O-N 3.44Å; E256-C260 PolarHBondContact O-N 3.3Å; E256-C260 PolarHBondContact O-SG 3.33Å
257	V	98.6	Very high	97.5	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.4	-43.5	170.8	165.5	0	0	0	0	111.1	L207 L210 I252 G253 L255 C260 L261 M300 C370	L207-V257 HydrophobicContact CB-CG1 4.27Å; L207-V257 HydrophobicContact CB-CG2 4.12Å; L207-V257 HydrophobicContact CD1-CG1 4Å; L210-V257 HydrophobicContact CD2-CG1 4.48Å; I252-V257 HydrophobicContact CD1-CG2 4.13Å; G253-V257 WeakPolarHBondContact O-CG2 3.5Å; G253-V257 PolarHBondContact O-N 2.82Å; G253-V257 VanDerWaalsContact O-N 3.1Å; L255-V257 VanDerWaalsContact C-N 3.27Å; L255-V257 PolarHBondContact O-N 3.4Å; V257-C260 PolarHBondContact O-N 3.22Å; V257-L261 HydrophobicContact CG1-CD1 4.28Å; V257-L261 PolarHBondContact O-N 3.23Å; V257-M300 HydrophobicContact CG1-CB 4.37Å; V257-M300 HydrophobicContact CG1-CG 4.48Å; V257-M300 HydrophobicContact CG2-CE 3.94Å; V257-M300 HydrophobicContact CG2-CG 4.38Å; V257-C370 HydrophobicContact CG1-CB 4.29Å
258	S	98.4	Very high	97.4	Very high	14 Å²	14	51.6 Å²	51.6	10%	0.098	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-38.8	176.8	78.5	0	0	0	0	112.5	S254 L255 E256 C260 L261 Q262	S254-S258 PolarHBondContact O-N 3.26Å; S254-S258 VanDerWaalsContact O-N 3.11Å; L255-S258 WeakPolarHBondContact O-CA 3.46Å; L255-S258 WeakPolarHBondContact O-CB 3.39Å; L255-S258 PolarHBondContact O-N 3.32Å; L255-S258 PolarHBondContact O-OG 2.83Å; E256-S258 VanDerWaalsContact C-N 3.31Å; E256-S258 PolarHBondContact O-N 3.47Å; S258-C260 VanDerWaalsContact C-N 3.35Å; S258-C260 PolarHBondContact O-N 2.94Å; S258-L261 PolarHBondContact O-N 3.16Å; S258-Q262 PolarHBondContact O-N 2.88Å
259	Y	98.5	Very high	97.4	Very high	56 Å²	56	51.5 Å²	51.5	22%	0.22	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-41.6	175.2	-61.5	-21.3	0	0	0	111.8	F238 D240 L255 E256 L261 Q262 E263	F238-Y259 AromaticContact CD1-CD1 3.95Å; F238-Y259 HydrophobicContact CD1-CD1 3.95Å; F238-Y259 AromaticContact CD1-CD2 3.83Å; F238-Y259 HydrophobicContact CD1-CD2 3.83Å; F238-Y259 HydrophobicContact CD1-CE1 4.48Å; F238-Y259 HydrophobicContact CD1-CE2 4.38Å; F238-Y259 AromaticContact CD1-CG 3.58Å; F238-Y259 HydrophobicContact CD1-CG 3.58Å; F238-Y259 AromaticContact CE1-CD1 3.29Å; F238-Y259 HydrophobicContact CE1-CD1 3.29Å; F238-Y259 AromaticContact CE1-CD2 3.9Å; F238-Y259 HydrophobicContact CE1-CD2 3.9Å; F238-Y259 AromaticContact CE1-CE1 3.6Å; F238-Y259 HydrophobicContact CE1-CE1 3.6Å; F238-Y259 HydrophobicContact CE1-CE2 4.17Å; F238-Y259 AromaticContact CE1-CG 3.45Å; F238-Y259 HydrophobicContact CE1-CG 3.45Å; F238-Y259 VanDerWaalsContact CE1-CG 3.45Å; F238-Y259 HydrophobicContact CE2-CD1 4.35Å; F238-Y259 HydrophobicContact CG-CG 4.24Å; F238-Y259 AromaticContact CZ-CD1 3.53Å; F238-Y259 HydrophobicContact CZ-CD1 3.53Å; F238-Y259 AromaticContact CZ-CE1 4Å; F238-Y259 HydrophobicContact CZ-CE1 4Å; F238-Y259 HydrophobicContact CZ-CG 4Å; D240-Y259 HydrophobicContact CB-CD2 3.94Å; D240-Y259 HydrophobicContact CB-CE2 4.04Å; D240-Y259 WeakPolarHBondContact OD1-CE2 3.23Å; L255-Y259 HydrophobicContact CD1-CE1 3.79Å; L255-Y259 HydrophobicContact CD1-CE2 4.35Å; L255-Y259 WeakPolarHBondContact CD1-OH 3.39Å; L255-Y259 HydrophobicContact CD2-CE2 4.14Å; L255-Y259 WeakPolarHBondContact CD2-OH 3.49Å; L255-Y259 HydrophobicContact CG-CD2 4.49Å; L255-Y259 HydrophobicContact CG-CE1 4.07Å; L255-Y259 HydrophobicContact CG-CE2 3.72Å; L255-Y259 VanDerWaalsContact CG-CZ 3.48Å; L255-Y259 WeakPolarHBondContact CG-OH 3.48Å; L255-Y259 PolarHBondContact O-N 3.46Å; E256-Y259 PolarHBondContact O-N 3.44Å; Y259-L261 PolarHBondContact O-N 3.35Å; Y259-Q262 PolarHBondContact O-N 3.23Å; Y259-E263 VanDerWaalsContact O-CB 3.31Å; Y259-E263 WeakPolarHBondContact O-CB 3.39Å; Y259-E263 PolarHBondContact O-N 2.68Å
260	C	98.5	Very high	97.3	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-43.7	176.4	-68.3	0	0	0	0	112.6	L207 I235 E256 V257 S258 Q262 L264	L207-C260 HydrophobicContact CD1-CB 4.47Å; L207-C260 HydrophobicContact CD2-CB 3.62Å; I235-C260 WeakPolarHBondContact CG1-SG 3.09Å; E256-C260 PolarHBondContact O-N 3.3Å; E256-C260 PolarHBondContact O-SG 3.33Å; V257-C260 PolarHBondContact O-N 3.22Å; S258-C260 VanDerWaalsContact C-N 3.35Å; S258-C260 PolarHBondContact O-N 2.94Å; C260-Q262 VanDerWaalsContact C-N 3.31Å; C260-L264 VanDerWaalsContact O-CB 3.27Å; C260-L264 WeakPolarHBondContact O-CB 3.25Å; C260-L264 VanDerWaalsContact O-CG 3.31Å; C260-L264 WeakPolarHBondContact O-CG 3.35Å; C260-L264 PolarHBondContact O-N 3.2Å
261	L	98.3	Very high	97.4	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-66.7	-35.7	179.4	-72.9	166.8	0	0	0	111.6	L207 L210 I211 L214 V257 S258 Y259 Y265 N266 I267 C269 L372	L207-L261 HydrophobicContact CD1-CD1 4.04Å; L207-L261 HydrophobicContact CD1-CD2 3.79Å; L207-L261 HydrophobicContact CD1-CG 3.64Å; L210-L261 HydrophobicContact CD2-CD1 4.21Å; I211-L261 HydrophobicContact CG1-CD2 3.85Å; L214-L261 HydrophobicContact CD1-CD2 3.83Å; V257-L261 HydrophobicContact CG1-CD1 4.28Å; V257-L261 PolarHBondContact O-N 3.23Å; S258-L261 PolarHBondContact O-N 3.16Å; Y259-L261 PolarHBondContact O-N 3.35Å; L261-Y265 HydrophobicContact CD2-CD2 4.4Å; L261-Y265 PolarHBondContact O-N 3.29Å; L261-N266 PolarHBondContact O-N 2.8Å; L261-I267 CarbonylContact C-O 3.45Å; L261-I267 HydrophobicContact CB-CB 4.35Å; L261-I267 PolarHBondContact O-N 3.32Å; L261-I267 VanDerWaalsContact O-N 3.11Å; L261-C269 WeakPolarHBondContact CD1-SG 3.39Å; L261-L372 HydrophobicContact CD1-CD2 3.79Å
262	Q	97.8	Very high	97.5	Very high	63 Å²	63	48.9 Å²	48.9	29%	0.294	24%	0.235	S	C	.	.	H	α-helix	trans	-68.6	-50.6	174.1	-177.4	58	28.3	0	0	111.9	F238 S258 Y259 C260 N266 I267	F238-Q262 HydrophobicContact CE2-CB 4.3Å; F238-Q262 HydrophobicContact CE2-CG 4.06Å; S258-Q262 PolarHBondContact O-N 2.88Å; Y259-Q262 PolarHBondContact O-N 3.23Å; C260-Q262 VanDerWaalsContact C-N 3.31Å; Q262-N266 PolarHBondContact NE2-OD1 2.96Å; Q262-N266 WeakPolarHBondContact O-CA 3.45Å; Q262-N266 PolarHBondContact O-N 3.26Å; Q262-I267 PolarHBondContact N-O 2.98Å
263	E	98	Very high	97.5	Very high	72 Å²	72	53.6 Å²	53.6	34%	0.336	26%	0.257	S	S	.	.	H	α-helix	trans	-66.5	-43.9	-177.2	173	61.5	-169.3	0	0	112.9	S234 R237 F238 Y259	S234-E263 WeakPolarHBondContact OG-CB 3.43Å; S234-E263 WeakPolarHBondContact OG-CG 3.08Å; R237-E263 HydrophobicContact CB-CG 4.48Å; R237-E263 WeakPolarHBondContact CB-OE1 3.43Å; R237-E263 IonicContact CZ-OE1 3.65Å; R237-E263 IonicContact NE-OE1 3.69Å; R237-E263 PolarHBondContact NE-OE1 3.5Å; R237-E263 IonicContact NH2-OE1 3.89Å; F238-E263 HydrophobicContact CB-CB 4.47Å; F238-E263 HydrophobicContact CD2-CB 4.11Å; Y259-E263 VanDerWaalsContact O-CB 3.31Å; Y259-E263 WeakPolarHBondContact O-CB 3.39Å; Y259-E263 PolarHBondContact O-N 2.68Å
264	L	97.4	Very high	97.5	Very high	49 Å²	49	53 Å²	53	26%	0.257	25%	0.25	S	C	.	.	H	α-helix	trans	-80.1	-33	-175.4	-65.3	173.5	0	0	0	113	P226 S234 C260	P226-L264 HydrophobicContact CB-CD1 4.39Å; P226-L264 HydrophobicContact CG-CD1 4.02Å; S234-L264 WeakPolarHBondContact OG-CG 3.37Å; C260-L264 VanDerWaalsContact O-CB 3.27Å; C260-L264 WeakPolarHBondContact O-CB 3.25Å; C260-L264 VanDerWaalsContact O-CG 3.31Å; C260-L264 WeakPolarHBondContact O-CG 3.35Å; C260-L264 PolarHBondContact O-N 3.2Å
265	Y	96.1	Very high	97.5	Very high	61 Å²	61	55.7 Å²	55.7	24%	0.239	27%	0.268	C	S	.	.	H	α-helix	trans	-136.8	1.9	-165.2	-55.8	-61.5	0	0	0	114.7	I211 I220 P226 L261 I267	I211-Y265 HydrophobicContact CB-CE2 4.48Å; I211-Y265 HydrophobicContact CD1-CE2 3.87Å; I211-Y265 HydrophobicContact CG1-CD2 4.48Å; I211-Y265 HydrophobicContact CG1-CE2 3.82Å; I211-Y265 HydrophobicContact CG2-CE2 3.86Å; I220-Y265 HydrophobicContact CB-CD1 4.34Å; I220-Y265 HydrophobicContact CD1-CD1 3.79Å; I220-Y265 HydrophobicContact CD1-CD2 4.11Å; I220-Y265 HydrophobicContact CD1-CE1 3.81Å; I220-Y265 HydrophobicContact CD1-CE2 4.13Å; I220-Y265 HydrophobicContact CD1-CG 3.95Å; I220-Y265 HydrophobicContact CG2-CD1 4.25Å; I220-Y265 HydrophobicContact CG2-CG 4.19Å; P226-Y265 WeakPolarHBondContact CD-OH 3.39Å; P226-Y265 WeakPolarHBondContact CG-OH 3.31Å; L261-Y265 HydrophobicContact CD2-CD2 4.4Å; L261-Y265 PolarHBondContact O-N 3.29Å; Y265-I267 VanDerWaalsContact C-N 3.26Å; Y265-I267 PolarHBondContact O-N 3.05Å
266	N	95.6	Very high	97.4	Very high	121 Å²	121	56 Å²	56	65%	0.647	27%	0.267	S	S	*	.			trans	53.7	43.2	-174.6	-165.8	29.5	0	0	0	112.5	L261 Q262	L261-N266 PolarHBondContact O-N 2.8Å; Q262-N266 PolarHBondContact NE2-OD1 2.96Å; Q262-N266 WeakPolarHBondContact O-CA 3.45Å; Q262-N266 PolarHBondContact O-N 3.26Å
267	I	95.5	Very high	97.3	Very high	15 Å²	15	54.9 Å²	54.9	8%	0.077	26%	0.262	C	S	.	.			trans	-107.9	110.5	177.2	-68.5	174.1	0	0	0	109.7	L214 I220 L261 Q262 Y265 L372 P373	L214-I267 HydrophobicContact CD1-CD1 3.39Å; L214-I267 HydrophobicContact CD2-CD1 3.71Å; L214-I267 HydrophobicContact CG-CD1 4.07Å; I220-I267 HydrophobicContact CG2-CD1 3.55Å; L261-I267 CarbonylContact C-O 3.45Å; L261-I267 HydrophobicContact CB-CB 4.35Å; L261-I267 PolarHBondContact O-N 3.32Å; L261-I267 VanDerWaalsContact O-N 3.11Å; Q262-I267 PolarHBondContact N-O 2.98Å; Y265-I267 VanDerWaalsContact C-N 3.26Å; Y265-I267 PolarHBondContact O-N 3.05Å; I267-L372 HydrophobicContact CG2-CD2 4.32Å; I267-P373 HydrophobicContact CG2-CG 3.91Å
268	Q	95.8	Very high	97	Very high	158 Å²	158	58.9 Å²	58.9	74%	0.738	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-81.6	120.4	174.1	-169.1	177.1	-5.2	0	0	110.4
269	C	97.4	Very high	96.9	Very high	20 Å²	20	60.3 Å²	60.3	14%	0.135	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-95.3	153.3	177.7	-60.8	0	0	0	0	111.4	L261 C370 L371	L261-C269 WeakPolarHBondContact CD1-SG 3.39Å; C269-C370 VanDerWaalsContact CB-SG 3.53Å; C269-L371 WeakPolarHBondContact CA-O 3.12Å; C269-L371 WeakPolarHBondContact CB-O 2.97Å
270	R	97.5	Very high	96.7	Very high	170 Å²	170	57.7 Å²	57.7	64%	0.642	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.1	131.1	167.3	178	176.9	174.9	163.8	-1.3	109.1	L371	R270-L371 HydrophobicContact CB-CB 4.32Å; R270-L371 PolarHBondContact N-O 3.04Å; R270-L371 PolarHBondContact O-N 2.98Å
271	L	97.9	Very high	96.5	Very high	76 Å²	76	58.5 Å²	58.5	40%	0.398	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	133.8	171.8	-64.4	172.9	0	0	0	109.9	L255 L369 C370	L255-L271 HydrophobicContact CD1-CD1 3.56Å; L271-L369 CarbonylContact C-O 3.39Å; L271-L369 VanDerWaalsContact CA-O 3.32Å; L271-L369 WeakPolarHBondContact CA-O 3.31Å; L271-C370 HydrophobicContact CD2-CB 3.98Å
272	L	98.1	Very high	96.2	Very high	31 Å²	31	65.5 Å²	65.5	16%	0.162	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	116.8	172.2	175.9	67.5	0	0	0	108.9	I274 A284 A287 L369 L371	L272-I274 HydrophobicContact CD2-CD1 4.1Å; L272-I274 HydrophobicContact CG-CD1 4Å; L272-A284 HydrophobicContact CD2-CB 4.1Å; L272-A287 HydrophobicContact CD2-CB 4.19Å; L272-L369 HydrophobicContact CB-CB 4.27Å; L272-L369 PolarHBondContact N-O 3.37Å; L272-L369 PolarHBondContact O-N 2.76Å; L272-L371 HydrophobicContact CB-CD1 3.98Å
273	H	97.9	Very high	96.1	Very high	105 Å²	105	65.8 Å²	65.8	49%	0.486	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	134.3	176.9	-179	65	0	0	0	110.8	N368	H273-N368 PolarHBondContact ND1-OD1 3.24Å
274	I	97.6	Very high	96	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	110.7	175.7	-50.3	-65.3	0	0	0	106.8	L272 Q276 Q279 M280 L283 A284 H366 Y367 L369	L272-I274 HydrophobicContact CD2-CD1 4.1Å; L272-I274 HydrophobicContact CG-CD1 4Å; I274-Q276 VanDerWaalsContact C-N 3.33Å; I274-Q276 WeakPolarHBondContact CG2-O 3.31Å; I274-Q276 PolarHBondContact O-N 2.89Å; I274-Q279 HydrophobicContact CG2-CB 4.29Å; I274-M280 HydrophobicContact CG1-SD 3.99Å; I274-M280 HydrophobicContact CG2-SD 4.49Å; I274-L283 HydrophobicContact CD1-CB 3.56Å; I274-L283 HydrophobicContact CD1-CD1 4.48Å; I274-L283 HydrophobicContact CG2-CD1 4.49Å; I274-A284 HydrophobicContact CD1-CB 3.91Å; I274-H366 CarbonylContact O-C 3.56Å; I274-H366 WeakPolarHBondContact O-CA 3.15Å; I274-Y367 PolarHBondContact N-O 3.19Å; I274-Y367 PolarHBondContact O-N 2.97Å; I274-L369 HydrophobicContact CG1-CD1 3.74Å
275	P	96.8	Very high	95.9	Very high	60 Å²	60	60 Å²	60	39%	0.39	29%	0.287	S	S	.	.	S	Bend	trans	-62.9	-38.1	-172.3	-24.2	33.5	0	0	0	113.4	H366	P275-H366 VanDerWaalsContact O-CA 3.22Å; P275-H366 WeakPolarHBondContact O-CA 3.41Å; P275-H366 VanDerWaalsContact O-CB 3.26Å; P275-H366 WeakPolarHBondContact O-CB 3.47Å
276	Q	96	Very high	95.9	Very high	81 Å²	81	62.5 Å²	62.5	38%	0.379	30%	0.301	S	S	.	.	S	Bend	trans	-139.6	138.4	-179.2	-59.4	-166.7	26.2	0	0	110.8	I274 H278 Q279 S363 V365	I274-Q276 VanDerWaalsContact C-N 3.33Å; I274-Q276 WeakPolarHBondContact CG2-O 3.31Å; I274-Q276 PolarHBondContact O-N 2.89Å; Q276-H278 PolarHBondContact O-N 3.08Å; Q276-H278 VanDerWaalsContact O-N 3.12Å; Q276-H278 PolarHBondContact OE1-CE1 3.37Å; Q276-H278 PolarHBondContact OE1-ND1 3.33Å; Q276-Q279 HydrophobicContact CB-CG 4.28Å; Q276-Q279 WeakPolarHBondContact O-CA 3.42Å; Q276-Q279 VanDerWaalsContact O-CB 3.3Å; Q276-Q279 WeakPolarHBondContact O-CB 3.17Å; Q276-Q279 PolarHBondContact O-N 3.26Å; Q276-S363 CarbonylContact C-O 3.07Å; Q276-S363 WeakPolarHBondContact CB-O 3.49Å; Q276-V365 CarbonylContact C-O 3.52Å; Q276-V365 WeakPolarHBondContact CA-O 3.47Å
277	G	95.3	Very high	95.9	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	G	3₁₀ helix	trans	-57.7	-29.1	-174.9	0	0	0	0	0	114.5	Q279 M280 K362 S363 V365	G277-Q279 PolarHBondContact O-N 3Å; G277-M280 VanDerWaalsContact O-CB 3.24Å; G277-M280 WeakPolarHBondContact O-CB 3.31Å; G277-M280 PolarHBondContact O-N 3.38Å; G277-M280 VanDerWaalsContact O-N 3.13Å; G277-K362 WeakPolarHBondContact CA-O 3.41Å; G277-S363 PolarHBondContact N-O 3.14Å; G277-V365 PolarHBondContact N-O 3.35Å
278	H	93.6	Very high	96	Very high	84 Å²	84	57.3 Å²	57.3	39%	0.389	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-65.2	-25.1	175	66.8	-106.6	0	0	0	112.8	Q276 M280 Q358 S363	Q276-H278 PolarHBondContact O-N 3.08Å; Q276-H278 VanDerWaalsContact O-N 3.12Å; Q276-H278 PolarHBondContact OE1-CE1 3.37Å; Q276-H278 PolarHBondContact OE1-ND1 3.33Å; H278-M280 VanDerWaalsContact C-N 3.28Å; H278-M280 PolarHBondContact O-N 3.04Å; H278-Q358 PolarHBondContact O-NE2 2.7Å; H278-S363 PolarHBondContact N-O 2.95Å; H278-S363 PolarHBondContact ND1-O 3.48Å; H278-S363 PolarHBondContact ND1-OG 3.34Å
279	Q	94.8	Very high	96.1	Very high	45 Å²	45	50 Å²	50	21%	0.21	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-81.8	-1.7	177.4	-52.2	-179.4	-84.3	0	0	113.1	I274 Q276 G277 N281 E282 L283	I274-Q279 HydrophobicContact CG2-CB 4.29Å; Q276-Q279 HydrophobicContact CB-CG 4.28Å; Q276-Q279 WeakPolarHBondContact O-CA 3.42Å; Q276-Q279 VanDerWaalsContact O-CB 3.3Å; Q276-Q279 WeakPolarHBondContact O-CB 3.17Å; Q276-Q279 PolarHBondContact O-N 3.26Å; G277-Q279 PolarHBondContact O-N 3Å; Q279-N281 PolarHBondContact O-N 2.77Å; Q279-E282 PolarHBondContact O-N 3.29Å; Q279-L283 HydrophobicContact CB-CD1 3.78Å; Q279-L283 HydrophobicContact CB-CG 4.13Å; Q279-L283 WeakPolarHBondContact O-CB 3.32Å; Q279-L283 PolarHBondContact O-N 3.08Å
280	M	95.6	Very high	96	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-55.5	-40.4	-178.4	-171	71.6	80.1	0	0	112.2	I274 G277 H278 A284 A285 V301 Y330 W361 Y367 L369	I274-M280 HydrophobicContact CG1-SD 3.99Å; I274-M280 HydrophobicContact CG2-SD 4.49Å; G277-M280 VanDerWaalsContact O-CB 3.24Å; G277-M280 WeakPolarHBondContact O-CB 3.31Å; G277-M280 PolarHBondContact O-N 3.38Å; G277-M280 VanDerWaalsContact O-N 3.13Å; H278-M280 VanDerWaalsContact C-N 3.28Å; H278-M280 PolarHBondContact O-N 3.04Å; M280-A284 HydrophobicContact CG-CB 4.24Å; M280-A284 WeakPolarHBondContact O-CA 3.26Å; M280-A284 WeakPolarHBondContact O-CB 3.39Å; M280-A284 PolarHBondContact O-N 3.19Å; M280-A284 HydrophobicContact SD-CB 3.66Å; M280-A285 PolarHBondContact O-N 2.88Å; M280-V301 HydrophobicContact CE-CG2 4.28Å; M280-Y330 HydrophobicContact CG-CE1 4.07Å; M280-Y330 PolarHBondContact O-OH 2.95Å; M280-W361 HydrophobicContact CB-CG 4.08Å; M280-W361 HydrophobicContact CE-CD2 3.62Å; M280-W361 HydrophobicContact CE-CE3 3.65Å; M280-W361 HydrophobicContact CE-CG 4.11Å; M280-W361 HydrophobicContact CE-CH2 4.32Å; M280-W361 HydrophobicContact CE-CZ2 4.27Å; M280-W361 HydrophobicContact CE-CZ3 4.01Å; M280-W361 HydrophobicContact CG-CD2 4.15Å; M280-W361 HydrophobicContact CG-CG 4.07Å; M280-W361 HydrophobicContact CG-CZ2 4.49Å; M280-Y367 HydrophobicContact CE-CD1 4.08Å; M280-Y367 HydrophobicContact CE-CD2 3.95Å; M280-Y367 HydrophobicContact CE-CG 3.64Å; M280-L369 HydrophobicContact CE-CD1 4.28Å; M280-L369 HydrophobicContact SD-CD1 4.15Å
281	N	93.3	Very high	96	Very high	17 Å²	17	48.4 Å²	48.4	9%	0.091	24%	0.242	C	C	.	.	H	α-helix	trans	-64.9	-49.6	178.5	-74.8	6.1	0	0	0	112.3	Q279 A285 Y330 Q358	Q279-N281 PolarHBondContact O-N 2.77Å; N281-A285 WeakPolarHBondContact O-CB 3.04Å; N281-A285 PolarHBondContact O-N 3.43Å; N281-Y330 WeakPolarHBondContact CA-OH 3.43Å; N281-Y330 PolarHBondContact N-OH 3.05Å; N281-Y330 VanDerWaalsContact OD1-CE2 3.31Å; N281-Y330 WeakPolarHBondContact OD1-CE2 3.47Å; N281-Y330 PolarHBondContact OD1-OH 3.21Å; N281-Q358 PolarHBondContact ND2-OE1 2.95Å
282	E	92.2	Very high	95.9	Very high	147 Å²	147	45.1 Å²	45.1	69%	0.687	22%	0.224	S	C	*	.	H	α-helix	trans	-63.9	-45.8	-177.7	-175.8	-175.5	179	0	0	111.5	Q279	Q279-E282 PolarHBondContact O-N 3.29Å
283	L	95.4	Very high	95.6	Very high	69 Å²	69	48.2 Å²	48.2	36%	0.361	24%	0.244	S	C	.	.	H	α-helix	trans	-95.5	-27.8	-168.7	-60.5	-179.2	0	0	0	114	I274 Q279	I274-L283 HydrophobicContact CD1-CB 3.56Å; I274-L283 HydrophobicContact CD1-CD1 4.48Å; I274-L283 HydrophobicContact CG2-CD1 4.49Å; Q279-L283 HydrophobicContact CB-CD1 3.78Å; Q279-L283 HydrophobicContact CB-CG 4.13Å; Q279-L283 WeakPolarHBondContact O-CB 3.32Å; Q279-L283 PolarHBondContact O-N 3.08Å
284	A	96.6	Very high	95.2	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-107.6	-38	-175.1	0	0	0	0	0	113.9	L272 I274 M280 H286 A287 L288 L369	L272-A284 HydrophobicContact CD2-CB 4.1Å; I274-A284 HydrophobicContact CD1-CB 3.91Å; M280-A284 HydrophobicContact CG-CB 4.24Å; M280-A284 WeakPolarHBondContact O-CA 3.26Å; M280-A284 WeakPolarHBondContact O-CB 3.39Å; M280-A284 PolarHBondContact O-N 3.19Å; M280-A284 HydrophobicContact SD-CB 3.66Å; A284-H286 PolarHBondContact O-N 2.75Å; A284-A287 WeakPolarHBondContact O-CA 3.4Å; A284-A287 WeakPolarHBondContact O-CB 3.21Å; A284-A287 PolarHBondContact O-N 3.05Å; A284-L288 HydrophobicContact CB-CD1 4.3Å; A284-L288 HydrophobicContact CB-CG 4.34Å; A284-L288 VanDerWaalsContact O-CG 3.28Å; A284-L288 WeakPolarHBondContact O-CG 3.49Å; A284-L288 PolarHBondContact O-N 3.39Å; A284-L369 HydrophobicContact CB-CD2 4.43Å
285	A	95.5	Very high	94.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-54.8	-46.7	-164.6	0	0	0	0	0	114	M280 N281 L288 A289 V313 L315	M280-A285 PolarHBondContact O-N 2.88Å; N281-A285 WeakPolarHBondContact O-CB 3.04Å; N281-A285 PolarHBondContact O-N 3.43Å; A285-L288 PolarHBondContact O-N 3.33Å; A285-A289 PolarHBondContact O-N 3.12Å; A285-V313 HydrophobicContact CB-CG2 4.35Å; A285-L315 HydrophobicContact CB-CD2 3.82Å
286	H	95.3	Very high	94.4	Very high	113 Å²	113	43.6 Å²	43.6	52%	0.523	23%	0.227	S	C	.	.	H	α-helix	trans	-70.3	-37.5	177.4	-70.6	93.2	0	0	0	112.8	A284 L288 A289 Q290	A284-H286 PolarHBondContact O-N 2.75Å; H286-L288 VanDerWaalsContact C-N 3.32Å; H286-L288 PolarHBondContact O-N 3.06Å; H286-A289 PolarHBondContact O-N 3.28Å; H286-Q290 WeakPolarHBondContact O-CG 3.33Å; H286-Q290 PolarHBondContact O-N 3.38Å
287	A	96.8	Very high	94.4	Very high	27 Å²	27	39.8 Å²	39.8	22%	0.223	21%	0.209	C	C	.	.	H	α-helix	trans	-63.3	-39.1	175.3	0	0	0	0	0	111.5	L272 A284 Q290 H291	L272-A287 HydrophobicContact CD2-CB 4.19Å; A284-A287 WeakPolarHBondContact O-CA 3.4Å; A284-A287 WeakPolarHBondContact O-CB 3.21Å; A284-A287 PolarHBondContact O-N 3.05Å; A287-Q290 PolarHBondContact O-N 3.03Å; A287-H291 VanDerWaalsContact O-CB 3.3Å; A287-H291 WeakPolarHBondContact O-CB 3.3Å; A287-H291 PolarHBondContact O-N 3.03Å
288	L	97.7	Very high	94.5	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-43.8	173.7	-63	177.9	0	0	0	111.6	A284 A285 H286 Q290 H291 F292 I299 I310 V313 Y330 L369	A284-L288 HydrophobicContact CB-CD1 4.3Å; A284-L288 HydrophobicContact CB-CG 4.34Å; A284-L288 VanDerWaalsContact O-CG 3.28Å; A284-L288 WeakPolarHBondContact O-CG 3.49Å; A284-L288 PolarHBondContact O-N 3.39Å; A285-L288 PolarHBondContact O-N 3.33Å; H286-L288 VanDerWaalsContact C-N 3.32Å; H286-L288 PolarHBondContact O-N 3.06Å; L288-Q290 PolarHBondContact O-N 3.34Å; L288-H291 WeakPolarHBondContact O-CB 3.35Å; L288-H291 PolarHBondContact O-N 3.3Å; L288-F292 HydrophobicContact CB-CE2 4.35Å; L288-F292 WeakPolarHBondContact O-CD2 3.47Å; L288-F292 PolarHBondContact O-N 2.89Å; L288-I299 HydrophobicContact CD2-CD1 3.25Å; L288-I310 HydrophobicContact CD1-CD1 4.33Å; L288-I310 HydrophobicContact CD1-CG2 4.34Å; L288-V313 HydrophobicContact CB-CB 4.2Å; L288-V313 HydrophobicContact CB-CG1 3.86Å; L288-V313 HydrophobicContact CD1-CB 4.41Å; L288-Y330 HydrophobicContact CD1-CD1 3.82Å; L288-Y330 HydrophobicContact CD1-CE1 3.59Å; L288-L369 HydrophobicContact CD2-CD2 3.83Å
289	A	96.3	Very high	94.8	Very high	5 Å²	5	35.8 Å²	35.8	4%	0.041	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-45.5	177.6	0	0	0	0	0	111.4	Y179 A285 H286 T293 V313 L315	Y179-A289 HydrophobicContact CD1-CB 4.35Å; Y179-A289 HydrophobicContact CD2-CB 3.55Å; Y179-A289 HydrophobicContact CE2-CB 3.79Å; Y179-A289 HydrophobicContact CG-CB 3.84Å; A285-A289 PolarHBondContact O-N 3.12Å; H286-A289 PolarHBondContact O-N 3.28Å; A289-T293 VanDerWaalsContact O-CB 3.31Å; A289-T293 WeakPolarHBondContact O-CB 3.47Å; A289-T293 PolarHBondContact O-N 3.12Å; A289-T293 PolarHBondContact O-OG1 2.86Å; A289-V313 HydrophobicContact CB-CG1 4.06Å; A289-L315 HydrophobicContact CB-CD1 3.99Å; A289-L315 HydrophobicContact CB-CD2 4.35Å; A289-L315 HydrophobicContact CB-CG 4.34Å
290	Q	96.1	Very high	95	Very high	142 Å²	142	33.6 Å²	33.6	66%	0.664	18%	0.18	S	C	*	.	H	α-helix	trans	-61.7	-44.9	174.9	-73.2	178.1	-10.1	0	0	111.9	H286 A287 L288 T293 S294	H286-Q290 WeakPolarHBondContact O-CG 3.33Å; H286-Q290 PolarHBondContact O-N 3.38Å; A287-Q290 PolarHBondContact O-N 3.03Å; L288-Q290 PolarHBondContact O-N 3.34Å; Q290-T293 PolarHBondContact O-N 3.18Å; Q290-S294 WeakPolarHBondContact O-CB 3.23Å; Q290-S294 PolarHBondContact O-N 3.31Å; Q290-S294 PolarHBondContact O-OG 3.18Å
291	H	96.7	Very high	95.1	Very high	15 Å²	15	33.7 Å²	33.7	7%	0.069	18%	0.181	C	C	.	.	H	α-helix	trans	-56	-54.3	177.1	172.5	92.4	0	0	0	111.7	A287 L288 T293 S294 G295 G296 G297 L371 L372	A287-H291 VanDerWaalsContact O-CB 3.3Å; A287-H291 WeakPolarHBondContact O-CB 3.3Å; A287-H291 PolarHBondContact O-N 3.03Å; L288-H291 WeakPolarHBondContact O-CB 3.35Å; L288-H291 PolarHBondContact O-N 3.3Å; H291-T293 VanDerWaalsContact C-N 3.32Å; H291-T293 PolarHBondContact O-N 3.22Å; H291-S294 PolarHBondContact O-N 3.31Å; H291-S294 PolarHBondContact O-OG 3.12Å; H291-G295 PolarHBondContact O-N 3.35Å; H291-G296 VanDerWaalsContact NE2-C 3.32Å; H291-G296 WeakPolarHBondContact NE2-CA 3.26Å; H291-G296 WeakPolarHBondContact O-CA 3.21Å; H291-G296 PolarHBondContact O-N 3.49Å; H291-G297 PolarHBondContact NE2-N 2.83Å; H291-G297 PolarHBondContact NE2-O 3.25Å; H291-L371 HydrophobicContact CB-CD2 4.11Å; H291-L372 PolarHBondContact CE1-O 3.03Å
292	F	95.5	Very high	95.3	Very high	6 Å²	6	33.4 Å²	33.4	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-64.9	-36.5	179.6	-67.7	-55.2	0	0	0	112.4	V181 L288 S294 G295 G297 I299 I310 V313	V181-F292 HydrophobicContact CB-CD1 4.21Å; V181-F292 HydrophobicContact CB-CE1 4.03Å; L288-F292 HydrophobicContact CB-CE2 4.35Å; L288-F292 WeakPolarHBondContact O-CD2 3.47Å; L288-F292 PolarHBondContact O-N 2.89Å; F292-S294 PolarHBondContact O-N 2.72Å; F292-G295 PolarHBondContact O-N 3.45Å; F292-G295 VanDerWaalsContact O-N 3.11Å; F292-G297 WeakPolarHBondContact CE1-O 3.01Å; F292-I299 HydrophobicContact CE1-CD1 4.3Å; F292-I299 HydrophobicContact CE2-CD1 4.19Å; F292-I299 HydrophobicContact CZ-CD1 3.77Å; F292-I299 HydrophobicContact CZ-CG1 4.31Å; F292-I310 HydrophobicContact CE2-CG2 4.37Å; F292-I310 HydrophobicContact CZ-CG2 4.29Å; F292-V313 HydrophobicContact CD2-CG1 4.36Å
293	T	92.6	Very high	95.4	Very high	96 Å²	96	26.8 Å²	26.8	59%	0.589	15%	0.153	S	C	*	.	H	α-helix	trans	-64.2	-40	176.5	-58.1	0	0	0	0	112.1	Y179 A289 Q290 H291 G295	Y179-T293 WeakPolarHBondContact CD1-OG1 3.31Å; Y179-T293 WeakPolarHBondContact CE1-OG1 3.24Å; A289-T293 VanDerWaalsContact O-CB 3.31Å; A289-T293 WeakPolarHBondContact O-CB 3.47Å; A289-T293 PolarHBondContact O-N 3.12Å; A289-T293 PolarHBondContact O-OG1 2.86Å; Q290-T293 PolarHBondContact O-N 3.18Å; H291-T293 VanDerWaalsContact C-N 3.32Å; H291-T293 PolarHBondContact O-N 3.22Å; T293-G295 PolarHBondContact O-N 3.2Å; T293-G295 VanDerWaalsContact O-N 3.13Å
294	S	90	Very high	95	Very high	62 Å²	62	25.6 Å²	25.6	43%	0.434	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-0.7	175.9	72.6	0	0	0	0	113.8	Q290 H291 F292	Q290-S294 WeakPolarHBondContact O-CB 3.23Å; Q290-S294 PolarHBondContact O-N 3.31Å; Q290-S294 PolarHBondContact O-OG 3.18Å; H291-S294 PolarHBondContact O-N 3.31Å; H291-S294 PolarHBondContact O-OG 3.12Å; F292-S294 PolarHBondContact O-N 2.72Å
295	G	87.7	Confident	94.6	Very high	7 Å²	7	32.6 Å²	32.6	7%	0.072	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	84.9	18.4	-178	0	0	0	0	0	113.9	H291 F292 T293 R375	H291-G295 PolarHBondContact O-N 3.35Å; F292-G295 PolarHBondContact O-N 3.45Å; F292-G295 VanDerWaalsContact O-N 3.11Å; T293-G295 PolarHBondContact O-N 3.2Å; T293-G295 VanDerWaalsContact O-N 3.13Å; G295-R375 PolarHBondContact O-NE 3.44Å
296	G	90.5	Very high	94.5	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.209	C	C	.	.			trans	-62.7	148.7	170.9	0	0	0	0	0	112.5	H291	H291-G296 VanDerWaalsContact NE2-C 3.32Å; H291-G296 WeakPolarHBondContact NE2-CA 3.26Å; H291-G296 WeakPolarHBondContact O-CA 3.21Å; H291-G296 PolarHBondContact O-N 3.49Å
297	G	94.7	Very high	94.7	Very high	0 Å²	0	31 Å²	31	0%	0	19%	0.185	C	C	.	.			trans	-82.8	-167.1	-177.8	0	0	0	0	0	114.6	W213 H291 F292	W213-G297 VanDerWaalsContact CE2-CA 3.44Å; W213-G297 VanDerWaalsContact CZ2-CA 3.42Å; H291-G297 PolarHBondContact NE2-N 2.83Å; H291-G297 PolarHBondContact NE2-O 3.25Å; F292-G297 WeakPolarHBondContact CE1-O 3.01Å
298	P	98.4	Very high	94.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	18%	0.178	C	C	.	.			trans	-54.8	152.1	170.3	-21.6	32.9	0	0	0	111.8	V181 Y185 L210 W213 T309 I311	V181-P298 HydrophobicContact CG2-CG 4.04Å; Y185-P298 HydrophobicContact CD1-CG 4.41Å; Y185-P298 HydrophobicContact CG-CG 4.37Å; L210-P298 HydrophobicContact CD1-CB 4Å; L210-P298 HydrophobicContact CG-CB 4.47Å; W213-P298 HydrophobicContact CB-CG 3.94Å; W213-P298 HydrophobicContact CG-CG 3.99Å; P298-T309 HydrophobicContact CB-CG2 3.72Å; P298-I311 HydrophobicContact CB-CG2 4Å; P298-I311 HydrophobicContact CG-CG2 4.36Å
299	I	98.8	Very high	94.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	124.3	-176.3	-59.7	165.8	0	0	0	108.3	L288 F292 T309 I310 L369 L371	L288-I299 HydrophobicContact CD2-CD1 3.25Å; F292-I299 HydrophobicContact CE1-CD1 4.3Å; F292-I299 HydrophobicContact CE2-CD1 4.19Å; F292-I299 HydrophobicContact CZ-CD1 3.77Å; F292-I299 HydrophobicContact CZ-CG1 4.31Å; I299-T309 CarbonylContact O-C 3.52Å; I299-T309 WeakPolarHBondContact O-CA 3.38Å; I299-I310 HydrophobicContact CB-CB 4.31Å; I299-I310 PolarHBondContact N-O 3.3Å; I299-I310 PolarHBondContact O-N 2.92Å; I299-L369 HydrophobicContact CG2-CB 3.97Å; I299-L369 HydrophobicContact CG2-CD2 4.2Å; I299-L369 HydrophobicContact CG2-CG 4.37Å; I299-L371 HydrophobicContact CD1-CD2 4.35Å; I299-L371 HydrophobicContact CD1-CG 4.07Å; I299-L371 HydrophobicContact CG1-CG 4.11Å; I299-L371 HydrophobicContact CG2-CD1 4.12Å; I299-L371 HydrophobicContact CG2-CG 4.03Å
300	M	98.6	Very high	94.9	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	132.2	169.9	-178.8	-78.9	-161.7	0	0	108.4	A203 S206 L210 S254 V257 A307 L369 C370	A203-M300 HydrophobicContact CB-CE 3.38Å; S206-M300 WeakPolarHBondContact OG-CB 3.21Å; S206-M300 VanDerWaalsContact OG-CG 3.25Å; S206-M300 WeakPolarHBondContact OG-CG 3.18Å; L210-M300 HydrophobicContact CD1-CB 4.21Å; L210-M300 HydrophobicContact CD2-CB 4.11Å; S254-M300 PolarHBondContact OG-SD 2.9Å; V257-M300 HydrophobicContact CG1-CB 4.37Å; V257-M300 HydrophobicContact CG1-CG 4.48Å; V257-M300 HydrophobicContact CG2-CE 3.94Å; V257-M300 HydrophobicContact CG2-CG 4.38Å; M300-A307 HydrophobicContact CE-CB 3.7Å; M300-L369 CarbonylContact O-C 3.43Å; M300-L369 WeakPolarHBondContact O-CA 3.48Å; M300-C370 HydrophobicContact CB-CB 4.36Å; M300-C370 PolarHBondContact N-O 3.46Å; M300-C370 PolarHBondContact O-N 2.91Å
301	V	98.6	Very high	95	Very high	2 Å²	2	23.7 Å²	23.7	1%	0.012	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	123.7	172.9	58.3	0	0	0	0	109.3	M280 A307 H308 I310 W361 Y367 N368 L369	M280-V301 HydrophobicContact CE-CG2 4.28Å; V301-A307 CarbonylContact O-C 3.59Å; V301-A307 WeakPolarHBondContact O-CA 3.28Å; V301-H308 HydrophobicContact CG1-CB 3.87Å; V301-H308 WeakPolarHBondContact CG1-O 3.08Å; V301-H308 PolarHBondContact N-O 3.45Å; V301-H308 PolarHBondContact O-N 3.21Å; V301-I310 HydrophobicContact CB-CD1 4.03Å; V301-I310 HydrophobicContact CB-CG1 4.41Å; V301-I310 HydrophobicContact CG1-CD1 3.91Å; V301-I310 HydrophobicContact CG1-CG1 3.83Å; V301-W361 HydrophobicContact CG1-CH2 3.86Å; V301-W361 HydrophobicContact CG1-CZ3 3.93Å; V301-W361 HydrophobicContact CG2-CH2 4.35Å; V301-W361 HydrophobicContact CG2-CZ3 4Å; V301-Y367 HydrophobicContact CG2-CD1 3.79Å; V301-Y367 HydrophobicContact CG2-CG 4.44Å; V301-N368 WeakPolarHBondContact CA-O 3.35Å; V301-L369 HydrophobicContact CB-CG 4.05Å; V301-L369 HydrophobicContact CG2-CD1 3.87Å; V301-L369 HydrophobicContact CG2-CG 3.86Å
302	G	97.6	Very high	95.1	Very high	11 Å²	11	23 Å²	23	11%	0.113	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	133.8	174.8	0	0	0	0	0	110.7	S254 Y367 N368	S254-G302 PolarHBondContact OG-N 3.34Å; G302-Y367 CarbonylContact O-C 3.54Å; G302-Y367 VanDerWaalsContact O-CA 3.28Å; G302-Y367 WeakPolarHBondContact O-CA 3.41Å; G302-N368 PolarHBondContact N-O 2.74Å; G302-N368 PolarHBondContact O-N 3.44Å
303	G	94.3	Very high	95.1	Very high	8 Å²	8	22.7 Å²	22.7	8%	0.082	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148	118.7	173.9	0	0	0	0	0	111.7	Q305 L306 H366	G303-Q305 PolarHBondContact O-N 2.77Å; G303-L306 PolarHBondContact N-O 2.88Å; G303-L306 PolarHBondContact O-N 2.85Å; G303-H366 WeakPolarHBondContact CA-O 3.33Å
304	G	87.1	Confident	95.2	Very high	43 Å²	43	18.2 Å²	18.2	44%	0.443	11%	0.113	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-123.1	-169.1	0	0	0	0	0	111.1
305	Q	87.7	Confident	95.3	Very high	147 Å²	147	16.1 Å²	16.1	69%	0.687	10%	0.097	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.9	5.2	-179.9	-63.3	176.8	-1.4	0	0	113.6	G303	G303-Q305 PolarHBondContact O-N 2.77Å
306	L	94.2	Very high	95.1	Very high	77 Å²	77	17.1 Å²	17.1	40%	0.403	10%	0.102	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	144.9	-175.7	-60.9	175.8	0	0	0	110.7	G303 H336	G303-L306 PolarHBondContact N-O 2.88Å; G303-L306 PolarHBondContact O-N 2.85Å; L306-H336 WeakPolarHBondContact CD2-NE2 3.46Å
307	A	98	Very high	94	Very high	2 Å²	2	19.3 Å²	19.3	2%	0.017	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	145.4	171.9	0	0	0	0	0	111.3	C202 A203 M300 V301 P335 H336	C202-A307 HydrophobicContact CB-CB 4.14Å; C202-A307 PolarHBondContact SG-N 3.43Å; C202-A307 VanDerWaalsContact SG-N 3.36Å; A203-A307 HydrophobicContact CB-CB 3.89Å; M300-A307 HydrophobicContact CE-CB 3.7Å; V301-A307 CarbonylContact O-C 3.59Å; V301-A307 WeakPolarHBondContact O-CA 3.28Å; A307-P335 WeakPolarHBondContact O-CD 3.49Å; A307-P335 WeakPolarHBondContact O-CG 3.21Å; A307-H336 PolarHBondContact O-CE1 2.84Å
308	H	98.6	Very high	92.3	Very high	20 Å²	20	22.6 Å²	22.6	9%	0.093	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	171.6	174.3	-61.3	87.5	0	0	0	110	V301 I332 D334 H336 F360	V301-H308 HydrophobicContact CG1-CB 3.87Å; V301-H308 WeakPolarHBondContact CG1-O 3.08Å; V301-H308 PolarHBondContact N-O 3.45Å; V301-H308 PolarHBondContact O-N 3.21Å; H308-I332 HydrophobicContact CB-CG2 3.93Å; H308-D334 IonicContact CD2-OD1 2.75Å; H308-D334 IonicContact CD2-OD2 3.73Å; H308-D334 IonicContact NE2-OD1 3.03Å; H308-D334 IonicContact NE2-OD2 3.66Å; H308-H336 AromaticContact CE1-CE1 3.95Å; H308-H336 AromaticContact NE2-CE1 3.69Å; H308-H336 AromaticContact NE2-ND1 3.74Å; H308-F360 AromaticContact CD2-CZ 3.73Å; H308-F360 AromaticContact CE1-CZ 3.75Å; H308-F360 AromaticContact CG-CZ 3.92Å; H308-F360 AromaticContact ND1-CZ 3.93Å; H308-F360 AromaticContact NE2-CZ 3.61Å
309	T	98.9	Very high	90.1	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.006	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	120.9	171.8	-44.8	0	0	0	0	109.5	S206 T209 L210 P298 I299 I311 L333	S206-T309 WeakPolarHBondContact CB-OG1 3.47Å; S206-T309 PolarHBondContact OG-OG1 2.76Å; T209-T309 HydrophobicContact CG2-CG2 4.37Å; L210-T309 HydrophobicContact CD1-CG2 4Å; P298-T309 HydrophobicContact CB-CG2 3.72Å; I299-T309 CarbonylContact O-C 3.52Å; I299-T309 WeakPolarHBondContact O-CA 3.38Å; T309-I311 HydrophobicContact CG2-CG2 4.15Å; T309-L333 WeakPolarHBondContact CB-O 3.28Å; T309-L333 PolarHBondContact N-O 3.15Å; T309-L333 PolarHBondContact O-N 2.81Å
310	I	98.7	Very high	87.8	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	125.9	171.2	-58	168	0	0	0	107.8	L288 F292 I299 V301 G312 I332 W361 L369	L288-I310 HydrophobicContact CD1-CD1 4.33Å; L288-I310 HydrophobicContact CD1-CG2 4.34Å; F292-I310 HydrophobicContact CE2-CG2 4.37Å; F292-I310 HydrophobicContact CZ-CG2 4.29Å; I299-I310 HydrophobicContact CB-CB 4.31Å; I299-I310 PolarHBondContact N-O 3.3Å; I299-I310 PolarHBondContact O-N 2.92Å; V301-I310 HydrophobicContact CB-CD1 4.03Å; V301-I310 HydrophobicContact CB-CG1 4.41Å; V301-I310 HydrophobicContact CG1-CD1 3.91Å; V301-I310 HydrophobicContact CG1-CG1 3.83Å; I310-G312 WeakPolarHBondContact CG2-O 3.44Å; I310-I332 HydrophobicContact CG1-CD1 3.77Å; I310-W361 HydrophobicContact CD1-CH2 3.84Å; I310-W361 HydrophobicContact CD1-CZ2 4.07Å; I310-W361 HydrophobicContact CG1-CH2 4.05Å; I310-W361 HydrophobicContact CG1-CZ2 4.43Å; I310-L369 HydrophobicContact CD1-CD2 3.94Å
311	I	98.4	Very high	85.3	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	6.8	179.7	51.3	164.3	0	0	0	112	H166 V181 Y185 P298 T309 L331 L333	H166-I311 HydrophobicContact CB-CD1 3.58Å; V181-I311 HydrophobicContact CB-CB 4.49Å; V181-I311 HydrophobicContact CG1-CB 3.89Å; V181-I311 HydrophobicContact CG1-CG2 4.29Å; V181-I311 PolarHBondContact N-O 3.38Å; Y185-I311 HydrophobicContact CE1-CG2 4.26Å; Y185-I311 WeakPolarHBondContact OH-CD1 3.46Å; P298-I311 HydrophobicContact CB-CG2 4Å; P298-I311 HydrophobicContact CG-CG2 4.36Å; T309-I311 HydrophobicContact CG2-CG2 4.15Å; I311-L331 HydrophobicContact CD1-CD2 3.78Å; I311-L331 HydrophobicContact CD1-CG 3.72Å; I311-L331 HydrophobicContact CG1-CB 4.12Å; I311-L331 HydrophobicContact CG1-CD2 3.81Å; I311-L331 HydrophobicContact CG1-CG 3.6Å; I311-L331 VanDerWaalsContact CG1-O 3.25Å; I311-L331 WeakPolarHBondContact CG1-O 3.48Å; I311-L331 PolarHBondContact N-O 3.41Å; I311-L333 HydrophobicContact CD1-CB 4.11Å; I311-L333 HydrophobicContact CG1-CB 4.39Å; I311-L333 HydrophobicContact CG2-CB 4.43Å
312	G	97.5	Very high	83	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	178.6	164.9	173.7	0	0	0	0	0	113.8	Y179 I310 L331	Y179-G312 CarbonylContact O-C 3.52Å; Y179-G312 WeakPolarHBondContact O-CA 3.43Å; I310-G312 WeakPolarHBondContact CG2-O 3.44Å; G312-L331 PolarHBondContact O-N 2.8Å
313	V	96.7	Very high	80.9	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	137.8	175.9	64.8	0	0	0	0	109.6	Y179 A285 L288 A289 F292 L315 R329 Y330	Y179-V313 HydrophobicContact CD2-CG1 4.42Å; Y179-V313 PolarHBondContact N-O 2.87Å; Y179-V313 PolarHBondContact O-N 2.65Å; A285-V313 HydrophobicContact CB-CG2 4.35Å; L288-V313 HydrophobicContact CB-CB 4.2Å; L288-V313 HydrophobicContact CB-CG1 3.86Å; L288-V313 HydrophobicContact CD1-CB 4.41Å; A289-V313 HydrophobicContact CB-CG1 4.06Å; F292-V313 HydrophobicContact CD2-CG1 4.36Å; V313-L315 HydrophobicContact CG2-CD2 4.11Å; V313-R329 CarbonylContact C-O 3.46Å; V313-R329 WeakPolarHBondContact CA-O 3.47Å; V313-Y330 HydrophobicContact CG2-CD1 4.36Å; V313-Y330 HydrophobicContact CG2-CE1 4.28Å
314	Q	94.5	Very high	79	Confident	2 Å²	2	55 Å²	55	1%	0.009	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	120.6	164.8	-176.4	-178.1	47.6	0	0	107.6	P173 G176 Q177 H328 R329 W355	P173-Q314 PolarHBondContact O-NE2 3.16Å; G176-Q314 PolarHBondContact O-NE2 2.93Å; Q177-Q314 WeakPolarHBondContact O-CA 3.48Å; Q314-H328 WeakPolarHBondContact O-CA 3.41Å; Q314-R329 HydrophobicContact CB-CB 4.14Å; Q314-R329 PolarHBondContact N-O 2.98Å; Q314-R329 PolarHBondContact O-N 2.84Å; Q314-W355 HydrophobicContact CB-CH2 4.47Å; Q314-W355 HydrophobicContact CB-CZ3 4.05Å
315	L	92.1	Very high	77.4	Confident	19 Å²	19	55.8 Å²	55.8	10%	0.099	34%	0.339	C	S	.	.			trans	-77.7	142.9	173.1	-57.9	-174.9	0	0	0	109.7	G176 Q177 Y179 A285 A289 V313 G317 H328	G176-L315 VanDerWaalsContact CA-O 3.3Å; G176-L315 WeakPolarHBondContact CA-O 3.28Å; Q177-L315 PolarHBondContact O-N 3.47Å; Y179-L315 HydrophobicContact CD2-CD1 4.44Å; Y179-L315 HydrophobicContact CD2-CG 4.28Å; Y179-L315 HydrophobicContact CE2-CD1 3.74Å; Y179-L315 HydrophobicContact CE2-CG 3.95Å; A285-L315 HydrophobicContact CB-CD2 3.82Å; A289-L315 HydrophobicContact CB-CD1 3.99Å; A289-L315 HydrophobicContact CB-CD2 4.35Å; A289-L315 HydrophobicContact CB-CG 4.34Å; V313-L315 HydrophobicContact CG2-CD2 4.11Å; L315-G317 PolarHBondContact O-N 3.33Å; L315-H328 WeakPolarHBondContact CA-ND1 3.22Å
316	C	83.6	Confident	76.2	Confident	27 Å²	27	50 Å²	50	18%	0.182	31%	0.314	C	S	.	.			trans	-62.1	125.7	170.5	170.2	0	0	0	0	110.2	S318 S326 H328	C316-S318 PolarHBondContact SG-O 3.43Å; C316-S326 VanDerWaalsContact CB-O 3.23Å; C316-S326 WeakPolarHBondContact CB-O 3.32Å; C316-S326 WeakPolarHBondContact SG-CA 3.27Å; C316-S326 PolarHBondContact SG-O 2.98Å; C316-H328 PolarHBondContact N-ND1 3.2Å
317	G	67.1	Low	75.5	Confident	47 Å²	47	47.9 Å²	47.9	49%	0.485	31%	0.306	S	S	.	.	S	Bend	trans	-91.4	98.5	166	0	0	0	0	0	109.7	V175 L315	V175-G317 WeakPolarHBondContact O-CA 3.41Å; V175-G317 PolarHBondContact O-N 3.46Å; L315-G317 PolarHBondContact O-N 3.33Å
318	S	59.4	Low	75.1	Confident	69 Å²	69	49.2 Å²	49.2	48%	0.483	31%	0.312	S	S	.	.			trans	84.4	113.5	179.5	-169	0	0	0	0	116.5	C316 L320 S326	C316-S318 PolarHBondContact SG-O 3.43Å; S318-L320 PolarHBondContact O-N 2.84Å; S318-L320 WeakPolarHBondContact OG-CB 3.26Å; S318-L320 PolarHBondContact OG-N 3.26Å; S318-S326 WeakPolarHBondContact O-CB 3.19Å
319	T	52.3	Low	75	Confident	129 Å²	129	49.3 Å²	49.3	79%	0.791	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-3.3	172.3	46.2	0	0	0	0	113.8	N321	T319-N321 VanDerWaalsContact C-N 3.28Å; T319-N321 PolarHBondContact O-N 3.3Å; T319-N321 VanDerWaalsContact O-N 3.16Å
320	L	49.6	Very low	74.9	Confident	139 Å²	139	49.3 Å²	49.3	73%	0.728	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-15.2	-162	-80.5	160.7	0	0	0	115.2	S318	S318-L320 PolarHBondContact O-N 2.84Å; S318-L320 WeakPolarHBondContact OG-CB 3.26Å; S318-L320 PolarHBondContact OG-N 3.26Å
321	N	45.8	Very low	74.8	Confident	122 Å²	122	49.4 Å²	49.4	65%	0.652	31%	0.312	S	S	*	.	S	Bend	trans	-141.1	114.4	173.9	-72	-45.1	0	0	0	109.4	T319 T323 S326	T319-N321 VanDerWaalsContact C-N 3.28Å; T319-N321 PolarHBondContact O-N 3.3Å; T319-N321 VanDerWaalsContact O-N 3.16Å; N321-T323 PolarHBondContact O-N 3.05Å; N321-S326 WeakPolarHBondContact O-CB 3.33Å; N321-S326 PolarHBondContact O-OG 2.85Å
322	G	51.2	Low	74.8	Confident	86 Å²	86	49.4 Å²	49.4	89%	0.887	31%	0.312	S	S	*	.			trans	-66.8	38.5	-178	0	0	0	0	0	115.9
323	T	54.1	Low	74.9	Confident	88 Å²	88	49.5 Å²	49.5	54%	0.54	31%	0.312	S	S	.	.	S	Bend	trans	-84.8	155.3	169.9	58.1	0	0	0	0	110	N321 S325 S326	N321-T323 PolarHBondContact O-N 3.05Å; T323-S325 PolarHBondContact O-N 3.2Å; T323-S326 PolarHBondContact O-N 3.42Å; T323-S326 PolarHBondContact O-OG 3.41Å
324	E	52.9	Low	75	Confident	137 Å²	137	50.5 Å²	50.5	64%	0.64	32%	0.318	S	S	*	.	G	3₁₀ helix	trans	-53.8	-18.2	-179.8	-67.7	-161.8	154.9	0	0	114.4	S326 S327 R329	E324-S326 PolarHBondContact O-N 3.4Å; E324-S327 PolarHBondContact O-N 3.26Å; E324-R329 PolarHBondContact O-NH2 3.24Å
325	S	54.4	Low	75.2	Confident	59 Å²	59	50.4 Å²	50.4	41%	0.413	32%	0.318	S	S	.	.	G	3₁₀ helix	trans	-62.1	-23.3	170.2	-101.2	0	0	0	0	114.1	V175 T323	V175-S325 WeakPolarHBondContact CB-O 3.25Å; V175-S325 WeakPolarHBondContact CG2-O 3.38Å; T323-S325 PolarHBondContact O-N 3.2Å
326	S	61.7	Low	75.5	Confident	25 Å²	25	50.9 Å²	50.9	18%	0.175	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-99.7	20	-179	64.9	0	0	0	0	114	C316 S318 N321 T323 E324	C316-S326 VanDerWaalsContact CB-O 3.23Å; C316-S326 WeakPolarHBondContact CB-O 3.32Å; C316-S326 WeakPolarHBondContact SG-CA 3.27Å; C316-S326 PolarHBondContact SG-O 2.98Å; S318-S326 WeakPolarHBondContact O-CB 3.19Å; N321-S326 WeakPolarHBondContact O-CB 3.33Å; N321-S326 PolarHBondContact O-OG 2.85Å; T323-S326 PolarHBondContact O-N 3.42Å; T323-S326 PolarHBondContact O-OG 3.41Å; E324-S326 PolarHBondContact O-N 3.4Å
327	S	79	Confident	76.2	Confident	33 Å²	33	49.7 Å²	49.7	23%	0.231	31%	0.311	C	S	.	.	S	Bend	trans	-100.5	140	178.9	-65.6	0	0	0	0	112.1	E324	E324-S327 PolarHBondContact O-N 3.26Å
328	H	91.4	Very high	77.6	Confident	31 Å²	31	50.7 Å²	50.7	14%	0.144	31%	0.308	C	S	.	.			trans	-56.2	144.2	167.9	-64	-87.2	0	0	0	110.4	Q314 L315 C316 Y330	Q314-H328 WeakPolarHBondContact O-CA 3.41Å; L315-H328 WeakPolarHBondContact CA-ND1 3.22Å; C316-H328 PolarHBondContact N-ND1 3.2Å; H328-Y330 HydrophobicContact CB-CE2 4.4Å
329	R	94.8	Very high	79.4	Confident	22 Å²	22	48.5 Å²	48.5	8%	0.083	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	147.9	174.6	-59.5	-178.5	179	72.6	12.7	110.7	V313 Q314 E324 W355 K356 L357	V313-R329 CarbonylContact C-O 3.46Å; V313-R329 WeakPolarHBondContact CA-O 3.47Å; Q314-R329 HydrophobicContact CB-CB 4.14Å; Q314-R329 PolarHBondContact N-O 2.98Å; Q314-R329 PolarHBondContact O-N 2.84Å; E324-R329 PolarHBondContact O-NH2 3.24Å; R329-W355 HydrophobicContact CB-CE3 3.81Å; R329-W355 HydrophobicContact CB-CZ3 4.42Å; R329-K356 CarbonylContact C-O 3.57Å; R329-K356 VanDerWaalsContact CA-O 3.27Å; R329-K356 WeakPolarHBondContact CA-O 3.43Å; R329-L357 HydrophobicContact CG-CD2 3.95Å
330	Y	97.1	Very high	81.4	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	128.6	178.7	-58	-94.7	0	0	0	108.8	M280 N281 L288 V313 H328 I332 W355 K356 W361	M280-Y330 HydrophobicContact CG-CE1 4.07Å; M280-Y330 PolarHBondContact O-OH 2.95Å; N281-Y330 WeakPolarHBondContact CA-OH 3.43Å; N281-Y330 PolarHBondContact N-OH 3.05Å; N281-Y330 VanDerWaalsContact OD1-CE2 3.31Å; N281-Y330 WeakPolarHBondContact OD1-CE2 3.47Å; N281-Y330 PolarHBondContact OD1-OH 3.21Å; L288-Y330 HydrophobicContact CD1-CD1 3.82Å; L288-Y330 HydrophobicContact CD1-CE1 3.59Å; V313-Y330 HydrophobicContact CG2-CD1 4.36Å; V313-Y330 HydrophobicContact CG2-CE1 4.28Å; H328-Y330 HydrophobicContact CB-CE2 4.4Å; Y330-I332 PolarHBondContact O-N 3.18Å; Y330-W355 CarbonylContact O-C 3.46Å; Y330-W355 WeakPolarHBondContact O-CA 3.48Å; Y330-K356 PolarHBondContact N-O 3.17Å; Y330-K356 PolarHBondContact O-N 3.22Å; Y330-W361 AromaticContact CD1-CZ2 3.97Å; Y330-W361 HydrophobicContact CD1-CZ2 3.97Å; Y330-W361 HydrophobicContact CD2-CZ2 4.18Å; Y330-W361 AromaticContact CD2-NE1 3.25Å; Y330-W361 VanDerWaalsContact CD2-NE1 3.25Å; Y330-W361 AromaticContact CE2-NE1 3.24Å; Y330-W361 AromaticContact CG-CZ2 3.79Å; Y330-W361 HydrophobicContact CG-CZ2 3.79Å; Y330-W361 AromaticContact CG-NE1 3.77Å; Y330-W361 AromaticContact CZ-NE1 3.73Å
331	L	97.9	Very high	83.5	Confident	3 Å²	3	43.8 Å²	43.8	2%	0.016	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	109.7	173.8	-176.1	62.9	0	0	0	108	H166 V169 I180 I311 G312 W355	H166-L331 HydrophobicContact CB-CD2 4.06Å; V169-L331 HydrophobicContact CG1-CD1 4.18Å; I180-L331 HydrophobicContact CG2-CD2 4.06Å; I311-L331 HydrophobicContact CD1-CD2 3.78Å; I311-L331 HydrophobicContact CD1-CG 3.72Å; I311-L331 HydrophobicContact CG1-CB 4.12Å; I311-L331 HydrophobicContact CG1-CD2 3.81Å; I311-L331 HydrophobicContact CG1-CG 3.6Å; I311-L331 VanDerWaalsContact CG1-O 3.25Å; I311-L331 WeakPolarHBondContact CG1-O 3.48Å; I311-L331 PolarHBondContact N-O 3.41Å; G312-L331 PolarHBondContact O-N 2.8Å; L331-W355 HydrophobicContact CB-CD2 3.93Å; L331-W355 HydrophobicContact CB-CE3 3.73Å; L331-W355 HydrophobicContact CB-CH2 3.71Å; L331-W355 HydrophobicContact CB-CZ2 3.91Å; L331-W355 HydrophobicContact CB-CZ3 3.63Å; L331-W355 HydrophobicContact CD1-CD2 3.93Å; L331-W355 HydrophobicContact CD1-CG 4.03Å; L331-W355 HydrophobicContact CD1-CZ2 4.31Å; L331-W355 HydrophobicContact CD2-CH2 4.35Å; L331-W355 HydrophobicContact CD2-CZ2 3.95Å; L331-W355 HydrophobicContact CG-CD2 4.43Å; L331-W355 HydrophobicContact CG-CZ2 4.27Å
332	I	98.5	Very high	85.7	Confident	0 Å²	0	39 Å²	39	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	136.4	-174	-57.1	-56.2	0	0	0	109.9	H308 I310 Y330 C353 G354 K356 F360 W361	H308-I332 HydrophobicContact CB-CG2 3.93Å; I310-I332 HydrophobicContact CG1-CD1 3.77Å; Y330-I332 PolarHBondContact O-N 3.18Å; I332-C353 CarbonylContact O-C 3.51Å; I332-C353 VanDerWaalsContact O-CA 3.32Å; I332-C353 WeakPolarHBondContact O-CA 3.32Å; I332-G354 PolarHBondContact N-O 2.89Å; I332-G354 PolarHBondContact O-N 3.13Å; I332-K356 HydrophobicContact CB-CG 3.97Å; I332-K356 HydrophobicContact CG1-CB 4.07Å; I332-K356 HydrophobicContact CG1-CG 3.58Å; I332-F360 HydrophobicContact CD1-CE1 4.14Å; I332-F360 HydrophobicContact CG1-CD1 4.31Å; I332-F360 HydrophobicContact CG1-CE1 3.94Å; I332-F360 HydrophobicContact CG1-CZ 4.25Å; I332-F360 HydrophobicContact CG2-CE1 4.39Å; I332-F360 HydrophobicContact CG2-CZ 4.07Å; I332-W361 HydrophobicContact CD1-CH2 3.82Å; I332-W361 HydrophobicContact CD1-CZ2 4.01Å
333	L	98.7	Very high	87.7	Confident	1 Å²	1	37.8 Å²	37.8	1%	0.005	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	108.8	165.2	-174.7	76.9	0	0	0	107.8	P165 Y185 Y187 T209 T309 I311 P335 C353	P165-L333 HydrophobicContact CG-CD1 3.62Å; Y185-L333 HydrophobicContact CD2-CD2 4.11Å; Y185-L333 HydrophobicContact CE2-CD2 3.53Å; Y187-L333 HydrophobicContact CD1-CD1 4.23Å; Y187-L333 HydrophobicContact CD2-CD1 3.46Å; Y187-L333 VanDerWaalsContact CD2-CD1 3.46Å; Y187-L333 HydrophobicContact CD2-CD2 3.57Å; Y187-L333 HydrophobicContact CD2-CG 3.45Å; Y187-L333 VanDerWaalsContact CD2-CG 3.45Å; Y187-L333 HydrophobicContact CE1-CD1 4.4Å; Y187-L333 HydrophobicContact CE2-CD1 3.66Å; Y187-L333 HydrophobicContact CE2-CD2 4.22Å; Y187-L333 HydrophobicContact CE2-CG 3.61Å; Y187-L333 HydrophobicContact CG-CD1 3.75Å; Y187-L333 HydrophobicContact CG-CD2 4.24Å; Y187-L333 HydrophobicContact CG-CG 4.21Å; T209-L333 HydrophobicContact CG2-CD2 3.86Å; T309-L333 WeakPolarHBondContact CB-O 3.28Å; T309-L333 PolarHBondContact N-O 3.15Å; T309-L333 PolarHBondContact O-N 2.81Å; I311-L333 HydrophobicContact CD1-CB 4.11Å; I311-L333 HydrophobicContact CG1-CB 4.39Å; I311-L333 HydrophobicContact CG2-CB 4.43Å; L333-P335 WeakPolarHBondContact O-CD 3.37Å; L333-C353 HydrophobicContact CD1-CB 3.84Å
334	D	98.6	Very high	89.7	Confident	21 Å²	21	35.8 Å²	35.8	11%	0.112	21%	0.205	C	C	.	.			trans	-91.9	110.4	-166.9	-172.2	-22	0	0	0	111.4	Y187 H308 H336 W352	Y187-D334 PolarHBondContact OH-O 3.02Å; H308-D334 IonicContact CD2-OD1 2.75Å; H308-D334 IonicContact CD2-OD2 3.73Å; H308-D334 IonicContact NE2-OD1 3.03Å; H308-D334 IonicContact NE2-OD2 3.66Å; D334-H336 PolarHBondContact O-N 2.77Å; D334-H336 VanDerWaalsContact O-N 3.12Å; D334-H336 VanDerWaalsContact OD1-CB 3.3Å; D334-H336 WeakPolarHBondContact OD1-CB 3.32Å; D334-H336 IonicContact OD1-CE1 3.97Å; D334-H336 IonicContact OD1-CG 2.85Å; D334-H336 VanDerWaalsContact OD1-CG 3.31Å; D334-H336 PolarHBondContact OD1-N 3Å; D334-H336 IonicContact OD1-ND1 2.97Å; D334-H336 PolarHBondContact OD1-ND1 3.34Å; D334-W352 HydrophobicContact CB-CE3 4.01Å; D334-W352 WeakPolarHBondContact CB-O 3.45Å; D334-W352 PolarHBondContact N-O 3.43Å
335	P	98.5	Very high	91.7	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-8.7	-177.8	30.2	-35.3	0	0	0	113.9	H189 Y190 C202 R205 A307 L333 Y337	H189-P335 CarbonylContact C-O 3.48Å; H189-P335 VanDerWaalsContact CA-O 3.27Å; H189-P335 WeakPolarHBondContact CA-O 3.4Å; H189-P335 WeakPolarHBondContact CB-O 3.32Å; Y190-P335 WeakPolarHBondContact CD1-O 3.2Å; Y190-P335 PolarHBondContact N-O 3.42Å; C202-P335 HydrophobicContact CB-CG 3.89Å; C202-P335 WeakPolarHBondContact O-CG 3.39Å; R205-P335 HydrophobicContact CB-CB 3.7Å; A307-P335 WeakPolarHBondContact O-CD 3.49Å; A307-P335 WeakPolarHBondContact O-CG 3.21Å; L333-P335 WeakPolarHBondContact O-CD 3.37Å; P335-Y337 VanDerWaalsContact C-N 3.26Å; P335-Y337 PolarHBondContact O-N 2.85Å
336	H	98.3	Very high	93.7	Very high	29 Å²	29	35.1 Å²	35.1	13%	0.134	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	-0.6	-174.5	-51.7	91.8	0	0	0	113.9	Y190 C202 L306 A307 H308 D334 T338 W352	Y190-H336 VanDerWaalsContact CD2-CA 3.49Å; Y190-H336 HydrophobicContact CD2-CB 4.13Å; Y190-H336 WeakPolarHBondContact CD2-O 3.15Å; Y190-H336 HydrophobicContact CE2-CB 3.84Å; Y190-H336 AromaticContact CE2-CD2 3.56Å; Y190-H336 AromaticContact CZ-CD2 3.53Å; Y190-H336 PolarHBondContact OH-CD2 2.99Å; Y190-H336 VanDerWaalsContact OH-CD2 3.22Å; C202-H336 VanDerWaalsContact CB-NE2 3.31Å; C202-H336 WeakPolarHBondContact CB-NE2 3.28Å; L306-H336 WeakPolarHBondContact CD2-NE2 3.46Å; A307-H336 PolarHBondContact O-CE1 2.84Å; H308-H336 AromaticContact CE1-CE1 3.95Å; H308-H336 AromaticContact NE2-CE1 3.69Å; H308-H336 AromaticContact NE2-ND1 3.74Å; D334-H336 PolarHBondContact O-N 2.77Å; D334-H336 VanDerWaalsContact O-N 3.12Å; D334-H336 VanDerWaalsContact OD1-CB 3.3Å; D334-H336 WeakPolarHBondContact OD1-CB 3.32Å; D334-H336 IonicContact OD1-CE1 3.97Å; D334-H336 IonicContact OD1-CG 2.85Å; D334-H336 VanDerWaalsContact OD1-CG 3.31Å; D334-H336 PolarHBondContact OD1-N 3Å; D334-H336 IonicContact OD1-ND1 2.97Å; D334-H336 PolarHBondContact OD1-ND1 3.34Å; H336-T338 PolarHBondContact O-N 2.8Å; H336-W352 HydrophobicContact CB-CZ3 4.02Å
337	Y	98.2	Very high	95.4	Very high	2 Å²	2	34 Å²	34	1%	0.008	19%	0.187	C	C	.	.			trans	-60.2	123.7	178.7	176.2	-110.3	0	0	0	111.7	Y187 H189 Y190 P335 G339 P340 L346 I347 W352	Y187-Y337 VanDerWaalsContact OH-CB 3.23Å; Y187-Y337 WeakPolarHBondContact OH-CB 3.28Å; H189-Y337 AromaticContact CD2-CD1 3.86Å; H189-Y337 AromaticContact CE1-CD1 3.51Å; H189-Y337 AromaticContact CE1-CE1 3.94Å; H189-Y337 AromaticContact CG-CD1 3.87Å; H189-Y337 AromaticContact ND1-CD1 3.65Å; H189-Y337 PolarHBondContact ND1-O 3.17Å; H189-Y337 AromaticContact NE2-CD1 3.66Å; Y190-Y337 PolarHBondContact N-O 2.93Å; P335-Y337 VanDerWaalsContact C-N 3.26Å; P335-Y337 PolarHBondContact O-N 2.85Å; Y337-G339 WeakPolarHBondContact CE1-O 3.46Å; Y337-G339 VanDerWaalsContact CZ-C 3.44Å; Y337-G339 WeakPolarHBondContact OH-CA 3.37Å; Y337-P340 WeakPolarHBondContact CE1-O 3.49Å; Y337-P340 WeakPolarHBondContact OH-CD 3.49Å; Y337-P340 PolarHBondContact OH-O 3.15Å; Y337-L346 HydrophobicContact CE2-CD2 3.95Å; Y337-L346 HydrophobicContact CE2-CG 4.35Å; Y337-I347 HydrophobicContact CD1-CD1 4.16Å; Y337-I347 HydrophobicContact CD1-CG1 4.05Å; Y337-I347 HydrophobicContact CD2-CG1 4.28Å; Y337-I347 HydrophobicContact CE1-CD1 3.78Å; Y337-I347 HydrophobicContact CE1-CG1 3.78Å; Y337-I347 HydrophobicContact CE2-CG1 3.99Å; Y337-I347 HydrophobicContact CG-CG1 4.3Å; Y337-W352 HydrophobicContact CD2-CB 4.47Å; Y337-W352 AromaticContact CD2-CD1 3.57Å; Y337-W352 AromaticContact CD2-CD2 3.72Å; Y337-W352 HydrophobicContact CD2-CD2 3.72Å; Y337-W352 AromaticContact CD2-CE2 3.64Å; Y337-W352 HydrophobicContact CD2-CE3 4.46Å; Y337-W352 AromaticContact CD2-CG 3.69Å; Y337-W352 HydrophobicContact CD2-CG 3.69Å; Y337-W352 HydrophobicContact CD2-CZ2 4.3Å; Y337-W352 AromaticContact CD2-NE1 3.53Å; Y337-W352 AromaticContact CE2-NE1 3.99Å; Y337-W352 HydrophobicContact CG-CD2 4.23Å; Y337-W352 HydrophobicContact CG-CG 4.23Å
338	T	97.6	Very high	96.2	Very high	68 Å²	68	33.9 Å²	33.9	42%	0.417	19%	0.185	S	C	.	.			trans	-115.5	7.8	178.7	60	0	0	0	0	113.2	Y190 L191 R198 H336	Y190-T338 HydrophobicContact CD2-CG2 3.97Å; Y190-T338 HydrophobicContact CG-CG2 4.45Å; L191-T338 HydrophobicContact CD1-CG2 4.06Å; L191-T338 HydrophobicContact CG-CG2 4.28Å; R198-T338 HydrophobicContact CG-CG2 3.95Å; H336-T338 PolarHBondContact O-N 2.8Å
339	G	96	Very high	96.4	Very high	22 Å²	22	38.5 Å²	38.5	23%	0.227	21%	0.206	C	C	.	.	S	Bend	trans	-76.6	-175.4	-178.2	0	0	0	0	0	112.7	Y337 F341	Y337-G339 WeakPolarHBondContact CE1-O 3.46Å; Y337-G339 VanDerWaalsContact CZ-C 3.44Å; Y337-G339 WeakPolarHBondContact OH-CA 3.37Å; G339-F341 PolarHBondContact O-N 3.43Å
340	P	95.7	Very high	96.5	Very high	83 Å²	83	44.5 Å²	44.5	54%	0.539	23%	0.233	S	C	.	.			trans	-54.7	136.9	178.9	-24.5	33.9	0	0	0	112.4	Y337 N343	Y337-P340 WeakPolarHBondContact CE1-O 3.49Å; Y337-P340 WeakPolarHBondContact OH-CD 3.49Å; Y337-P340 PolarHBondContact OH-O 3.15Å; P340-N343 HydrophobicContact CB-CB 4.36Å
341	F	94.2	Very high	96.4	Very high	87 Å²	87	45.1 Å²	45.1	38%	0.382	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.2	150.6	177.4	-50.4	-46.2	0	0	0	111.4	E160 H189 L191 Q192 G339 N343	E160-F341 HydrophobicContact CB-CB 4.27Å; E160-F341 HydrophobicContact CG-CB 4.34Å; E160-F341 HydrophobicContact CG-CD2 4.02Å; E160-F341 HydrophobicContact CG-CG 4.45Å; H189-F341 AromaticContact CE1-CD1 3.75Å; L191-F341 WeakPolarHBondContact O-CZ 3.46Å; Q192-F341 HydrophobicContact CG-CD1 4.37Å; Q192-F341 HydrophobicContact CG-CE1 4.07Å; G339-F341 PolarHBondContact O-N 3.43Å; F341-N343 PolarHBondContact O-N 2.93Å
342	G	90.4	Very high	96.4	Very high	21 Å²	21	48.3 Å²	48.3	22%	0.216	25%	0.252	C	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	-3.5	177.5	0	0	0	0	0	116.3	I344	G342-I344 VanDerWaalsContact C-N 3.29Å; G342-I344 PolarHBondContact O-N 2.89Å
343	N	94.8	Very high	96.4	Very high	60 Å²	60	48.3 Å²	48.3	32%	0.321	25%	0.252	S	S	.	.			trans	-77.1	77.1	-175.7	-166.9	-22.9	0	0	0	112.3	P340 F341 K345 L346 I347	P340-N343 HydrophobicContact CB-CB 4.36Å; F341-N343 PolarHBondContact O-N 2.93Å; N343-K345 PolarHBondContact O-N 3.43Å; N343-L346 HydrophobicContact CB-CB 4.19Å; N343-L346 PolarHBondContact O-N 3.27Å; N343-L346 WeakPolarHBondContact OD1-CB 3.37Å; N343-L346 PolarHBondContact OD1-N 3.02Å; N343-I347 WeakPolarHBondContact O-CD1 3.14Å; N343-I347 VanDerWaalsContact O-CG1 3.32Å; N343-I347 WeakPolarHBondContact O-CG1 3.42Å; N343-I347 PolarHBondContact O-N 3.49Å
344	I	94.8	Very high	96.4	Very high	46 Å²	46	48.6 Å²	48.6	24%	0.236	25%	0.254	C	S	.	.	H	α-helix	trans	-57.4	-37.3	-176.8	-173.6	62.4	0	0	0	112.6	L162 P165 V168 G342 I347 T348	L162-I344 HydrophobicContact CD1-CB 4.19Å; L162-I344 HydrophobicContact CD1-CD1 4.01Å; L162-I344 HydrophobicContact CD2-CB 4.36Å; P165-I344 HydrophobicContact CB-CD1 3.47Å; P165-I344 VanDerWaalsContact CB-CD1 3.47Å; V168-I344 HydrophobicContact CG2-CD1 3.67Å; V168-I344 HydrophobicContact CG2-CG1 3.49Å; V168-I344 VanDerWaalsContact CG2-CG1 3.49Å; G342-I344 VanDerWaalsContact C-N 3.29Å; G342-I344 PolarHBondContact O-N 2.89Å; I344-I347 PolarHBondContact O-N 3.1Å; I344-T348 HydrophobicContact CD1-CG2 4.12Å; I344-T348 PolarHBondContact O-N 3.47Å; I344-T348 PolarHBondContact O-OG1 3.32Å; I344-T348 VanDerWaalsContact O-OG1 3.08Å
345	K	94.8	Very high	96.3	Very high	131 Å²	131	49.4 Å²	49.4	57%	0.57	26%	0.256	S	S	*	.	H	α-helix	trans	-64.1	-50.4	-179.9	-174.5	179.5	179.9	-177.5	0	110.8	N343 I347 T348 E349	N343-K345 PolarHBondContact O-N 3.43Å; K345-I347 VanDerWaalsContact C-N 3.31Å; K345-I347 PolarHBondContact O-N 3.13Å; K345-T348 PolarHBondContact O-N 2.96Å; K345-T348 PolarHBondContact O-OG1 3.07Å; K345-E349 VanDerWaalsContact CE-CD 3.43Å; K345-E349 WeakPolarHBondContact CE-OE1 3.11Å; K345-E349 WeakPolarHBondContact CE-OE2 3.42Å; K345-E349 VanDerWaalsContact CG-CD 3.43Å; K345-E349 HydrophobicContact CG-CG 4.2Å; K345-E349 WeakPolarHBondContact CG-OE1 3.23Å; K345-E349 VanDerWaalsContact O-CB 3.25Å; K345-E349 WeakPolarHBondContact O-CB 3.32Å; K345-E349 VanDerWaalsContact O-CG 3.31Å; K345-E349 WeakPolarHBondContact O-CG 3.29Å; K345-E349 PolarHBondContact O-N 2.89Å
346	L	96.6	Very high	96.2	Very high	52 Å²	52	51.9 Å²	51.9	27%	0.272	27%	0.267	S	S	.	.	H	α-helix	trans	-62.4	-40.7	177.8	-173.2	68.8	0	0	0	111.5	Y337 N343 K350	Y337-L346 HydrophobicContact CE2-CD2 3.95Å; Y337-L346 HydrophobicContact CE2-CG 4.35Å; N343-L346 HydrophobicContact CB-CB 4.19Å; N343-L346 PolarHBondContact O-N 3.27Å; N343-L346 WeakPolarHBondContact OD1-CB 3.37Å; N343-L346 PolarHBondContact OD1-N 3.02Å; L346-K350 HydrophobicContact CD1-CG 3.6Å; L346-K350 HydrophobicContact CG-CG 4.27Å; L346-K350 VanDerWaalsContact O-CB 3.27Å; L346-K350 WeakPolarHBondContact O-CB 3.44Å; L346-K350 WeakPolarHBondContact O-CG 3.26Å; L346-K350 PolarHBondContact O-N 3.24Å
347	I	97.5	Very high	95.9	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-44.6	-179.9	-73.9	162	0	0	0	111.7	L162 P165 Y187 Y337 N343 I344 K345 G351 W352 C353	L162-I347 HydrophobicContact CD1-CD1 3.34Å; P165-I347 HydrophobicContact CB-CG2 4.47Å; Y187-I347 HydrophobicContact CD1-CD1 4.2Å; Y187-I347 HydrophobicContact CD1-CG2 4.47Å; Y187-I347 HydrophobicContact CE1-CD1 3.79Å; Y187-I347 HydrophobicContact CE1-CG1 4.16Å; Y187-I347 HydrophobicContact CE1-CG2 3.87Å; Y337-I347 HydrophobicContact CD1-CD1 4.16Å; Y337-I347 HydrophobicContact CD1-CG1 4.05Å; Y337-I347 HydrophobicContact CD2-CG1 4.28Å; Y337-I347 HydrophobicContact CE1-CD1 3.78Å; Y337-I347 HydrophobicContact CE1-CG1 3.78Å; Y337-I347 HydrophobicContact CE2-CG1 3.99Å; Y337-I347 HydrophobicContact CG-CG1 4.3Å; N343-I347 WeakPolarHBondContact O-CD1 3.14Å; N343-I347 VanDerWaalsContact O-CG1 3.32Å; N343-I347 WeakPolarHBondContact O-CG1 3.42Å; N343-I347 PolarHBondContact O-N 3.49Å; I344-I347 PolarHBondContact O-N 3.1Å; K345-I347 VanDerWaalsContact C-N 3.31Å; K345-I347 PolarHBondContact O-N 3.13Å; I347-G351 PolarHBondContact O-N 3.42Å; I347-W352 HydrophobicContact CG2-CB 4.18Å; I347-W352 WeakPolarHBondContact O-CB 3.28Å; I347-W352 PolarHBondContact O-N 3.46Å; I347-C353 HydrophobicContact CG2-CB 3.74Å; I347-C353 PolarHBondContact O-N 2.98Å; I347-C353 VanDerWaalsContact O-N 3.1Å
348	T	95.9	Very high	95.5	Very high	31 Å²	31	55.5 Å²	55.5	19%	0.19	29%	0.285	C	S	.	.	H	α-helix	trans	-81.5	-42.7	-179.4	57	0	0	0	0	112.9	V168 V169 I344 K345 K350 G351	V168-T348 HydrophobicContact CG2-CG2 3.99Å; V169-T348 HydrophobicContact CG2-CG2 3.6Å; I344-T348 HydrophobicContact CD1-CG2 4.12Å; I344-T348 PolarHBondContact O-N 3.47Å; I344-T348 PolarHBondContact O-OG1 3.32Å; I344-T348 VanDerWaalsContact O-OG1 3.08Å; K345-T348 PolarHBondContact O-N 2.96Å; K345-T348 PolarHBondContact O-OG1 3.07Å; T348-K350 PolarHBondContact O-N 3.12Å; T348-G351 PolarHBondContact O-N 3.2Å; T348-G351 VanDerWaalsContact O-N 3.13Å
349	E	95.4	Very high	95.2	Very high	128 Å²	128	58.4 Å²	58.4	60%	0.598	30%	0.298	S	S	*	.	H	α-helix	trans	-68.4	-34.2	-178	-70.6	179.4	171.9	0	0	113	K345 G351	K345-E349 VanDerWaalsContact CE-CD 3.43Å; K345-E349 WeakPolarHBondContact CE-OE1 3.11Å; K345-E349 WeakPolarHBondContact CE-OE2 3.42Å; K345-E349 VanDerWaalsContact CG-CD 3.43Å; K345-E349 HydrophobicContact CG-CG 4.2Å; K345-E349 WeakPolarHBondContact CG-OE1 3.23Å; K345-E349 VanDerWaalsContact O-CB 3.25Å; K345-E349 WeakPolarHBondContact O-CB 3.32Å; K345-E349 VanDerWaalsContact O-CG 3.31Å; K345-E349 WeakPolarHBondContact O-CG 3.29Å; K345-E349 PolarHBondContact O-N 2.89Å; E349-G351 VanDerWaalsContact C-N 3.29Å
350	K	96.7	Very high	95.1	Very high	148 Å²	148	59.8 Å²	59.8	64%	0.643	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	0.9	174.2	-59.1	-63.2	-176	-179.2	0	113.1	L346 T348 W352	L346-K350 HydrophobicContact CD1-CG 3.6Å; L346-K350 HydrophobicContact CG-CG 4.27Å; L346-K350 VanDerWaalsContact O-CB 3.27Å; L346-K350 WeakPolarHBondContact O-CB 3.44Å; L346-K350 WeakPolarHBondContact O-CG 3.26Å; L346-K350 PolarHBondContact O-N 3.24Å; T348-K350 PolarHBondContact O-N 3.12Å; K350-W352 PolarHBondContact O-N 3.39Å
351	G	96.3	Very high	95.1	Very high	14 Å²	14	56.2 Å²	56.2	14%	0.144	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.9	26.7	173.7	0	0	0	0	0	114.9	I347 T348 E349 C353 K356	I347-G351 PolarHBondContact O-N 3.42Å; T348-G351 PolarHBondContact O-N 3.2Å; T348-G351 VanDerWaalsContact O-N 3.13Å; E349-G351 VanDerWaalsContact C-N 3.29Å; G351-C353 VanDerWaalsContact C-N 3.29Å; G351-K356 WeakPolarHBondContact O-CE 3.27Å; G351-K356 PolarHBondContact O-NZ 2.89Å
352	W	98	Very high	95.2	Very high	70 Å²	70	58.4 Å²	58.4	27%	0.265	28%	0.283	S	S	.	.	S	Bend	trans	-68.9	-32.4	166.8	-61	101.1	0	0	0	111	D334 H336 Y337 I347 K350	D334-W352 HydrophobicContact CB-CE3 4.01Å; D334-W352 WeakPolarHBondContact CB-O 3.45Å; D334-W352 PolarHBondContact N-O 3.43Å; H336-W352 HydrophobicContact CB-CZ3 4.02Å; Y337-W352 HydrophobicContact CD2-CB 4.47Å; Y337-W352 AromaticContact CD2-CD1 3.57Å; Y337-W352 AromaticContact CD2-CD2 3.72Å; Y337-W352 HydrophobicContact CD2-CD2 3.72Å; Y337-W352 AromaticContact CD2-CE2 3.64Å; Y337-W352 HydrophobicContact CD2-CE3 4.46Å; Y337-W352 AromaticContact CD2-CG 3.69Å; Y337-W352 HydrophobicContact CD2-CG 3.69Å; Y337-W352 HydrophobicContact CD2-CZ2 4.3Å; Y337-W352 AromaticContact CD2-NE1 3.53Å; Y337-W352 AromaticContact CE2-NE1 3.99Å; Y337-W352 HydrophobicContact CG-CD2 4.23Å; Y337-W352 HydrophobicContact CG-CG 4.23Å; I347-W352 HydrophobicContact CG2-CB 4.18Å; I347-W352 WeakPolarHBondContact O-CB 3.28Å; I347-W352 PolarHBondContact O-N 3.46Å; K350-W352 PolarHBondContact O-N 3.39Å
353	C	98.4	Very high	95.4	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	110.8	160.1	-173.1	0	0	0	0	107.7	P165 V169 I332 L333 I347 G351	P165-C353 HydrophobicContact CB-CB 4.31Å; P165-C353 HydrophobicContact CG-CB 4.36Å; V169-C353 HydrophobicContact CG2-CB 4.25Å; V169-C353 VanDerWaalsContact CG2-O 3.24Å; V169-C353 WeakPolarHBondContact CG2-O 3.4Å; I332-C353 CarbonylContact O-C 3.51Å; I332-C353 VanDerWaalsContact O-CA 3.32Å; I332-C353 WeakPolarHBondContact O-CA 3.32Å; L333-C353 HydrophobicContact CD1-CB 3.84Å; I347-C353 HydrophobicContact CG2-CB 3.74Å; I347-C353 PolarHBondContact O-N 2.98Å; I347-C353 VanDerWaalsContact O-N 3.1Å; G351-C353 VanDerWaalsContact C-N 3.29Å
354	G	97.7	Very high	95.3	Very high	6 Å²	6	63.8 Å²	63.8	6%	0.062	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.8	163.8	-173.4	0	0	0	0	0	115.3	I332	I332-G354 PolarHBondContact N-O 2.89Å; I332-G354 PolarHBondContact O-N 3.13Å
355	W	96.4	Very high	95.4	Very high	39 Å²	39	63.3 Å²	63.3	15%	0.148	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	131	175.2	-68.7	99.9	0	0	0	110.9	P172 T178 I180 Q314 R329 Y330 L331	P172-W355 HydrophobicContact CB-CB 4.48Å; P172-W355 HydrophobicContact CB-CD2 4.24Å; P172-W355 HydrophobicContact CB-CG 4.05Å; P172-W355 HydrophobicContact CG-CD2 3.85Å; P172-W355 HydrophobicContact CG-CE3 4.38Å; P172-W355 HydrophobicContact CG-CG 4.1Å; P172-W355 HydrophobicContact CG-CZ2 4.17Å; T178-W355 HydrophobicContact CG2-CH2 3.54Å; T178-W355 HydrophobicContact CG2-CZ2 3.74Å; I180-W355 HydrophobicContact CG2-CH2 4.04Å; I180-W355 HydrophobicContact CG2-CZ2 4.08Å; Q314-W355 HydrophobicContact CB-CH2 4.47Å; Q314-W355 HydrophobicContact CB-CZ3 4.05Å; R329-W355 HydrophobicContact CB-CE3 3.81Å; R329-W355 HydrophobicContact CB-CZ3 4.42Å; Y330-W355 CarbonylContact O-C 3.46Å; Y330-W355 WeakPolarHBondContact O-CA 3.48Å; L331-W355 HydrophobicContact CB-CD2 3.93Å; L331-W355 HydrophobicContact CB-CE3 3.73Å; L331-W355 HydrophobicContact CB-CH2 3.71Å; L331-W355 HydrophobicContact CB-CZ2 3.91Å; L331-W355 HydrophobicContact CB-CZ3 3.63Å; L331-W355 HydrophobicContact CD1-CD2 3.93Å; L331-W355 HydrophobicContact CD1-CG 4.03Å; L331-W355 HydrophobicContact CD1-CZ2 4.31Å; L331-W355 HydrophobicContact CD2-CH2 4.35Å; L331-W355 HydrophobicContact CD2-CZ2 3.95Å; L331-W355 HydrophobicContact CG-CD2 4.43Å; L331-W355 HydrophobicContact CG-CZ2 4.27Å
356	K	95.5	Very high	95.5	Very high	52 Å²	52	61.7 Å²	61.7	23%	0.226	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	144	179.3	-54.9	-63.1	-179.2	175.4	0	110.3	R329 Y330 I332 G351 F360	R329-K356 CarbonylContact C-O 3.57Å; R329-K356 VanDerWaalsContact CA-O 3.27Å; R329-K356 WeakPolarHBondContact CA-O 3.43Å; Y330-K356 PolarHBondContact N-O 3.17Å; Y330-K356 PolarHBondContact O-N 3.22Å; I332-K356 HydrophobicContact CB-CG 3.97Å; I332-K356 HydrophobicContact CG1-CB 4.07Å; I332-K356 HydrophobicContact CG1-CG 3.58Å; G351-K356 WeakPolarHBondContact O-CE 3.27Å; G351-K356 PolarHBondContact O-NZ 2.89Å; K356-F360 HydrophobicContact CB-CB 3.85Å; K356-F360 HydrophobicContact CB-CD1 4.43Å; K356-F360 HydrophobicContact CB-CD2 4.09Å; K356-F360 HydrophobicContact CB-CG 3.87Å; K356-F360 HydrophobicContact CD-CD2 4.1Å; K356-F360 HydrophobicContact CD-CE2 4.42Å; K356-F360 HydrophobicContact CG-CD2 3.9Å; K356-F360 HydrophobicContact CG-CE2 4.22Å; K356-F360 HydrophobicContact CG-CG 4.12Å
357	L	93.3	Very high	95.5	Very high	42 Å²	42	60 Å²	60	22%	0.22	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	173.2	175.1	-71.4	166.8	0	0	0	110.9	R329 N359 F360	R329-L357 HydrophobicContact CG-CD2 3.95Å; L357-N359 WeakPolarHBondContact CB-OD1 3.36Å; L357-N359 PolarHBondContact O-N 3.4Å; L357-F360 WeakPolarHBondContact O-CB 3.17Å; L357-F360 PolarHBondContact O-N 3.35Å
358	Q	88.7	Confident	95.6	Very high	66 Å²	66	62.5 Å²	62.5	31%	0.308	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-56.4	-33.5	179.8	-177.2	179.9	3.8	0	0	113.8	H278 N281 F360 W361	H278-Q358 PolarHBondContact O-NE2 2.7Å; N281-Q358 PolarHBondContact ND2-OE1 2.95Å; Q358-F360 PolarHBondContact O-N 3.28Å; Q358-W361 PolarHBondContact O-N 3.33Å
359	N	91.4	Very high	95.7	Very high	128 Å²	128	61 Å²	61	68%	0.684	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-64.4	-8.4	178.3	66	-8.2	0	0	0	114.1	L357 W361	L357-N359 WeakPolarHBondContact CB-OD1 3.36Å; L357-N359 PolarHBondContact O-N 3.4Å; N359-W361 PolarHBondContact O-N 3.33Å
360	F	95	Very high	95.9	Very high	52 Å²	52	55 Å²	55	23%	0.228	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-62.8	-33.5	169.4	-179	-103.6	0	0	0	112.2	H308 I332 K356 L357 Q358	H308-F360 AromaticContact CD2-CZ 3.73Å; H308-F360 AromaticContact CE1-CZ 3.75Å; H308-F360 AromaticContact CG-CZ 3.92Å; H308-F360 AromaticContact ND1-CZ 3.93Å; H308-F360 AromaticContact NE2-CZ 3.61Å; I332-F360 HydrophobicContact CD1-CE1 4.14Å; I332-F360 HydrophobicContact CG1-CD1 4.31Å; I332-F360 HydrophobicContact CG1-CE1 3.94Å; I332-F360 HydrophobicContact CG1-CZ 4.25Å; I332-F360 HydrophobicContact CG2-CE1 4.39Å; I332-F360 HydrophobicContact CG2-CZ 4.07Å; K356-F360 HydrophobicContact CB-CB 3.85Å; K356-F360 HydrophobicContact CB-CD1 4.43Å; K356-F360 HydrophobicContact CB-CD2 4.09Å; K356-F360 HydrophobicContact CB-CG 3.87Å; K356-F360 HydrophobicContact CD-CD2 4.1Å; K356-F360 HydrophobicContact CD-CE2 4.42Å; K356-F360 HydrophobicContact CG-CD2 3.9Å; K356-F360 HydrophobicContact CG-CE2 4.22Å; K356-F360 HydrophobicContact CG-CG 4.12Å; L357-F360 WeakPolarHBondContact O-CB 3.17Å; L357-F360 PolarHBondContact O-N 3.35Å; Q358-F360 PolarHBondContact O-N 3.28Å
361	W	95.5	Very high	95.9	Very high	8 Å²	8	48.3 Å²	48.3	3%	0.03	24%	0.242	C	C	.	.	S	Bend	trans	-83.4	125.4	177.6	-48	112.6	0	0	0	109.7	M280 V301 I310 Y330 I332 Q358 N359 S363 Y367	M280-W361 HydrophobicContact CB-CG 4.08Å; M280-W361 HydrophobicContact CE-CD2 3.62Å; M280-W361 HydrophobicContact CE-CE3 3.65Å; M280-W361 HydrophobicContact CE-CG 4.11Å; M280-W361 HydrophobicContact CE-CH2 4.32Å; M280-W361 HydrophobicContact CE-CZ2 4.27Å; M280-W361 HydrophobicContact CE-CZ3 4.01Å; M280-W361 HydrophobicContact CG-CD2 4.15Å; M280-W361 HydrophobicContact CG-CG 4.07Å; M280-W361 HydrophobicContact CG-CZ2 4.49Å; V301-W361 HydrophobicContact CG1-CH2 3.86Å; V301-W361 HydrophobicContact CG1-CZ3 3.93Å; V301-W361 HydrophobicContact CG2-CH2 4.35Å; V301-W361 HydrophobicContact CG2-CZ3 4Å; I310-W361 HydrophobicContact CD1-CH2 3.84Å; I310-W361 HydrophobicContact CD1-CZ2 4.07Å; I310-W361 HydrophobicContact CG1-CH2 4.05Å; I310-W361 HydrophobicContact CG1-CZ2 4.43Å; Y330-W361 AromaticContact CD1-CZ2 3.97Å; Y330-W361 HydrophobicContact CD1-CZ2 3.97Å; Y330-W361 HydrophobicContact CD2-CZ2 4.18Å; Y330-W361 AromaticContact CD2-NE1 3.25Å; Y330-W361 VanDerWaalsContact CD2-NE1 3.25Å; Y330-W361 AromaticContact CE2-NE1 3.24Å; Y330-W361 AromaticContact CG-CZ2 3.79Å; Y330-W361 HydrophobicContact CG-CZ2 3.79Å; Y330-W361 AromaticContact CG-NE1 3.77Å; Y330-W361 AromaticContact CZ-NE1 3.73Å; I332-W361 HydrophobicContact CD1-CH2 3.82Å; I332-W361 HydrophobicContact CD1-CZ2 4.01Å; Q358-W361 PolarHBondContact O-N 3.33Å; N359-W361 PolarHBondContact O-N 3.33Å; W361-S363 PolarHBondContact O-N 3.37Å; W361-Y367 HydrophobicContact CB-CE2 4.19Å; W361-Y367 HydrophobicContact CE3-CD1 4.13Å; W361-Y367 AromaticContact CE3-CE1 3.66Å; W361-Y367 HydrophobicContact CE3-CE1 3.66Å; W361-Y367 HydrophobicContact CE3-CE2 4.5Å; W361-Y367 AromaticContact CE3-CZ 3.87Å; W361-Y367 HydrophobicContact CZ3-CD1 4.36Å; W361-Y367 HydrophobicContact CZ3-CE1 4.09Å
362	K	95.8	Very high	96	Very high	132 Å²	132	47.8 Å²	47.8	57%	0.574	24%	0.236	S	C	*	.			trans	-68.2	119.7	176.9	-68.8	-177.1	178.9	-179.5	0	108.9	G277 N364 V365 Y367	G277-K362 WeakPolarHBondContact CA-O 3.41Å; K362-N364 VanDerWaalsContact C-N 3.3Å; K362-N364 PolarHBondContact O-N 3.31Å; K362-N364 VanDerWaalsContact O-N 3.14Å; K362-V365 HydrophobicContact CB-CB 3.97Å; K362-V365 HydrophobicContact CB-CG2 3.58Å; K362-V365 HydrophobicContact CD-CG2 4.06Å; K362-V365 HydrophobicContact CG-CG2 4.47Å; K362-V365 PolarHBondContact O-N 3.24Å; K362-V365 VanDerWaalsContact O-N 3.13Å; K362-Y367 PolarHBondContact N-OH 3.38Å
363	S	94.2	Very high	95.7	Very high	58 Å²	58	46.8 Å²	46.8	41%	0.406	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-46.8	-171.2	-174.5	0	0	0	0	114	Q276 G277 H278 W361	Q276-S363 CarbonylContact C-O 3.07Å; Q276-S363 WeakPolarHBondContact CB-O 3.49Å; G277-S363 PolarHBondContact N-O 3.14Å; H278-S363 PolarHBondContact N-O 2.95Å; H278-S363 PolarHBondContact ND1-O 3.48Å; H278-S363 PolarHBondContact ND1-OG 3.34Å; W361-S363 PolarHBondContact O-N 3.37Å
364	N	94.3	Very high	95.1	Very high	137 Å²	137	50 Å²	50	73%	0.733	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	21	-171.5	-56.8	-16.2	0	0	0	113.2	K362	K362-N364 VanDerWaalsContact C-N 3.3Å; K362-N364 PolarHBondContact O-N 3.31Å; K362-N364 VanDerWaalsContact O-N 3.14Å
365	V	95.7	Very high	94.1	Very high	35 Å²	35	51.6 Å²	51.6	21%	0.212	26%	0.264	C	S	.	.			trans	-108.1	134.8	177.7	174.5	0	0	0	0	108.7	Q276 G277 K362 Y367	Q276-V365 CarbonylContact C-O 3.52Å; Q276-V365 WeakPolarHBondContact CA-O 3.47Å; G277-V365 PolarHBondContact N-O 3.35Å; K362-V365 HydrophobicContact CB-CB 3.97Å; K362-V365 HydrophobicContact CB-CG2 3.58Å; K362-V365 HydrophobicContact CD-CG2 4.06Å; K362-V365 HydrophobicContact CG-CG2 4.47Å; K362-V365 PolarHBondContact O-N 3.24Å; K362-V365 VanDerWaalsContact O-N 3.13Å; V365-Y367 HydrophobicContact CB-CE2 3.99Å; V365-Y367 HydrophobicContact CG1-CE2 4.03Å; V365-Y367 VanDerWaalsContact O-CD2 3.26Å; V365-Y367 WeakPolarHBondContact O-CD2 3.42Å; V365-Y367 WeakPolarHBondContact O-CE2 3.48Å
366	H	96.3	Very high	92.6	Very high	97 Å²	97	56 Å²	56	45%	0.449	28%	0.284	S	S	.	.			trans	-76.2	146.2	170.6	68.2	-92.4	0	0	0	110.3	I274 P275 G303	I274-H366 CarbonylContact O-C 3.56Å; I274-H366 WeakPolarHBondContact O-CA 3.15Å; P275-H366 VanDerWaalsContact O-CA 3.22Å; P275-H366 WeakPolarHBondContact O-CA 3.41Å; P275-H366 VanDerWaalsContact O-CB 3.26Å; P275-H366 WeakPolarHBondContact O-CB 3.47Å; G303-H366 WeakPolarHBondContact CA-O 3.33Å
367	Y	98.2	Very high	90.6	Very high	16 Å²	16	57.3 Å²	57.3	6%	0.063	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	140.6	177.1	-68.9	-91.1	0	0	0	110.8	I274 M280 V301 G302 W361 K362 V365	I274-Y367 PolarHBondContact N-O 3.19Å; I274-Y367 PolarHBondContact O-N 2.97Å; M280-Y367 HydrophobicContact CE-CD1 4.08Å; M280-Y367 HydrophobicContact CE-CD2 3.95Å; M280-Y367 HydrophobicContact CE-CG 3.64Å; V301-Y367 HydrophobicContact CG2-CD1 3.79Å; V301-Y367 HydrophobicContact CG2-CG 4.44Å; G302-Y367 CarbonylContact O-C 3.54Å; G302-Y367 VanDerWaalsContact O-CA 3.28Å; G302-Y367 WeakPolarHBondContact O-CA 3.41Å; W361-Y367 HydrophobicContact CB-CE2 4.19Å; W361-Y367 HydrophobicContact CE3-CD1 4.13Å; W361-Y367 AromaticContact CE3-CE1 3.66Å; W361-Y367 HydrophobicContact CE3-CE1 3.66Å; W361-Y367 HydrophobicContact CE3-CE2 4.5Å; W361-Y367 AromaticContact CE3-CZ 3.87Å; W361-Y367 HydrophobicContact CZ3-CD1 4.36Å; W361-Y367 HydrophobicContact CZ3-CE1 4.09Å; K362-Y367 PolarHBondContact N-OH 3.38Å; V365-Y367 HydrophobicContact CB-CE2 3.99Å; V365-Y367 HydrophobicContact CG1-CE2 4.03Å; V365-Y367 VanDerWaalsContact O-CD2 3.26Å; V365-Y367 WeakPolarHBondContact O-CD2 3.42Å; V365-Y367 WeakPolarHBondContact O-CE2 3.48Å
368	N	98.2	Very high	88.6	Confident	54 Å²	54	61.1 Å²	61.1	29%	0.289	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	133.6	168.6	-67.3	-51.6	0	0	0	108.2	S254 H273 V301 G302	S254-N368 PolarHBondContact OG-O 3.21Å; H273-N368 PolarHBondContact ND1-OD1 3.24Å; V301-N368 WeakPolarHBondContact CA-O 3.35Å; G302-N368 PolarHBondContact N-O 2.74Å; G302-N368 PolarHBondContact O-N 3.44Å
369	L	98.7	Very high	86.9	Confident	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	130.4	177.2	-70.7	75.2	0	0	0	108.6	L271 L272 I274 M280 A284 L288 I299 M300 V301 I310 L371	L271-L369 CarbonylContact C-O 3.39Å; L271-L369 VanDerWaalsContact CA-O 3.32Å; L271-L369 WeakPolarHBondContact CA-O 3.31Å; L272-L369 HydrophobicContact CB-CB 4.27Å; L272-L369 PolarHBondContact N-O 3.37Å; L272-L369 PolarHBondContact O-N 2.76Å; I274-L369 HydrophobicContact CG1-CD1 3.74Å; M280-L369 HydrophobicContact CE-CD1 4.28Å; M280-L369 HydrophobicContact SD-CD1 4.15Å; A284-L369 HydrophobicContact CB-CD2 4.43Å; L288-L369 HydrophobicContact CD2-CD2 3.83Å; I299-L369 HydrophobicContact CG2-CB 3.97Å; I299-L369 HydrophobicContact CG2-CD2 4.2Å; I299-L369 HydrophobicContact CG2-CG 4.37Å; M300-L369 CarbonylContact O-C 3.43Å; M300-L369 WeakPolarHBondContact O-CA 3.48Å; V301-L369 HydrophobicContact CB-CG 4.05Å; V301-L369 HydrophobicContact CG2-CD1 3.87Å; V301-L369 HydrophobicContact CG2-CG 3.86Å; I310-L369 HydrophobicContact CD1-CD2 3.94Å; L369-L371 HydrophobicContact CB-CD1 3.64Å; L369-L371 WeakPolarHBondContact O-CD1 3.44Å
370	C	98.6	Very high	85.3	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	105.6	173.4	-178.5	0	0	0	0	109.5	V257 C269 L271 M300	V257-C370 HydrophobicContact CG1-CB 4.29Å; C269-C370 VanDerWaalsContact CB-SG 3.53Å; L271-C370 HydrophobicContact CD2-CB 3.98Å; M300-C370 HydrophobicContact CB-CB 4.36Å; M300-C370 PolarHBondContact N-O 3.46Å; M300-C370 PolarHBondContact O-N 2.91Å
371	L	98.4	Very high	84.8	Confident	9 Å²	9	53.4 Å²	53.4	5%	0.047	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	124	-176.7	-67.9	76.9	0	0	0	109.3	C269 R270 L272 H291 I299 L369	C269-L371 WeakPolarHBondContact CA-O 3.12Å; C269-L371 WeakPolarHBondContact CB-O 2.97Å; R270-L371 HydrophobicContact CB-CB 4.32Å; R270-L371 PolarHBondContact N-O 3.04Å; R270-L371 PolarHBondContact O-N 2.98Å; L272-L371 HydrophobicContact CB-CD1 3.98Å; H291-L371 HydrophobicContact CB-CD2 4.11Å; I299-L371 HydrophobicContact CD1-CD2 4.35Å; I299-L371 HydrophobicContact CD1-CG 4.07Å; I299-L371 HydrophobicContact CG1-CG 4.11Å; I299-L371 HydrophobicContact CG2-CD1 4.12Å; I299-L371 HydrophobicContact CG2-CG 4.03Å; L369-L371 HydrophobicContact CB-CD1 3.64Å; L369-L371 WeakPolarHBondContact O-CD1 3.44Å
372	L	96.9	Very high	84.3	Confident	2 Å²	2	55.8 Å²	55.8	1%	0.01	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-61.5	149.1	169.3	-69.2	175	0	0	0	110.7	L210 W213 L214 L261 I267 H291	L210-L372 HydrophobicContact CB-CD1 4.2Å; L210-L372 HydrophobicContact CD2-CD1 4.46Å; L210-L372 HydrophobicContact CD2-CD2 4.27Å; L210-L372 HydrophobicContact CD2-CG 4.13Å; L210-L372 HydrophobicContact CG-CD1 4.03Å; L210-L372 HydrophobicContact CG-CG 4.25Å; W213-L372 HydrophobicContact CE3-CD1 3.72Å; W213-L372 HydrophobicContact CZ3-CD1 4.11Å; L214-L372 HydrophobicContact CD1-CD2 3.95Å; L214-L372 HydrophobicContact CD2-CD1 4.29Å; L214-L372 HydrophobicContact CD2-CD2 4.35Å; L214-L372 HydrophobicContact CG-CD1 4.19Å; L214-L372 HydrophobicContact CG-CD2 4.36Å; L261-L372 HydrophobicContact CD1-CD2 3.79Å; I267-L372 HydrophobicContact CG2-CD2 4.32Å; H291-L372 PolarHBondContact CE1-O 3.03Å
373	P	92.3	Very high	83.6	Confident	50 Å²	50	51.6 Å²	51.6	33%	0.325	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-63.2	156	174.2	28.3	-34.2	0	0	0	110.8	I267	I267-P373 HydrophobicContact CG2-CG 3.91Å
374	P	85.3	Confident	83	Confident	68 Å²	68	51.2 Å²	51.2	44%	0.442	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-53.8	149.4	165.8	-19.6	30.8	0	0	0	110	K376	P374-K376 PolarHBondContact O-N 3.2Å
375	R	76.7	Confident	82.3	Confident	38 Å²	38	45.8 Å²	45.8	14%	0.143	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-53	135.2	173.7	-72	-177.6	-84.6	-177.5	-3.4	109.6	P137 T182 W213 E219 G295 S377	P137-R375 HydrophobicContact CG-CB 4.37Å; T182-R375 PolarHBondContact OG1-NH2 2.74Å; W213-R375 HydrophobicContact CH2-CG 3.8Å; W213-R375 HydrophobicContact CZ2-CG 4.42Å; E219-R375 WeakPolarHBondContact OE1-CB 3.31Å; E219-R375 VanDerWaalsContact OE1-CG 3.31Å; E219-R375 WeakPolarHBondContact OE1-CG 3.25Å; G295-R375 PolarHBondContact O-NE 3.44Å; R375-S377 PolarHBondContact O-N 2.64Å; R375-S377 VanDerWaalsContact O-N 3.08Å
376	K	66.1	Low	81.4	Confident	131 Å²	131	46.5 Å²	46.5	57%	0.57	25%	0.25	S	S	*	.	P	Polyproline II helix	trans	-60.5	117.2	-174.5	-71.5	-179.8	-179.8	174.3	0	110.1	P374 N378 C379	P374-K376 PolarHBondContact O-N 3.2Å; K376-N378 PolarHBondContact O-N 3.11Å; K376-C379 HydrophobicContact CB-CB 4.32Å; K376-C379 PolarHBondContact O-N 3.18Å
377	S	53.2	Low	80.3	Confident	80 Å²	80	42.9 Å²	42.9	56%	0.559	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-1.7	-174.5	-22.3	0	0	0	0	115.1	D135 R375	D135-S377 CarbonylContact C-O 3.55Å; D135-S377 WeakPolarHBondContact CA-O 3.32Å; D135-S377 VanDerWaalsContact CB-O 3.26Å; D135-S377 WeakPolarHBondContact CB-O 3.36Å; D135-S377 CarbonylContact O-C 3.39Å; D135-S377 VanDerWaalsContact O-CA 3.31Å; D135-S377 WeakPolarHBondContact O-CA 3.4Å; D135-S377 VanDerWaalsContact O-O 3.14Å; R375-S377 PolarHBondContact O-N 2.64Å; R375-S377 VanDerWaalsContact O-N 3.08Å
378	N	51.8	Low	78.9	Confident	123 Å²	123	45 Å²	45	66%	0.658	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-119	22.5	-174.6	-74.2	-9.6	0	0	0	113.1	R120 K376	R120-N378 PolarHBondContact NH2-O 2.92Å; R120-N378 VanDerWaalsContact NH2-O 3.08Å; K376-N378 PolarHBondContact O-N 3.11Å
379	C	52.9	Low	77.3	Confident	27 Å²	27	44.3 Å²	44.3	18%	0.182	25%	0.246	C	C	.	.			trans	-125.9	66.3	-162.7	-74.3	0	0	0	0	112.8	R140 K376	R140-C379 PolarHBondContact NH2-O 3.22Å; K376-C379 HydrophobicContact CB-CB 4.32Å; K376-C379 PolarHBondContact O-N 3.18Å
380	V	57.1	Low	75.4	Confident	3 Å²	3	48.3 Å²	48.3	2%	0.018	27%	0.269	C	S	.	.			trans	-55.4	0	132.7	-160.4	0	0	0	0	109.5	R120 R123 K124 H127 M134 R140	R120-V380 WeakPolarHBondContact CG-O 3.48Å; R120-V380 PolarHBondContact NE-O 3.34Å; R123-V380 HydrophobicContact CB-CG1 3.4Å; R123-V380 VanDerWaalsContact CB-CG1 3.4Å; R123-V380 VanDerWaalsContact CZ-OXT 3.23Å; R123-V380 PolarHBondContact NE-OXT 3.17Å; R123-V380 PolarHBondContact NH2-OXT 3.4Å; R123-V380 WeakPolarHBondContact O-CG1 3.45Å; K124-V380 VanDerWaalsContact CA-CG1 3.45Å; K124-V380 HydrophobicContact CB-CG1 4.29Å; K124-V380 HydrophobicContact CG-CB 3.78Å; K124-V380 HydrophobicContact CG-CG1 3.88Å; H127-V380 HydrophobicContact CB-CG1 4.15Å; H127-V380 HydrophobicContact CB-CG2 4.17Å; H127-V380 VanDerWaalsContact CD2-CG1 3.49Å; H127-V380 WeakPolarHBondContact CD2-CG1 3.49Å; M134-V380 HydrophobicContact CB-CG2 4.05Å; M134-V380 HydrophobicContact CE-CG2 4Å; M134-V380 HydrophobicContact CG-CG2 4.46Å; M134-V380 VanDerWaalsContact O-CG2 3.28Å; M134-V380 WeakPolarHBondContact O-CG2 3.45Å; M134-V380 HydrophobicContact SD-CG2 3.63Å; R140-V380 PolarHBondContact NH2-OXT 3.19Å; R140-V380 VanDerWaalsContact NH2-OXT 3.1Å

Retrieved 380 of 380 residues in 421.2 ms (Link to these results)

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