A0A077YVA1_TRITR Loading...

RNA helicase

AlphaFold DB , UniProt , Accession A0A077YVA1, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 441 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.5	Very low	30.8	Very low	252 Å²	252	145.4 Å²	145.4	100%	1.241	86%	0.861	S	S	*	*				0	96	0	-80.1	174.1	159.4	0	0	106.8
2	A	29.5	Very low	30.7	Very low	111 Å²	111	145.6 Å²	145.6	92%	0.917	86%	0.855	S	S	*	*			trans	-116.9	123	-178.2	0	0	0	0	0	107.6
3	A	28.4	Very low	30.6	Very low	92 Å²	92	149.2 Å²	149.2	76%	0.76	85%	0.847	S	S	*	*			trans	-127.1	123.4	179.9	0	0	0	0	0	108.3
4	V	29.8	Very low	30.6	Very low	147 Å²	147	150.9 Å²	150.9	89%	0.891	85%	0.845	S	S	*	*			trans	59.5	116.3	140.7	-165.9	0	0	0	0	120.7
5	A	31.5	Very low	30.8	Very low	84 Å²	84	150.8 Å²	150.8	69%	0.694	84%	0.842	S	S	*	*			trans	176.4	144	132.2	0	0	0	0	0	106
6	D	35.8	Very low	30.7	Very low	159 Å²	159	152.2 Å²	152.2	85%	0.85	84%	0.84	S	S	*	*			cis	-149.6	148.6	24.6	-94.7	-40.8	0	0	0	109.2
7	G	33.4	Very low	30.8	Very low	76 Å²	76	151.2 Å²	151.2	78%	0.784	84%	0.839	S	S	*	*			trans	-84.5	132.4	171.5	0	0	0	0	0	111.2
8	E	32.3	Very low	30.8	Very low	191 Å²	191	152.8 Å²	152.8	89%	0.893	84%	0.839	S	S	*	*			trans	-88.7	109.2	165.3	-75.4	-176.3	155.6	0	0	108.5
9	E	31.6	Very low	30.7	Very low	192 Å²	192	153.4 Å²	153.4	90%	0.897	84%	0.841	S	S	*	*			trans	-72.8	117.2	178.3	-152.1	169.1	-157.5	0	0	108.9
10	L	27.4	Very low	30.7	Very low	156 Å²	156	151.1 Å²	151.1	82%	0.817	84%	0.837	S	S	*	*			trans	-68.9	126.5	174	-92.6	108.3	0	0	0	109.6	D12	L10-D12 PolarHBondContact O-N 3.17Å
11	L	27.4	Very low	30.4	Very low	139 Å²	139	152.4 Å²	152.4	73%	0.728	84%	0.842	S	S	*	*			trans	-78.7	106.7	174.7	-74.3	158.6	0	0	0	110	Y13	L11-Y13 HydrophobicContact CB-CD2 4.4Å; L11-Y13 HydrophobicContact CB-CE2 3.98Å; L11-Y13 PolarHBondContact O-N 3.03Å
12	D	30.1	Very low	30.3	Very low	148 Å²	148	147.1 Å²	147.1	79%	0.791	82%	0.823	S	S	*	*			trans	-74.3	111.2	168.7	-71.2	-29.9	0	0	0	109.4	L10	L10-D12 PolarHBondContact O-N 3.17Å
13	Y	29.1	Very low	30	Very low	192 Å²	192	147.9 Å²	147.9	75%	0.753	82%	0.817	S	S	*	*			trans	-92	99.8	169.1	-75.9	-88.5	0	0	0	108.5	L11 D15	L11-Y13 HydrophobicContact CB-CD2 4.4Å; L11-Y13 HydrophobicContact CB-CE2 3.98Å; L11-Y13 PolarHBondContact O-N 3.03Å; Y13-D15 PolarHBondContact O-N 3.04Å
14	E	31	Very low	29.8	Very low	173 Å²	173	148.2 Å²	148.2	81%	0.808	82%	0.819	S	S	*	*			trans	-79.7	102.7	166.8	-68.9	-177.9	159.8	0	0	108.9	E16	E14-E16 PolarHBondContact O-N 3.45Å
15	D	33.4	Very low	29.5	Very low	150 Å²	150	145.4 Å²	145.4	80%	0.802	81%	0.811	S	S	*	*			trans	-86	85.5	169.8	-77.2	-32.4	0	0	0	109.5	Y13	Y13-D15 PolarHBondContact O-N 3.04Å
16	E	29.7	Very low	29.3	Very low	173 Å²	173	148.9 Å²	148.9	81%	0.808	82%	0.818	S	S	*	*			trans	-84.5	112.6	155.6	-73.3	-171.6	160.8	0	0	108.6	E14	E14-E16 PolarHBondContact O-N 3.45Å
17	T	31.5	Very low	28.7	Very low	135 Å²	135	149.9 Å²	149.9	83%	0.828	82%	0.818	S	S	*	*			trans	-127.2	100.4	163.8	30.6	0	0	0	0	109.4
18	E	31.8	Very low	28.4	Very low	181 Å²	181	156.2 Å²	156.2	85%	0.846	82%	0.824	S	S	*	*			trans	-66.7	140.4	169.4	-71.1	-176.9	139.4	0	0	111.7
19	D	28.9	Very low	27.9	Very low	164 Å²	164	155.5 Å²	155.5	88%	0.877	82%	0.82	S	S	*	*			trans	-57.6	128.2	166.6	-81.1	-45.6	0	0	0	111.4
20	S	30.2	Very low	27.6	Very low	107 Å²	107	153.7 Å²	153.7	75%	0.748	82%	0.816	S	S	*	*			trans	-151.8	99.4	163.6	-74.1	0	0	0	0	111.3	V22	S20-V22 PolarHBondContact O-N 3.18Å
21	L	24.6	Very low	27.4	Very low	179 Å²	179	152.1 Å²	152.1	94%	0.937	81%	0.813	S	S	*	*			trans	-55.7	123.5	163.8	-71.4	144.5	0	0	0	110.6
22	V	28.5	Very low	27.3	Very low	140 Å²	140	153.4 Å²	153.4	85%	0.848	82%	0.821	S	S	*	*			trans	-135.3	123.1	161.8	-168	0	0	0	0	109.9	S20	S20-V22 PolarHBondContact O-N 3.18Å
23	T	23.9	Very low	27.2	Very low	128 Å²	128	149.4 Å²	149.4	79%	0.785	81%	0.814	S	S	*	*			trans	-102.4	138.4	176.5	41.4	0	0	0	0	109.9
24	A	24.1	Very low	26.9	Very low	99 Å²	99	145.8 Å²	145.8	82%	0.818	82%	0.817	S	S	*	*			trans	60.5	135.3	145.9	0	0	0	0	0	122.1
25	A	24.2	Very low	26.8	Very low	87 Å²	87	143.9 Å²	143.9	72%	0.719	82%	0.817	S	S	*	*			trans	77	110.3	157.4	0	0	0	0	0	117.5
26	D	27.2	Very low	26.4	Very low	158 Å²	158	146.3 Å²	146.3	85%	0.845	82%	0.821	S	S	*	*				-177.3	150.1	83.8	-107.4	-23.1	0	0	0	112.2
27	E	23	Very low	26.5	Very low	179 Å²	179	143.7 Å²	143.7	84%	0.836	82%	0.819	S	S	*	*			trans	-61.9	141.2	177.3	-61.5	172.8	143.9	0	0	112.9
28	K	27.1	Very low	26.3	Very low	209 Å²	209	142.8 Å²	142.8	91%	0.909	81%	0.813	S	S	*	*			trans	-168.5	129.1	134.2	-106.8	161	-171.3	175.8	0	113
29	Q	21.1	Very low	26.2	Very low	177 Å²	177	140.8 Å²	140.8	83%	0.827	81%	0.813	S	S	*	*			trans	-54.7	147.7	165	-66.8	163.6	-11.6	0	0	111.5
30	L	24.4	Very low	26.2	Very low	154 Å²	154	141.9 Å²	141.9	81%	0.806	81%	0.81	S	S	*	*				170.2	136.2	120.6	-87.2	153.9	0	0	0	113.1
31	T	24.9	Very low	26.3	Very low	122 Å²	122	139.2 Å²	139.2	75%	0.748	80%	0.8	S	S	*	*			trans	71.4	101.6	145.7	58.7	0	0	0	0	121.8
32	D	25.1	Very low	26.7	Very low	167 Å²	167	135.4 Å²	135.4	89%	0.893	79%	0.794	S	S	*	*				21.9	114.7	121.3	-157	11.6	0	0	0	118.4
33	G	26.7	Very low	27.3	Very low	64 Å²	64	138.1 Å²	138.1	66%	0.66	79%	0.79	S	S	*	*			trans	-166.9	91.6	175.8	0	0	0	0	0	109.8	T35	G33-T35 PolarHBondContact O-N 2.88Å; G33-T35 VanDerWaalsContact O-N 3.17Å
34	S	23.9	Very low	27.8	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	79%	0.788	S	S	*	*			trans	-57.8	108.9	177	59	0	0	0	0	112.7
35	T	28.1	Very low	28.3	Very low	132 Å²	132	137 Å²	137	81%	0.81	79%	0.787	S	S	*	*			trans	-130.5	116	161.1	24.6	0	0	0	0	109.3	G33	G33-T35 PolarHBondContact O-N 2.88Å; G33-T35 VanDerWaalsContact O-N 3.17Å
36	K	24.8	Very low	29.2	Very low	201 Å²	201	139.6 Å²	139.6	87%	0.874	79%	0.788	S	S	*	*			trans	-49.6	132.3	177	-72.2	174.3	173.7	176.8	0	110.1	T38	K36-T38 PolarHBondContact O-N 3.36Å
37	P	31.5	Very low	30.1	Very low	118 Å²	118	138.4 Å²	138.4	77%	0.766	78%	0.777	S	S	*	*			trans	-71.9	107.6	176.2	29.7	-30.5	0	0	0	107.6	V39	P37-V39 PolarHBondContact O-N 2.95Å
38	T	28	Very low	31.5	Very low	117 Å²	117	135.8 Å²	135.8	72%	0.718	78%	0.778	S	S	*	*			trans	-58.7	109.4	159.4	40	0	0	0	0	106.9	K36 K40	K36-T38 PolarHBondContact O-N 3.36Å; T38-K40 PolarHBondContact O-N 2.83Å
39	V	30.3	Very low	33.4	Very low	139 Å²	139	126.7 Å²	126.7	84%	0.842	74%	0.741	S	S	*	*			trans	-66.9	74.1	170.5	-176.1	0	0	0	0	107.3	P37 G41	P37-V39 PolarHBondContact O-N 2.95Å; V39-G41 PolarHBondContact O-N 3.5Å
40	K	28.1	Very low	36.3	Very low	186 Å²	186	119.1 Å²	119.1	81%	0.809	71%	0.71	S	S	*	*			trans	-70.9	119	161.7	-78.1	-173.6	174.2	-176.9	0	105.1	T38 A42	T38-K40 PolarHBondContact O-N 2.83Å; K40-A42 PolarHBondContact O-N 3.49Å
41	G	33.7	Very low	39.2	Very low	52 Å²	52	112.2 Å²	112.2	54%	0.536	67%	0.674	S	S	.	*			trans	-44.4	138.3	-173.5	0	0	0	0	0	111.6	V39 Y43	V39-G41 PolarHBondContact O-N 3.5Å; G41-Y43 PolarHBondContact O-N 3.12Å
42	A	32.7	Very low	42.1	Very low	98 Å²	98	115 Å²	115	81%	0.81	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	46.8	-176.4	0	0	0	0	0	113.6	K40	K40-A42 PolarHBondContact O-N 3.49Å
43	Y	40.8	Very low	45	Very low	198 Å²	198	111.8 Å²	111.8	78%	0.776	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-12.9	170.9	-77.3	-75.7	0	0	0	112.6	G41 S45	G41-Y43 PolarHBondContact O-N 3.12Å; Y43-S45 PolarHBondContact O-N 2.99Å
44	A	34.4	Very low	48	Very low	90 Å²	90	109.9 Å²	109.9	74%	0.744	63%	0.627	S	S	*	*	S	Bend	trans	-89.5	92.6	171.5	0	0	0	0	0	109.9
45	S	34.7	Very low	51	Low	114 Å²	114	111.5 Å²	111.5	80%	0.797	63%	0.626	S	S	*	*	S	Bend	trans	146.1	3.1	141.8	76.7	0	0	0	0	116.2	Y43 H47	Y43-S45 PolarHBondContact O-N 2.99Å; S45-H47 PolarHBondContact O-N 2.88Å
46	I	42	Very low	54	Low	141 Å²	141	105.7 Å²	105.7	72%	0.723	59%	0.59	S	S	*	*	S	Bend	trans	-84.2	88.1	175.9	-54.6	178.6	0	0	0	108.3
47	H	46.9	Very low	57.3	Low	133 Å²	133	99.2 Å²	99.2	62%	0.616	56%	0.561	S	S	*	*			trans	61.2	103.6	174.1	-55	-68.5	0	0	0	114.6	S45 S49	S45-H47 PolarHBondContact O-N 2.88Å; H47-S49 PolarHBondContact O-N 3.46Å
48	S	52.2	Low	60.3	Low	124 Å²	124	98.1 Å²	98.1	87%	0.867	56%	0.555	S	S	*	*			trans	-64.5	23.1	173.5	72	0	0	0	0	114.1	G50	S48-G50 PolarHBondContact O-N 3.38Å
49	S	67.2	Low	63.5	Low	18 Å²	18	96.5 Å²	96.5	13%	0.126	54%	0.539	C	S	.	.			trans	-74.7	121	-176.8	59.8	0	0	0	0	110.3	H47 D53 P72 H77	H47-S49 PolarHBondContact O-N 3.46Å; S49-D53 VanDerWaalsContact C-OD2 3.31Å; S49-D53 WeakPolarHBondContact CA-OD2 3.48Å; S49-D53 WeakPolarHBondContact CB-OD2 3.49Å; S49-P72 VanDerWaalsContact O-CD 3.31Å; S49-P72 WeakPolarHBondContact O-CD 3.36Å; S49-H77 PolarHBondContact OG-CE1 3.44Å; S49-H77 PolarHBondContact OG-ND1 3.33Å
50	G	82	Confident	66.6	Low	18 Å²	18	89.9 Å²	89.9	19%	0.186	50%	0.499	C	S	.	.			trans	-84.9	170.2	171.5	0	0	0	0	0	111.5	S48 R52 D53	S48-G50 PolarHBondContact O-N 3.38Å; G50-R52 PolarHBondContact O-N 3.28Å; G50-R52 VanDerWaalsContact O-N 3.09Å; G50-D53 PolarHBondContact N-OD2 3.48Å; G50-D53 PolarHBondContact O-N 3.07Å
51	F	85.6	Confident	69.7	Low	9 Å²	9	82.7 Å²	82.7	4%	0.039	47%	0.469	C	S	.	.	G	3₁₀ helix	trans	-59	-21.1	170.6	-75.9	-83.1	0	0	0	113.6	D53 F54 L61 I64 F69 H71 P72 I80 L105	F51-D53 PolarHBondContact O-N 3.1Å; F51-F54 HydrophobicContact CD1-CD2 4.04Å; F51-F54 AromaticContact CD1-CE2 3.93Å; F51-F54 HydrophobicContact CD1-CE2 3.93Å; F51-F54 HydrophobicContact CE1-CE2 4.41Å; F51-F54 PolarHBondContact O-N 3.46Å; F51-L61 HydrophobicContact CB-CD2 4.21Å; F51-I64 HydrophobicContact CB-CD1 4.19Å; F51-I64 HydrophobicContact CB-CG2 4.2Å; F51-I64 HydrophobicContact CD1-CD1 4Å; F51-I64 HydrophobicContact CD1-CG2 4.34Å; F51-I64 HydrophobicContact CD2-CG2 3.71Å; F51-I64 HydrophobicContact CE2-CG2 4.12Å; F51-I64 HydrophobicContact CG-CD1 4.2Å; F51-I64 HydrophobicContact CG-CG2 3.83Å; F51-F69 HydrophobicContact CD2-CB 4.48Å; F51-F69 HydrophobicContact CE2-CB 3.79Å; F51-F69 HydrophobicContact CE2-CD1 4.37Å; F51-F69 HydrophobicContact CZ-CB 4.26Å; F51-F69 HydrophobicContact CZ-CD1 4.11Å; F51-H71 VanDerWaalsContact CE2-C 3.47Å; F51-P72 HydrophobicContact CD1-CB 4.47Å; F51-P72 HydrophobicContact CE1-CB 3.98Å; F51-P72 HydrophobicContact CE2-CB 4.11Å; F51-P72 HydrophobicContact CZ-CB 3.79Å; F51-I80 HydrophobicContact CD1-CD1 4.47Å; F51-I80 HydrophobicContact CE1-CD1 4Å; F51-L105 HydrophobicContact CD1-CD1 4.25Å; F51-L105 HydrophobicContact CE1-CD1 3.82Å
52	R	84.7	Confident	72.6	Confident	179 Å²	179	87.1 Å²	87.1	68%	0.675	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-64.4	-28.9	175.9	-66.8	-175.3	176.6	-174.9	0.4	112.6	G50 F54 L55 L61	G50-R52 PolarHBondContact O-N 3.28Å; G50-R52 VanDerWaalsContact O-N 3.09Å; R52-F54 PolarHBondContact O-N 3.06Å; R52-L55 PolarHBondContact O-N 3.09Å; R52-L55 VanDerWaalsContact O-N 3.14Å; R52-L61 HydrophobicContact CG-CD1 4.29Å; R52-L61 HydrophobicContact CG-CD2 4.08Å
53	D	87.6	Confident	75.6	Confident	101 Å²	101	82.5 Å²	82.5	54%	0.54	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-74.2	-14.8	-177.2	-56	-32.5	0	0	0	112.6	S49 G50 F51 L55	S49-D53 VanDerWaalsContact C-OD2 3.31Å; S49-D53 WeakPolarHBondContact CA-OD2 3.48Å; S49-D53 WeakPolarHBondContact CB-OD2 3.49Å; G50-D53 PolarHBondContact N-OD2 3.48Å; G50-D53 PolarHBondContact O-N 3.07Å; F51-D53 PolarHBondContact O-N 3.1Å; D53-L55 PolarHBondContact O-N 3.35Å
54	F	88.1	Confident	78	Confident	23 Å²	23	73.2 Å²	73.2	10%	0.101	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-80	4	172.6	-53.1	-39.2	0	0	0	113.4	F51 R52 M56 P72 H77 I80 P81 I84	F51-F54 HydrophobicContact CD1-CD2 4.04Å; F51-F54 AromaticContact CD1-CE2 3.93Å; F51-F54 HydrophobicContact CD1-CE2 3.93Å; F51-F54 HydrophobicContact CE1-CE2 4.41Å; F51-F54 PolarHBondContact O-N 3.46Å; R52-F54 PolarHBondContact O-N 3.06Å; F54-M56 VanDerWaalsContact C-N 3.27Å; F54-M56 HydrophobicContact CB-CG 3.85Å; F54-M56 HydrophobicContact CB-SD 4.22Å; F54-M56 PolarHBondContact O-N 2.96Å; F54-P72 HydrophobicContact CE2-CB 3.98Å; F54-P72 HydrophobicContact CE2-CG 4.04Å; F54-P72 HydrophobicContact CZ-CB 4.12Å; F54-P72 HydrophobicContact CZ-CG 3.93Å; F54-H77 AromaticContact CZ-ND1 3.95Å; F54-I80 HydrophobicContact CB-CG2 4.17Å; F54-I80 HydrophobicContact CD1-CG2 4.44Å; F54-I80 HydrophobicContact CD2-CB 4.31Å; F54-I80 HydrophobicContact CD2-CD1 4.31Å; F54-I80 HydrophobicContact CD2-CG2 3.68Å; F54-I80 HydrophobicContact CE2-CB 4.29Å; F54-I80 HydrophobicContact CE2-CD1 4.01Å; F54-I80 HydrophobicContact CE2-CG2 4.17Å; F54-I80 HydrophobicContact CG-CG2 3.85Å; F54-P81 HydrophobicContact CD1-CG 3.86Å; F54-P81 HydrophobicContact CE1-CG 3.77Å; F54-I84 HydrophobicContact CB-CD1 4.3Å
55	L	88	Confident	80.6	Confident	150 Å²	150	73.6 Å²	73.6	79%	0.785	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.4	42.9	179.1	-59.3	174.8	0	0	0	113	R52 D53 Q109	R52-L55 PolarHBondContact O-N 3.09Å; R52-L55 VanDerWaalsContact O-N 3.14Å; D53-L55 PolarHBondContact O-N 3.35Å; L55-Q109 PolarHBondContact O-NE2 3.19Å; L55-Q109 VanDerWaalsContact O-NE2 3.08Å
56	M	90.5	Very high	83.2	Confident	11 Å²	11	72 Å²	72	5%	0.054	37%	0.366	C	S	.	.			trans	-71.9	152	-177.4	-61.3	-71.6	-95.8	0	0	111.6	F54 L60 L61 I64 I84 L105 Q109	F54-M56 VanDerWaalsContact C-N 3.27Å; F54-M56 HydrophobicContact CB-CG 3.85Å; F54-M56 HydrophobicContact CB-SD 4.22Å; F54-M56 PolarHBondContact O-N 2.96Å; M56-L60 HydrophobicContact CE-CD2 3.29Å; M56-L60 HydrophobicContact CE-CG 4Å; M56-L60 HydrophobicContact SD-CD2 4.22Å; M56-L61 HydrophobicContact CB-CD1 4.4Å; M56-L61 HydrophobicContact CB-CD2 3.82Å; M56-L61 HydrophobicContact CB-CG 3.78Å; M56-L61 HydrophobicContact CG-CD2 4.36Å; M56-I64 HydrophobicContact CE-CD1 4.31Å; M56-I84 HydrophobicContact SD-CD1 3.52Å; M56-I84 VanDerWaalsContact SD-CD1 3.52Å; M56-L105 HydrophobicContact CE-CB 3.68Å; M56-L105 HydrophobicContact CE-CD1 4.36Å; M56-L105 HydrophobicContact CE-CD2 4.24Å; M56-L105 HydrophobicContact CE-CG 4.31Å; M56-Q109 HydrophobicContact SD-CB 4.13Å; M56-Q109 HydrophobicContact SD-CG 3.95Å
57	K	94.3	Very high	85.3	Confident	64 Å²	64	66 Å²	66	28%	0.278	34%	0.337	S	S	.	.			trans	-52.6	138.4	171.9	-77.1	172.5	-178.6	169.9	0	110.4	E59 L60 L61 L108 Q109 M111 M144	K57-E59 PolarHBondContact O-N 3Å; K57-L60 HydrophobicContact CB-CB 4.23Å; K57-L60 WeakPolarHBondContact O-CB 3.2Å; K57-L60 PolarHBondContact O-N 3.32Å; K57-L61 PolarHBondContact O-N 3Å; K57-L108 PolarHBondContact NZ-O 3.44Å; K57-Q109 WeakPolarHBondContact CE-O 3.47Å; K57-Q109 PolarHBondContact NZ-O 2.78Å; K57-Q109 VanDerWaalsContact NZ-O 3.07Å; K57-M111 PolarHBondContact NZ-O 2.75Å; K57-M144 HydrophobicContact CB-CE 4.36Å; K57-M144 HydrophobicContact CD-CE 4.07Å
58	P	94.7	Very high	86.9	Confident	96 Å²	96	62.4 Å²	62.4	62%	0.623	34%	0.335	S	S	*	.	H	α-helix	trans	-54.5	-37.9	-179	-27	34.9	0	0	0	113.9	L60 L61 R62	P58-L60 VanDerWaalsContact C-N 3.31Å; P58-L60 PolarHBondContact O-N 3.4Å; P58-L61 PolarHBondContact O-N 3.1Å; P58-R62 WeakPolarHBondContact O-CB 3.46Å; P58-R62 PolarHBondContact O-N 3.42Å
59	E	95.2	Very high	88.4	Confident	83 Å²	83	58.3 Å²	58.3	39%	0.388	30%	0.302	S	S	.	.	H	α-helix	trans	-62.5	-39.7	177.8	-57.1	81.8	-179.6	0	0	111.3	K57 A63 M144	K57-E59 PolarHBondContact O-N 3Å; E59-A63 PolarHBondContact O-N 3.43Å; E59-A63 VanDerWaalsContact O-N 3.09Å; E59-M144 HydrophobicContact CB-CE 4.02Å; E59-M144 HydrophobicContact CB-CG 4.08Å
60	L	94.5	Very high	88.8	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-73.1	-42.7	179.7	-165.3	55	0	0	0	111.2	M56 K57 P58 R62 A63 I64 L105 L108 Q109 F140 M144	M56-L60 HydrophobicContact CE-CD2 3.29Å; M56-L60 HydrophobicContact CE-CG 4Å; M56-L60 HydrophobicContact SD-CD2 4.22Å; K57-L60 HydrophobicContact CB-CB 4.23Å; K57-L60 WeakPolarHBondContact O-CB 3.2Å; K57-L60 PolarHBondContact O-N 3.32Å; P58-L60 VanDerWaalsContact C-N 3.31Å; P58-L60 PolarHBondContact O-N 3.4Å; L60-R62 VanDerWaalsContact C-N 3.29Å; L60-R62 PolarHBondContact O-N 2.66Å; L60-A63 PolarHBondContact O-N 3.45Å; L60-A63 VanDerWaalsContact O-N 3.16Å; L60-I64 HydrophobicContact CG-CD1 4.36Å; L60-I64 VanDerWaalsContact O-CG1 3.25Å; L60-I64 WeakPolarHBondContact O-CG1 3.27Å; L60-I64 PolarHBondContact O-N 2.92Å; L60-L105 HydrophobicContact CD1-CD2 3.64Å; L60-L105 HydrophobicContact CD2-CD2 4.18Å; L60-L105 WeakPolarHBondContact CD2-O 3.25Å; L60-L105 HydrophobicContact CG-CD2 3.9Å; L60-L108 HydrophobicContact CD1-CB 4.19Å; L60-L108 HydrophobicContact CD1-CD1 3.99Å; L60-L108 HydrophobicContact CD2-CB 4.26Å; L60-Q109 HydrophobicContact CD2-CB 4.12Å; L60-F140 HydrophobicContact CD1-CB 4.18Å; L60-F140 WeakPolarHBondContact CD1-O 3.49Å; L60-M144 HydrophobicContact CB-CE 3.72Å; L60-M144 HydrophobicContact CD1-CE 4.21Å; L60-M144 HydrophobicContact CG-CE 4.4Å
61	L	93.6	Very high	88.8	Confident	34 Å²	34	70.5 Å²	70.5	18%	0.178	35%	0.352	C	S	.	.	H	α-helix	trans	-58.8	-42.6	173.8	-73	173.2	0	0	0	111.7	F51 R52 M56 K57 P58 A63 I64 I65	F51-L61 HydrophobicContact CB-CD2 4.21Å; R52-L61 HydrophobicContact CG-CD1 4.29Å; R52-L61 HydrophobicContact CG-CD2 4.08Å; M56-L61 HydrophobicContact CB-CD1 4.4Å; M56-L61 HydrophobicContact CB-CD2 3.82Å; M56-L61 HydrophobicContact CB-CG 3.78Å; M56-L61 HydrophobicContact CG-CD2 4.36Å; K57-L61 PolarHBondContact O-N 3Å; P58-L61 PolarHBondContact O-N 3.1Å; L61-A63 VanDerWaalsContact C-N 3.34Å; L61-A63 PolarHBondContact O-N 3.31Å; L61-I64 PolarHBondContact O-N 3.31Å; L61-I65 WeakPolarHBondContact O-CG1 3.18Å; L61-I65 PolarHBondContact O-N 2.58Å; L61-I65 VanDerWaalsContact O-N 3.09Å
62	R	94.8	Very high	88.9	Confident	145 Å²	145	71 Å²	71	55%	0.547	36%	0.356	S	S	.	.	H	α-helix	trans	-62.1	-42.4	175.8	-169.5	-176.5	176.5	171.3	0.4	111.7	P58 L60 I65 D66 Y143	P58-R62 WeakPolarHBondContact O-CB 3.46Å; P58-R62 PolarHBondContact O-N 3.42Å; L60-R62 VanDerWaalsContact C-N 3.29Å; L60-R62 PolarHBondContact O-N 2.66Å; R62-I65 PolarHBondContact O-N 2.88Å; R62-D66 PolarHBondContact O-N 3.41Å; R62-D66 VanDerWaalsContact O-N 3.08Å; R62-Y143 HydrophobicContact CB-CD2 3.97Å; R62-Y143 HydrophobicContact CB-CE2 4.05Å; R62-Y143 HydrophobicContact CG-CD2 3.89Å; R62-Y143 HydrophobicContact CG-CE2 3.51Å; R62-Y143 PolarHBondContact NE-OH 3.19Å
63	A	94.8	Very high	88.8	Confident	1 Å²	1	64 Å²	64	1%	0.008	33%	0.334	C	S	.	.	H	α-helix	trans	-63.6	-43.8	175.5	0	0	0	0	0	111.8	E59 L60 L61 I65 D66 C67 F140 Y143	E59-A63 PolarHBondContact O-N 3.43Å; E59-A63 VanDerWaalsContact O-N 3.09Å; L60-A63 PolarHBondContact O-N 3.45Å; L60-A63 VanDerWaalsContact O-N 3.16Å; L61-A63 VanDerWaalsContact C-N 3.34Å; L61-A63 PolarHBondContact O-N 3.31Å; A63-I65 VanDerWaalsContact C-N 3.3Å; A63-I65 PolarHBondContact O-N 2.83Å; A63-D66 PolarHBondContact O-N 3.24Å; A63-C67 WeakPolarHBondContact O-CB 3.37Å; A63-C67 PolarHBondContact O-N 3.38Å; A63-C67 PolarHBondContact O-SG 3.4Å; A63-F140 VanDerWaalsContact CB-O 3.29Å; A63-F140 WeakPolarHBondContact CB-O 3.36Å; A63-Y143 HydrophobicContact CB-CD2 4.1Å
64	I	92.1	Very high	88.7	Confident	3 Å²	3	64.3 Å²	64.3	2%	0.015	33%	0.333	C	S	.	.	H	α-helix	trans	-55.7	-44.7	176.9	-70	166	0	0	0	111.3	F51 M56 L60 L61 C67 G68 F69 L105 F140	F51-I64 HydrophobicContact CB-CD1 4.19Å; F51-I64 HydrophobicContact CB-CG2 4.2Å; F51-I64 HydrophobicContact CD1-CD1 4Å; F51-I64 HydrophobicContact CD1-CG2 4.34Å; F51-I64 HydrophobicContact CD2-CG2 3.71Å; F51-I64 HydrophobicContact CE2-CG2 4.12Å; F51-I64 HydrophobicContact CG-CD1 4.2Å; F51-I64 HydrophobicContact CG-CG2 3.83Å; M56-I64 HydrophobicContact CE-CD1 4.31Å; L60-I64 HydrophobicContact CG-CD1 4.36Å; L60-I64 VanDerWaalsContact O-CG1 3.25Å; L60-I64 WeakPolarHBondContact O-CG1 3.27Å; L60-I64 PolarHBondContact O-N 2.92Å; L61-I64 PolarHBondContact O-N 3.31Å; I64-C67 WeakPolarHBondContact O-CB 3.2Å; I64-C67 PolarHBondContact O-N 3.44Å; I64-G68 PolarHBondContact O-N 2.81Å; I64-F69 HydrophobicContact CG2-CB 3.63Å; I64-F69 PolarHBondContact O-N 2.91Å; I64-L105 HydrophobicContact CD1-CD1 4.09Å; I64-L105 HydrophobicContact CD1-CD2 3.8Å; I64-L105 HydrophobicContact CG1-CD1 4.41Å; I64-L105 HydrophobicContact CG1-CD2 3.78Å; I64-F140 HydrophobicContact CG1-CD1 4.09Å; I64-F140 HydrophobicContact CG1-CE1 3.92Å
65	I	88.6	Confident	88.7	Confident	98 Å²	98	63.2 Å²	63.2	50%	0.503	33%	0.328	S	S	.	.	H	α-helix	trans	-64.9	-47.8	177.6	-65.7	165.6	0	0	0	111.3	L61 R62 A63 C67 G68	L61-I65 WeakPolarHBondContact O-CG1 3.18Å; L61-I65 PolarHBondContact O-N 2.58Å; L61-I65 VanDerWaalsContact O-N 3.09Å; R62-I65 PolarHBondContact O-N 2.88Å; A63-I65 VanDerWaalsContact C-N 3.3Å; A63-I65 PolarHBondContact O-N 2.83Å; I65-C67 PolarHBondContact O-N 2.87Å; I65-G68 PolarHBondContact O-N 3.29Å
66	D	90.2	Very high	88.8	Confident	81 Å²	81	56.2 Å²	56.2	43%	0.433	29%	0.291	S	S	.	.	H	α-helix	trans	-59.1	-29.3	176.3	-82.1	9.7	0	0	0	112.5	R62 A63 G68 K142 Y143	R62-D66 PolarHBondContact O-N 3.41Å; R62-D66 VanDerWaalsContact O-N 3.08Å; A63-D66 PolarHBondContact O-N 3.24Å; D66-G68 PolarHBondContact O-N 2.9Å; D66-K142 IonicContact OD2-NZ 3.69Å; D66-K142 PolarHBondContact OD2-NZ 2.94Å; D66-Y143 WeakPolarHBondContact OD2-CE2 3.27Å; D66-Y143 VanDerWaalsContact OD2-CZ 3.29Å; D66-Y143 PolarHBondContact OD2-OH 3.07Å
67	C	84.8	Confident	88.8	Confident	16 Å²	16	58.6 Å²	58.6	11%	0.108	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-10.5	175.2	-65.2	0	0	0	0	113.1	A63 I64 I65 F69 R139 F140	A63-C67 WeakPolarHBondContact O-CB 3.37Å; A63-C67 PolarHBondContact O-N 3.38Å; A63-C67 PolarHBondContact O-SG 3.4Å; I64-C67 WeakPolarHBondContact O-CB 3.2Å; I64-C67 PolarHBondContact O-N 3.44Å; I65-C67 PolarHBondContact O-N 2.87Å; C67-F69 HydrophobicContact CB-CD2 3.48Å; C67-F69 VanDerWaalsContact CB-CD2 3.48Å; C67-F69 HydrophobicContact CB-CE2 3.8Å; C67-R139 PolarHBondContact O-NH2 2.81Å; C67-R139 WeakPolarHBondContact SG-CD 3.49Å; C67-R139 WeakPolarHBondContact SG-CG 3.38Å; C67-R139 PolarHBondContact SG-NE 3.14Å; C67-F140 HydrophobicContact CB-CE1 4.28Å
68	G	82.1	Confident	88.6	Confident	57 Å²	57	59.3 Å²	59.3	59%	0.588	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.9	21.4	-178	0	0	0	0	0	114.2	I64 I65 D66 E70	I64-G68 PolarHBondContact O-N 2.81Å; I65-G68 PolarHBondContact O-N 3.29Å; D66-G68 PolarHBondContact O-N 2.9Å; G68-E70 PolarHBondContact O-N 3.15Å
69	F	81.8	Confident	88.5	Confident	38 Å²	38	54.8 Å²	54.8	17%	0.167	28%	0.277	C	S	.	.			trans	-83.6	105.1	173.8	-76.7	-100.8	0	0	0	109.6	F51 I64 C67 F140	F51-F69 HydrophobicContact CD2-CB 4.48Å; F51-F69 HydrophobicContact CE2-CB 3.79Å; F51-F69 HydrophobicContact CE2-CD1 4.37Å; F51-F69 HydrophobicContact CZ-CB 4.26Å; F51-F69 HydrophobicContact CZ-CD1 4.11Å; I64-F69 HydrophobicContact CG2-CB 3.63Å; I64-F69 PolarHBondContact O-N 2.91Å; C67-F69 HydrophobicContact CB-CD2 3.48Å; C67-F69 VanDerWaalsContact CB-CD2 3.48Å; C67-F69 HydrophobicContact CB-CE2 3.8Å; F69-F140 HydrophobicContact CD2-CE1 4.31Å; F69-F140 HydrophobicContact CD2-CZ 4.1Å; F69-F140 HydrophobicContact CE2-CE1 4.24Å; F69-F140 AromaticContact CE2-CZ 3.6Å; F69-F140 HydrophobicContact CE2-CZ 3.6Å; F69-F140 AromaticContact CZ-CZ 3.93Å; F69-F140 HydrophobicContact CZ-CZ 3.93Å
70	E	76.4	Confident	88.4	Confident	161 Å²	161	50.8 Å²	50.8	75%	0.752	26%	0.258	S	S	*	.			trans	-81.6	-52.1	178.8	-63.3	-179.3	170.4	0	0	111.7	G68	G68-E70 PolarHBondContact O-N 3.15Å
71	H	82.3	Confident	88.3	Confident	131 Å²	131	53 Å²	53	61%	0.606	27%	0.272	S	S	*	.	S	Bend	trans	-131.3	144.2	-177.9	-62.6	-68.2	0	0	0	111.7	F51	F51-H71 VanDerWaalsContact CE2-C 3.47Å
72	P	87.1	Confident	88.2	Confident	19 Å²	19	55.2 Å²	55.2	12%	0.123	28%	0.282	C	S	.	.			trans	-66.3	140.1	175.1	27.9	-33.1	0	0	0	110.6	S49 F51 F54 Q76 H77	S49-P72 VanDerWaalsContact O-CD 3.31Å; S49-P72 WeakPolarHBondContact O-CD 3.36Å; F51-P72 HydrophobicContact CD1-CB 4.47Å; F51-P72 HydrophobicContact CE1-CB 3.98Å; F51-P72 HydrophobicContact CE2-CB 4.11Å; F51-P72 HydrophobicContact CZ-CB 3.79Å; F54-P72 HydrophobicContact CE2-CB 3.98Å; F54-P72 HydrophobicContact CE2-CG 4.04Å; F54-P72 HydrophobicContact CZ-CB 4.12Å; F54-P72 HydrophobicContact CZ-CG 3.93Å; P72-Q76 HydrophobicContact CB-CB 3.89Å; P72-H77 HydrophobicContact CB-CB 4.44Å; P72-H77 HydrophobicContact CG-CB 4.43Å
73	S	84	Confident	88.1	Confident	31 Å²	31	48.3 Å²	48.3	22%	0.217	26%	0.256	C	S	.	.			trans	-66.1	165.5	168.8	72.4	0	0	0	0	111.3	V75 Q76 H77 M97	S73-V75 VanDerWaalsContact C-N 3.31Å; S73-V75 PolarHBondContact O-N 3.48Å; S73-V75 WeakPolarHBondContact OG-CG1 3.2Å; S73-Q76 CarbonylContact O-C 3.56Å; S73-Q76 WeakPolarHBondContact O-CA 3.44Å; S73-Q76 WeakPolarHBondContact O-CB 3.47Å; S73-Q76 PolarHBondContact O-N 2.99Å; S73-Q76 VanDerWaalsContact OG-CG 3.27Å; S73-Q76 WeakPolarHBondContact OG-CG 3.44Å; S73-Q76 PolarHBondContact OG-N 3.43Å; S73-H77 WeakPolarHBondContact O-CB 3.4Å; S73-H77 PolarHBondContact O-N 3.06Å; S73-M97 WeakPolarHBondContact CB-O 3.47Å; S73-M97 PolarHBondContact OG-O 3.46Å
74	E	84.6	Confident	88.1	Confident	109 Å²	109	50 Å²	50	51%	0.509	26%	0.264	S	S	.	.	H	α-helix	trans	-52.3	-46.8	177.6	-177.1	-178.2	177.1	0	0	112.9	Q76 H77 Q78 V266	E74-Q76 VanDerWaalsContact C-N 3.32Å; E74-Q76 PolarHBondContact O-N 3.07Å; E74-H77 PolarHBondContact O-N 2.99Å; E74-Q78 WeakPolarHBondContact O-CG 3.25Å; E74-Q78 PolarHBondContact O-N 3.18Å; E74-Q78 PolarHBondContact OE1-NE2 2.99Å; E74-V266 HydrophobicContact CG-CG1 4.47Å
75	V	87.9	Confident	88	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-67.9	-32.9	178	67.6	0	0	0	0	111.9	S73 C79 C91 A93 M97 K99 V266	S73-V75 VanDerWaalsContact C-N 3.31Å; S73-V75 PolarHBondContact O-N 3.48Å; S73-V75 WeakPolarHBondContact OG-CG1 3.2Å; V75-C79 WeakPolarHBondContact O-CB 3.5Å; V75-C79 PolarHBondContact O-N 3.33Å; V75-C79 PolarHBondContact O-SG 3.12Å; V75-C91 WeakPolarHBondContact CG2-SG 3.41Å; V75-A93 HydrophobicContact CB-CB 4.16Å; V75-A93 HydrophobicContact CG2-CB 3.84Å; V75-M97 HydrophobicContact CG1-CB 3.71Å; V75-M97 WeakPolarHBondContact CG1-O 3.15Å; V75-K99 HydrophobicContact CG2-CG 4.45Å; V75-V266 HydrophobicContact CB-CG2 4.12Å; V75-V266 HydrophobicContact CG2-CG2 4.33Å
76	Q	91	Very high	88.1	Confident	3 Å²	3	52.1 Å²	52.1	1%	0.014	29%	0.288	C	S	.	.	H	α-helix	trans	-68.8	-44.7	174.9	-72.6	168.1	-5.3	0	0	111.1	P72 S73 E74 Q78 C79 I80 G98 V102	P72-Q76 HydrophobicContact CB-CB 3.89Å; S73-Q76 CarbonylContact O-C 3.56Å; S73-Q76 WeakPolarHBondContact O-CA 3.44Å; S73-Q76 WeakPolarHBondContact O-CB 3.47Å; S73-Q76 PolarHBondContact O-N 2.99Å; S73-Q76 VanDerWaalsContact OG-CG 3.27Å; S73-Q76 WeakPolarHBondContact OG-CG 3.44Å; S73-Q76 PolarHBondContact OG-N 3.43Å; E74-Q76 VanDerWaalsContact C-N 3.32Å; E74-Q76 PolarHBondContact O-N 3.07Å; Q76-Q78 VanDerWaalsContact C-N 3.34Å; Q76-Q78 PolarHBondContact O-N 3.44Å; Q76-C79 PolarHBondContact O-N 3.34Å; Q76-I80 HydrophobicContact CB-CD1 3.76Å; Q76-I80 HydrophobicContact CB-CG1 4.4Å; Q76-I80 HydrophobicContact CG-CD1 4.25Å; Q76-I80 WeakPolarHBondContact O-CB 3.45Å; Q76-I80 WeakPolarHBondContact O-CG1 3.22Å; Q76-I80 PolarHBondContact O-N 3.08Å; Q76-G98 PolarHBondContact NE2-O 2.94Å; Q76-V102 HydrophobicContact CB-CG2 4.37Å; Q76-V102 HydrophobicContact CG-CG2 3.77Å
77	H	89.5	Confident	88.2	Confident	60 Å²	60	49.5 Å²	49.5	28%	0.278	28%	0.278	S	S	.	.	H	α-helix	trans	-62	-41.1	178.6	-173.4	80.5	0	0	0	112.4	S49 F54 P72 S73 E74 P81	S49-H77 PolarHBondContact OG-CE1 3.44Å; S49-H77 PolarHBondContact OG-ND1 3.33Å; F54-H77 AromaticContact CZ-ND1 3.95Å; P72-H77 HydrophobicContact CB-CB 4.44Å; P72-H77 HydrophobicContact CG-CB 4.43Å; S73-H77 WeakPolarHBondContact O-CB 3.4Å; S73-H77 PolarHBondContact O-N 3.06Å; E74-H77 PolarHBondContact O-N 2.99Å; H77-P81 WeakPolarHBondContact O-CD 3.49Å; H77-P81 WeakPolarHBondContact O-CG 3.42Å
78	Q	90.2	Very high	88.7	Confident	80 Å²	80	49.7 Å²	49.7	37%	0.374	28%	0.278	S	S	.	.	H	α-helix	trans	-75.2	-41.7	177.6	-68.2	-179.3	24.3	0	0	112.8	E74 Q76 I264	E74-Q78 WeakPolarHBondContact O-CG 3.25Å; E74-Q78 PolarHBondContact O-N 3.18Å; E74-Q78 PolarHBondContact OE1-NE2 2.99Å; Q76-Q78 VanDerWaalsContact C-N 3.34Å; Q76-Q78 PolarHBondContact O-N 3.44Å; Q78-I264 HydrophobicContact CB-CD1 4.36Å; Q78-I264 HydrophobicContact CB-CG2 4.28Å
79	C	92.5	Very high	89.3	Confident	0 Å²	0	47 Å²	47	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-84.7	-40.3	-172.3	-65.4	0	0	0	0	113.7	V75 Q76 Q82 T83 V102 I264	V75-C79 WeakPolarHBondContact O-CB 3.5Å; V75-C79 PolarHBondContact O-N 3.33Å; V75-C79 PolarHBondContact O-SG 3.12Å; Q76-C79 PolarHBondContact O-N 3.34Å; C79-Q82 PolarHBondContact O-N 3.15Å; C79-Q82 VanDerWaalsContact O-N 3.14Å; C79-T83 WeakPolarHBondContact O-CG2 3.43Å; C79-T83 PolarHBondContact O-N 2.82Å; C79-T83 PolarHBondContact O-OG1 3.46Å; C79-T83 VanDerWaalsContact O-OG1 3.11Å; C79-V102 HydrophobicContact CB-CB 4.41Å; C79-V102 HydrophobicContact CB-CG1 3.36Å; C79-V102 HydrophobicContact CB-CG2 4.16Å; C79-I264 HydrophobicContact CB-CD1 4.09Å; C79-I264 WeakPolarHBondContact SG-CD1 3.17Å
80	I	93.9	Very high	90	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-46.7	-170.7	-70.9	172.4	0	0	0	112.7	F51 F54 Q76 Q82 T83 I84 V102 L105	F51-I80 HydrophobicContact CD1-CD1 4.47Å; F51-I80 HydrophobicContact CE1-CD1 4Å; F54-I80 HydrophobicContact CB-CG2 4.17Å; F54-I80 HydrophobicContact CD1-CG2 4.44Å; F54-I80 HydrophobicContact CD2-CB 4.31Å; F54-I80 HydrophobicContact CD2-CD1 4.31Å; F54-I80 HydrophobicContact CD2-CG2 3.68Å; F54-I80 HydrophobicContact CE2-CB 4.29Å; F54-I80 HydrophobicContact CE2-CD1 4.01Å; F54-I80 HydrophobicContact CE2-CG2 4.17Å; F54-I80 HydrophobicContact CG-CG2 3.85Å; Q76-I80 HydrophobicContact CB-CD1 3.76Å; Q76-I80 HydrophobicContact CB-CG1 4.4Å; Q76-I80 HydrophobicContact CG-CD1 4.25Å; Q76-I80 WeakPolarHBondContact O-CB 3.45Å; Q76-I80 WeakPolarHBondContact O-CG1 3.22Å; Q76-I80 PolarHBondContact O-N 3.08Å; I80-Q82 VanDerWaalsContact C-N 3.29Å; I80-Q82 PolarHBondContact O-N 2.84Å; I80-T83 WeakPolarHBondContact CA-OG1 3.36Å; I80-T83 PolarHBondContact O-N 3.08Å; I80-T83 PolarHBondContact O-OG1 2.63Å; I80-I84 HydrophobicContact CG2-CD1 3.46Å; I80-I84 VanDerWaalsContact CG2-CD1 3.46Å; I80-I84 HydrophobicContact CG2-CG1 4.18Å; I80-I84 WeakPolarHBondContact O-CB 3.34Å; I80-I84 VanDerWaalsContact O-CG1 3.24Å; I80-I84 WeakPolarHBondContact O-CG1 3.46Å; I80-I84 PolarHBondContact O-N 2.76Å; I80-V102 HydrophobicContact CG1-CG1 4.29Å; I80-V102 HydrophobicContact CG1-CG2 4.46Å; I80-L105 HydrophobicContact CD1-CD1 4.03Å
81	P	92.1	Very high	90.8	Very high	46 Å²	46	37.5 Å²	37.5	30%	0.299	21%	0.206	S	C	.	.	H	α-helix	trans	-60.4	-40.8	178	-24.5	35.1	0	0	0	112.3	F54 H77 V85	F54-P81 HydrophobicContact CD1-CG 3.86Å; F54-P81 HydrophobicContact CE1-CG 3.77Å; H77-P81 WeakPolarHBondContact O-CD 3.49Å; H77-P81 WeakPolarHBondContact O-CG 3.42Å; P81-V85 PolarHBondContact O-N 2.92Å
82	Q	91.9	Very high	91.2	Very high	81 Å²	81	31.7 Å²	31.7	38%	0.379	18%	0.179	S	C	.	.	H	α-helix	trans	-71	-37.9	-178.6	-57.9	-61.6	-38.4	0	0	111.9	C79 I80 V85 A87 I89 V262	C79-Q82 PolarHBondContact O-N 3.15Å; C79-Q82 VanDerWaalsContact O-N 3.14Å; I80-Q82 VanDerWaalsContact C-N 3.29Å; I80-Q82 PolarHBondContact O-N 2.84Å; Q82-V85 WeakPolarHBondContact O-CG2 3.18Å; Q82-A87 WeakPolarHBondContact O-CB 3.33Å; Q82-A87 PolarHBondContact O-N 3.3Å; Q82-I89 HydrophobicContact CB-CD1 3.81Å; Q82-V262 HydrophobicContact CB-CG1 4.39Å; Q82-V262 HydrophobicContact CG-CG1 4.22Å
83	T	93	Very high	91.2	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-71.2	-38.2	177.4	53.6	0	0	0	0	111.5	C79 I80 V85 G86 I89 V102 A106 Q110 Q227 M229	C79-T83 WeakPolarHBondContact O-CG2 3.43Å; C79-T83 PolarHBondContact O-N 2.82Å; C79-T83 PolarHBondContact O-OG1 3.46Å; C79-T83 VanDerWaalsContact O-OG1 3.11Å; I80-T83 WeakPolarHBondContact CA-OG1 3.36Å; I80-T83 PolarHBondContact O-N 3.08Å; I80-T83 PolarHBondContact O-OG1 2.63Å; T83-V85 VanDerWaalsContact C-N 3.33Å; T83-V85 PolarHBondContact O-N 3.24Å; T83-G86 PolarHBondContact O-N 2.91Å; T83-G86 VanDerWaalsContact O-N 3.11Å; T83-I89 HydrophobicContact CG2-CB 4.43Å; T83-I89 HydrophobicContact CG2-CD1 4.05Å; T83-I89 HydrophobicContact CG2-CG1 3.61Å; T83-V102 HydrophobicContact CG2-CG1 3.93Å; T83-A106 HydrophobicContact CG2-CB 4.48Å; T83-A106 WeakPolarHBondContact OG1-CB 3.35Å; T83-Q110 PolarHBondContact O-NE2 3.46Å; T83-Q227 PolarHBondContact O-NE2 3.47Å; T83-M229 HydrophobicContact CG2-SD 3.81Å
84	I	93.5	Very high	90.8	Very high	36 Å²	36	30.5 Å²	30.5	19%	0.185	17%	0.168	C	C	.	.	H	α-helix	trans	-64.5	-35.6	178.7	-72.6	170.6	0	0	0	112.1	F54 M56 I80 G86 A106 Q109 Q110	F54-I84 HydrophobicContact CB-CD1 4.3Å; M56-I84 HydrophobicContact SD-CD1 3.52Å; M56-I84 VanDerWaalsContact SD-CD1 3.52Å; I80-I84 HydrophobicContact CG2-CD1 3.46Å; I80-I84 VanDerWaalsContact CG2-CD1 3.46Å; I80-I84 HydrophobicContact CG2-CG1 4.18Å; I80-I84 WeakPolarHBondContact O-CB 3.34Å; I80-I84 VanDerWaalsContact O-CG1 3.24Å; I80-I84 WeakPolarHBondContact O-CG1 3.46Å; I80-I84 PolarHBondContact O-N 2.76Å; I84-G86 PolarHBondContact O-N 2.8Å; I84-A106 HydrophobicContact CG1-CB 4.36Å; I84-Q109 HydrophobicContact CD1-CG 4.15Å; I84-Q109 HydrophobicContact CG1-CB 4.43Å; I84-Q109 HydrophobicContact CG1-CG 4.12Å; I84-Q109 HydrophobicContact CG2-CG 4.24Å; I84-Q110 VanDerWaalsContact O-CD 3.3Å; I84-Q110 PolarHBondContact O-OE1 3.06Å
85	V	90.5	Very high	90.3	Very high	113 Å²	113	26.4 Å²	26.4	69%	0.685	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-0.4	176.1	-61	0	0	0	0	113.5	P81 Q82 T83	P81-V85 PolarHBondContact O-N 2.92Å; Q82-V85 WeakPolarHBondContact O-CG2 3.18Å; T83-V85 VanDerWaalsContact C-N 3.33Å; T83-V85 PolarHBondContact O-N 3.24Å
86	G	91.5	Very high	89.4	Confident	32 Å²	32	27 Å²	27	33%	0.33	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.2	13.1	175.2	0	0	0	0	0	115.1	T83 I84	T83-G86 PolarHBondContact O-N 2.91Å; T83-G86 VanDerWaalsContact O-N 3.11Å; I84-G86 PolarHBondContact O-N 2.8Å
87	A	92	Very high	88.7	Confident	26 Å²	26	28.9 Å²	28.9	22%	0.215	17%	0.167	C	C	.	.			trans	-69.2	145.2	177.5	0	0	0	0	0	111.7	Q82 I89 Q227 V262	Q82-A87 WeakPolarHBondContact O-CB 3.33Å; Q82-A87 PolarHBondContact O-N 3.3Å; A87-I89 WeakPolarHBondContact O-CG1 3.22Å; A87-Q227 PolarHBondContact O-NE2 3.41Å; A87-V262 HydrophobicContact CB-CG2 3.96Å
88	D	95.1	Very high	88.4	Confident	21 Å²	21	26.7 Å²	26.7	11%	0.112	16%	0.161	C	C	.	.			trans	-68.8	140.5	167.8	-77.7	-8.4	0	0	0	110.4	Q227 V228 M247 P261 V262	D88-Q227 WeakPolarHBondContact OD1-CA 3.33Å; D88-V228 VanDerWaalsContact CA-O 3.28Å; D88-V228 WeakPolarHBondContact CA-O 3.36Å; D88-V228 PolarHBondContact OD1-N 3.08Å; D88-M247 HydrophobicContact CB-CB 4.2Å; D88-M247 HydrophobicContact CB-CG 3.89Å; D88-M247 HydrophobicContact CB-SD 4.27Å; D88-M247 WeakPolarHBondContact OD2-CA 3.24Å; D88-M247 VanDerWaalsContact OD2-CB 3.27Å; D88-M247 WeakPolarHBondContact OD2-CB 3.08Å; D88-M247 WeakPolarHBondContact OD2-CG 3.44Å; D88-P261 HydrophobicContact CB-CB 3.92Å; D88-P261 CarbonylContact O-C 3.58Å; D88-P261 WeakPolarHBondContact O-CA 3.4Å; D88-V262 PolarHBondContact O-N 3.18Å
89	I	95.3	Very high	88.4	Confident	0 Å²	0	23.8 Å²	23.8	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	128	-169.2	-63.4	-82.4	0	0	0	111.1	Q82 T83 A87 C91 V228 M229 M230 F231 M247 V262 I264	Q82-I89 HydrophobicContact CB-CD1 3.81Å; T83-I89 HydrophobicContact CG2-CB 4.43Å; T83-I89 HydrophobicContact CG2-CD1 4.05Å; T83-I89 HydrophobicContact CG2-CG1 3.61Å; A87-I89 WeakPolarHBondContact O-CG1 3.22Å; I89-C91 HydrophobicContact CG2-CB 3.95Å; I89-V228 PolarHBondContact N-O 2.7Å; I89-M229 HydrophobicContact CB-CB 4.33Å; I89-M229 HydrophobicContact CB-CG 4.13Å; I89-M229 HydrophobicContact CG1-CG 4.42Å; I89-M229 CarbonylContact O-C 3.56Å; I89-M229 WeakPolarHBondContact O-CA 3.27Å; I89-M230 PolarHBondContact O-N 2.72Å; I89-F231 HydrophobicContact CG2-CE1 4.38Å; I89-F231 HydrophobicContact CG2-CZ 4.3Å; I89-M247 WeakPolarHBondContact O-CE 3.32Å; I89-V262 WeakPolarHBondContact CA-O 3.23Å; I89-V262 HydrophobicContact CD1-CB 3.78Å; I89-V262 HydrophobicContact CD1-CG1 4.01Å; I89-I264 HydrophobicContact CD1-CD1 4.41Å
90	I	95.3	Very high	88.4	Confident	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	111.4	161.1	-60.3	174.4	0	0	0	107.1	L235 C243 K244 M247 P261 V262 E263 I264	I90-L235 HydrophobicContact CG2-CD1 3.71Å; I90-C243 HydrophobicContact CD1-CB 3.85Å; I90-C243 HydrophobicContact CG1-CB 4.37Å; I90-K244 HydrophobicContact CD1-CG 3.73Å; I90-M247 HydrophobicContact CD1-CE 4.32Å; I90-M247 HydrophobicContact CD1-SD 3.72Å; I90-M247 HydrophobicContact CG1-CE 3.52Å; I90-M247 HydrophobicContact CG1-SD 3.49Å; I90-M247 WeakPolarHBondContact CG1-SD 3.18Å; I90-P261 HydrophobicContact CD1-CG 4.33Å; I90-V262 PolarHBondContact N-O 3.09Å; I90-E263 HydrophobicContact CB-CG 4.35Å; I90-E263 HydrophobicContact CD1-CG 4.48Å; I90-E263 WeakPolarHBondContact O-CA 3.49Å; I90-I264 PolarHBondContact O-N 3.27Å
91	C	93.9	Very high	88.4	Confident	0 Å²	0	25 Å²	25	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	119.5	-178.6	174.4	0	0	0	0	110.7	V75 I89 M230 F231 S232 I264	V75-C91 WeakPolarHBondContact CG2-SG 3.41Å; I89-C91 HydrophobicContact CG2-CB 3.95Å; C91-M230 PolarHBondContact N-O 3.08Å; C91-F231 HydrophobicContact CB-CD1 3.44Å; C91-F231 VanDerWaalsContact CB-CD1 3.44Å; C91-F231 HydrophobicContact CB-CE1 3.62Å; C91-F231 HydrophobicContact CB-CG 4.37Å; C91-F231 WeakPolarHBondContact O-CA 3.45Å; C91-S232 PolarHBondContact O-N 2.96Å; C91-S232 VanDerWaalsContact O-N 3.07Å; C91-I264 CarbonylContact C-O 3.55Å; C91-I264 WeakPolarHBondContact CA-O 3.44Å
92	Q	91.4	Very high	88.5	Confident	9 Å²	9	22.8 Å²	22.8	4%	0.042	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	118.1	165	-165.9	179.5	-16.3	0	0	109.2	S232 A233 L235 I264 F265 V266	Q92-S232 WeakPolarHBondContact CA-O 3.2Å; Q92-A233 PolarHBondContact NE2-O 2.88Å; Q92-L235 HydrophobicContact CB-CD1 4.21Å; Q92-L235 HydrophobicContact CG-CB 4.38Å; Q92-I264 PolarHBondContact N-O 2.72Å; Q92-F265 HydrophobicContact CB-CD1 3.56Å; Q92-F265 HydrophobicContact CB-CE1 4.1Å; Q92-V266 PolarHBondContact O-N 3.17Å
93	A	85.2	Confident	88.7	Confident	1 Å²	1	19 Å²	19	1%	0.008	12%	0.122	C	C	.	.			trans	-153.1	155.4	173	0	0	0	0	0	110.3	V75 M97 K99 S232 A233 V266	V75-A93 HydrophobicContact CB-CB 4.16Å; V75-A93 HydrophobicContact CG2-CB 3.84Å; A93-M97 HydrophobicContact CB-SD 4.16Å; A93-K99 HydrophobicContact CB-CD 4.06Å; A93-K99 HydrophobicContact CB-CG 4.17Å; A93-K99 PolarHBondContact O-NZ 2.89Å; A93-S232 PolarHBondContact N-O 3.13Å; A93-S232 VanDerWaalsContact N-O 3.12Å; A93-A233 VanDerWaalsContact O-CA 3.24Å; A93-A233 WeakPolarHBondContact O-CA 3.41Å; A93-V266 HydrophobicContact CB-CB 3.99Å; A93-V266 HydrophobicContact CB-CG2 4.36Å
94	K	75.5	Confident	88.9	Confident	23 Å²	23	19 Å²	19	10%	0.1	12%	0.122	C	C	.	.			trans	-56.4	157.5	-178.8	-68	166.2	178.7	162.6	0	112.9	M97 K99 D267 K271 L272 T273	K94-M97 HydrophobicContact CB-CG 3.96Å; K94-M97 HydrophobicContact CB-SD 3.93Å; K94-M97 PolarHBondContact O-N 3.01Å; K94-K99 PolarHBondContact O-NZ 2.94Å; K94-D267 WeakPolarHBondContact CE-OD2 3.4Å; K94-D267 IonicContact NZ-OD2 2.94Å; K94-D267 PolarHBondContact NZ-OD2 3.08Å; K94-K271 PolarHBondContact NZ-O 3.36Å; K94-L272 HydrophobicContact CD-CD2 4.29Å; K94-L272 WeakPolarHBondContact CE-O 3.1Å; K94-L272 HydrophobicContact CG-CD2 3.6Å; K94-T273 PolarHBondContact NZ-O 3.07Å
95	S	74.2	Confident	89.1	Confident	23 Å²	23	17.2 Å²	17.2	16%	0.161	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.9	146.1	168.3	-66.6	0	0	0	0	110.2	M97 R392	S95-M97 VanDerWaalsContact C-N 3.29Å; S95-M97 PolarHBondContact O-N 3.29Å; S95-R392 PolarHBondContact OG-NH2 3.25Å
96	G	70.9	Confident	89.4	Confident	12 Å²	12	11.9 Å²	11.9	12%	0.124	8%	0.081	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.6	-1.5	-179.5	0	0	0	0	0	115.6	G98 F396	G96-G98 PolarHBondContact O-N 3.21Å; G96-F396 WeakPolarHBondContact O-CE1 3.4Å
97	M	76.1	Confident	89.6	Confident	44 Å²	44	10.3 Å²	10.3	22%	0.217	7%	0.065	C	C	.	.	S	Bend	trans	-80.5	3.4	175	-59.6	-163	94.9	0	0	113.8	S73 V75 A93 K94 S95 V266	S73-M97 WeakPolarHBondContact CB-O 3.47Å; S73-M97 PolarHBondContact OG-O 3.46Å; V75-M97 HydrophobicContact CG1-CB 3.71Å; V75-M97 WeakPolarHBondContact CG1-O 3.15Å; A93-M97 HydrophobicContact CB-SD 4.16Å; K94-M97 HydrophobicContact CB-CG 3.96Å; K94-M97 HydrophobicContact CB-SD 3.93Å; K94-M97 PolarHBondContact O-N 3.01Å; S95-M97 VanDerWaalsContact C-N 3.29Å; S95-M97 PolarHBondContact O-N 3.29Å; M97-V266 HydrophobicContact CE-CG1 4.01Å; M97-V266 HydrophobicContact SD-CG1 4.01Å
98	G	83.3	Confident	89.9	Confident	14 Å²	14	9.1 Å²	9.1	14%	0.144	6%	0.055	C	C	.	.			trans	82.9	25.3	176	0	0	0	0	0	115.7	Q76 G96 T100 A101 V102	Q76-G98 PolarHBondContact NE2-O 2.94Å; G96-G98 PolarHBondContact O-N 3.21Å; G98-T100 VanDerWaalsContact C-N 3.27Å; G98-T100 PolarHBondContact O-N 3.05Å; G98-A101 PolarHBondContact O-N 3.2Å; G98-V102 PolarHBondContact O-N 2.82Å
99	K	89.8	Confident	90	Very high	18 Å²	18	9.7 Å²	9.7	8%	0.078	6%	0.057	C	C	.	.	H	α-helix	trans	-53.8	-39.9	175.3	-65.9	-170.4	-64	-77.4	0	113.4	V75 A93 K94 A101 V102 F103 F231	V75-K99 HydrophobicContact CG2-CG 4.45Å; A93-K99 HydrophobicContact CB-CD 4.06Å; A93-K99 HydrophobicContact CB-CG 4.17Å; A93-K99 PolarHBondContact O-NZ 2.89Å; K94-K99 PolarHBondContact O-NZ 2.94Å; K99-A101 VanDerWaalsContact C-N 3.34Å; K99-A101 PolarHBondContact O-N 2.84Å; K99-V102 VanDerWaalsContact O-CB 3.24Å; K99-V102 WeakPolarHBondContact O-CB 3.27Å; K99-V102 PolarHBondContact O-N 2.91Å; K99-V102 VanDerWaalsContact O-N 3.12Å; K99-F103 WeakPolarHBondContact O-CD1 3.44Å; K99-F231 HydrophobicContact CB-CD1 4.08Å; K99-F231 HydrophobicContact CD-CB 4.24Å; K99-F231 HydrophobicContact CD-CD1 4.34Å; K99-F231 HydrophobicContact CG-CD1 4.42Å
100	T	92.4	Very high	90	Very high	22 Å²	22	12.4 Å²	12.4	14%	0.135	7%	0.07	C	C	.	.	H	α-helix	trans	-60.6	-44.6	-180	-53.6	0	0	0	0	111.6	G98 V102 F103 V104 I133 E136	G98-T100 VanDerWaalsContact C-N 3.27Å; G98-T100 PolarHBondContact O-N 3.05Å; T100-V102 PolarHBondContact O-N 3.28Å; T100-F103 HydrophobicContact CG2-CE1 4.31Å; T100-F103 HydrophobicContact CG2-CE2 4.33Å; T100-F103 HydrophobicContact CG2-CZ 3.78Å; T100-F103 PolarHBondContact O-N 2.99Å; T100-V104 HydrophobicContact CG2-CG2 4.16Å; T100-V104 WeakPolarHBondContact O-CB 3.14Å; T100-V104 VanDerWaalsContact O-CG2 3.25Å; T100-V104 WeakPolarHBondContact O-CG2 3.46Å; T100-V104 PolarHBondContact O-N 2.8Å; T100-V104 VanDerWaalsContact O-N 3.12Å; T100-I133 HydrophobicContact CG2-CG1 4.07Å; T100-E136 HydrophobicContact CG2-CB 4.15Å; T100-E136 HydrophobicContact CG2-CG 4.03Å
101	A	92.8	Very high	90	Very high	4 Å²	4	12.5 Å²	12.5	3%	0.033	7%	0.07	C	C	.	.	H	α-helix	trans	-61.5	-32.2	177	0	0	0	0	0	112.1	G98 K99 F103 V104 L105 F140	G98-A101 PolarHBondContact O-N 3.2Å; K99-A101 VanDerWaalsContact C-N 3.34Å; K99-A101 PolarHBondContact O-N 2.84Å; A101-F103 PolarHBondContact O-N 2.83Å; A101-V104 PolarHBondContact O-N 3.08Å; A101-L105 HydrophobicContact CB-CD1 4.4Å; A101-L105 WeakPolarHBondContact O-CB 3.33Å; A101-L105 WeakPolarHBondContact O-CG 3.41Å; A101-L105 PolarHBondContact O-N 3.33Å; A101-F140 HydrophobicContact CB-CE2 4.27Å; A101-F140 HydrophobicContact CB-CZ 4.29Å
102	V	95	Very high	90	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-54.1	-57.2	177.8	176.1	0	0	0	0	111.5	Q76 C79 I80 T83 G98 K99 T100 A106 F231	Q76-V102 HydrophobicContact CB-CG2 4.37Å; Q76-V102 HydrophobicContact CG-CG2 3.77Å; C79-V102 HydrophobicContact CB-CB 4.41Å; C79-V102 HydrophobicContact CB-CG1 3.36Å; C79-V102 HydrophobicContact CB-CG2 4.16Å; I80-V102 HydrophobicContact CG1-CG1 4.29Å; I80-V102 HydrophobicContact CG1-CG2 4.46Å; T83-V102 HydrophobicContact CG2-CG1 3.93Å; G98-V102 PolarHBondContact O-N 2.82Å; K99-V102 VanDerWaalsContact O-CB 3.24Å; K99-V102 WeakPolarHBondContact O-CB 3.27Å; K99-V102 PolarHBondContact O-N 2.91Å; K99-V102 VanDerWaalsContact O-N 3.12Å; T100-V102 PolarHBondContact O-N 3.28Å; V102-A106 WeakPolarHBondContact O-CB 3.39Å; V102-A106 PolarHBondContact O-N 2.73Å; V102-F231 HydrophobicContact CB-CE1 4.22Å; V102-F231 HydrophobicContact CB-CZ 4.45Å; V102-F231 HydrophobicContact CG1-CE1 4.02Å; V102-F231 HydrophobicContact CG1-CZ 4.07Å
103	F	96.8	Very high	90	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-78.1	-29.9	-175.7	64.8	-107.3	0	0	0	112.5	K99 T100 A101 T107 V122 I133 Y137 I198 D200 M229 F231	K99-F103 WeakPolarHBondContact O-CD1 3.44Å; T100-F103 HydrophobicContact CG2-CE1 4.31Å; T100-F103 HydrophobicContact CG2-CE2 4.33Å; T100-F103 HydrophobicContact CG2-CZ 3.78Å; T100-F103 PolarHBondContact O-N 2.99Å; A101-F103 PolarHBondContact O-N 2.83Å; F103-T107 WeakPolarHBondContact O-CB 3.35Å; F103-T107 VanDerWaalsContact O-CG2 3.32Å; F103-T107 WeakPolarHBondContact O-CG2 3.38Å; F103-T107 PolarHBondContact O-N 2.88Å; F103-T107 PolarHBondContact O-OG1 2.76Å; F103-V122 HydrophobicContact CE2-CG1 4.19Å; F103-V122 HydrophobicContact CE2-CG2 4.35Å; F103-V122 HydrophobicContact CZ-CG1 4.38Å; F103-I133 HydrophobicContact CE2-CG2 3.87Å; F103-I133 HydrophobicContact CZ-CD1 4.15Å; F103-I133 HydrophobicContact CZ-CG1 4.24Å; F103-I133 HydrophobicContact CZ-CG2 4.11Å; F103-Y137 HydrophobicContact CE2-CE2 4.18Å; F103-I198 HydrophobicContact CB-CD1 3.93Å; F103-I198 HydrophobicContact CB-CG1 4.44Å; F103-I198 HydrophobicContact CB-CG2 4.28Å; F103-I198 HydrophobicContact CD1-CG2 4.02Å; F103-I198 HydrophobicContact CD2-CD1 3.79Å; F103-I198 HydrophobicContact CD2-CG2 4.06Å; F103-I198 HydrophobicContact CE1-CG2 4.28Å; F103-I198 HydrophobicContact CE2-CG2 4.37Å; F103-I198 HydrophobicContact CG-CD1 4.13Å; F103-I198 HydrophobicContact CG-CG2 3.88Å; F103-I198 HydrophobicContact CZ-CG2 4.45Å; F103-D200 HydrophobicContact CE1-CB 4.19Å; F103-D200 HydrophobicContact CZ-CB 4.36Å; F103-M229 HydrophobicContact CB-SD 4.33Å; F103-F231 HydrophobicContact CB-CE2 3.69Å; F103-F231 HydrophobicContact CB-CZ 3.96Å; F103-F231 AromaticContact CD1-CD2 3.62Å; F103-F231 HydrophobicContact CD1-CD2 3.62Å; F103-F231 AromaticContact CD1-CE2 3.5Å; F103-F231 HydrophobicContact CD1-CE2 3.5Å; F103-F231 HydrophobicContact CD1-CG 4.25Å; F103-F231 HydrophobicContact CD1-CZ 4.06Å; F103-F231 HydrophobicContact CE1-CD2 4.2Å; F103-F231 HydrophobicContact CE1-CE2 4.49Å; F103-F231 HydrophobicContact CG-CD2 4.49Å; F103-F231 HydrophobicContact CG-CE2 4.01Å
104	V	97.5	Very high	90.4	Very high	0 Å²	0	22 Å²	22	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.3	-51.1	174.8	170.8	0	0	0	0	110.1	T100 A101 T107 L108 E136 Y137 F140	T100-V104 HydrophobicContact CG2-CG2 4.16Å; T100-V104 WeakPolarHBondContact O-CB 3.14Å; T100-V104 VanDerWaalsContact O-CG2 3.25Å; T100-V104 WeakPolarHBondContact O-CG2 3.46Å; T100-V104 PolarHBondContact O-N 2.8Å; T100-V104 VanDerWaalsContact O-N 3.12Å; A101-V104 PolarHBondContact O-N 3.08Å; V104-T107 PolarHBondContact O-OG1 3.17Å; V104-L108 HydrophobicContact CG1-CD1 3.88Å; V104-L108 WeakPolarHBondContact O-CB 3.24Å; V104-L108 VanDerWaalsContact O-CG 3.28Å; V104-L108 WeakPolarHBondContact O-CG 3.41Å; V104-L108 PolarHBondContact O-N 3.39Å; V104-L108 VanDerWaalsContact O-N 3.07Å; V104-E136 HydrophobicContact CG2-CB 4.28Å; V104-Y137 HydrophobicContact CB-CD1 4.37Å; V104-Y137 HydrophobicContact CB-CE1 4.16Å; V104-Y137 HydrophobicContact CG1-CD1 3.76Å; V104-Y137 HydrophobicContact CG1-CE1 4Å; V104-Y137 HydrophobicContact CG1-CG 4.2Å; V104-Y137 HydrophobicContact CG2-CD1 4.23Å; V104-Y137 HydrophobicContact CG2-CD2 4.01Å; V104-Y137 HydrophobicContact CG2-CE1 4.06Å; V104-Y137 HydrophobicContact CG2-CE2 3.82Å; V104-Y137 HydrophobicContact CG2-CG 4.21Å; V104-F140 HydrophobicContact CB-CD2 4.48Å; V104-F140 HydrophobicContact CG1-CB 3.85Å; V104-F140 HydrophobicContact CG1-CD2 3.65Å; V104-F140 HydrophobicContact CG1-CG 4.09Å
105	L	96.6	Very high	91.2	Very high	0 Å²	0	27 Å²	27	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.3	-46.1	179.2	-69.8	-178.8	0	0	0	111.5	F51 M56 L60 I64 I80 A101 T107 L108 Q109 F140	F51-L105 HydrophobicContact CD1-CD1 4.25Å; F51-L105 HydrophobicContact CE1-CD1 3.82Å; M56-L105 HydrophobicContact CE-CB 3.68Å; M56-L105 HydrophobicContact CE-CD1 4.36Å; M56-L105 HydrophobicContact CE-CD2 4.24Å; M56-L105 HydrophobicContact CE-CG 4.31Å; L60-L105 HydrophobicContact CD1-CD2 3.64Å; L60-L105 HydrophobicContact CD2-CD2 4.18Å; L60-L105 WeakPolarHBondContact CD2-O 3.25Å; L60-L105 HydrophobicContact CG-CD2 3.9Å; I64-L105 HydrophobicContact CD1-CD1 4.09Å; I64-L105 HydrophobicContact CD1-CD2 3.8Å; I64-L105 HydrophobicContact CG1-CD1 4.41Å; I64-L105 HydrophobicContact CG1-CD2 3.78Å; I80-L105 HydrophobicContact CD1-CD1 4.03Å; A101-L105 HydrophobicContact CB-CD1 4.4Å; A101-L105 WeakPolarHBondContact O-CB 3.33Å; A101-L105 WeakPolarHBondContact O-CG 3.41Å; A101-L105 PolarHBondContact O-N 3.33Å; L105-T107 PolarHBondContact O-N 3.15Å; L105-L108 PolarHBondContact O-N 2.85Å; L105-Q109 VanDerWaalsContact O-CB 3.24Å; L105-Q109 WeakPolarHBondContact O-CB 3.43Å; L105-Q109 PolarHBondContact O-N 2.99Å; L105-F140 HydrophobicContact CD2-CB 4.37Å; L105-F140 HydrophobicContact CD2-CD1 3.52Å; L105-F140 HydrophobicContact CD2-CE1 3.85Å; L105-F140 HydrophobicContact CD2-CG 3.91Å; L105-F140 HydrophobicContact CD2-CZ 4.49Å
106	A	96.1	Very high	92.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.1	-39.4	-177.8	0	0	0	0	0	113.3	T83 I84 V102 Q110	T83-A106 HydrophobicContact CG2-CB 4.48Å; T83-A106 WeakPolarHBondContact OG1-CB 3.35Å; I84-A106 HydrophobicContact CG1-CB 4.36Å; V102-A106 WeakPolarHBondContact O-CB 3.39Å; V102-A106 PolarHBondContact O-N 2.73Å; A106-Q110 WeakPolarHBondContact O-CG 3.44Å; A106-Q110 PolarHBondContact O-N 2.85Å; A106-Q110 VanDerWaalsContact O-N 3.15Å; A106-Q110 PolarHBondContact O-NE2 2.61Å
107	T	97.5	Very high	93.2	Very high	0 Å²	0	30 Å²	30	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-73.4	-41.9	178.3	52	0	0	0	0	111.9	F103 V104 L105 Q109 Q110 M111 Y137 F196 I198 M229	F103-T107 WeakPolarHBondContact O-CB 3.35Å; F103-T107 VanDerWaalsContact O-CG2 3.32Å; F103-T107 WeakPolarHBondContact O-CG2 3.38Å; F103-T107 PolarHBondContact O-N 2.88Å; F103-T107 PolarHBondContact O-OG1 2.76Å; V104-T107 PolarHBondContact O-OG1 3.17Å; L105-T107 PolarHBondContact O-N 3.15Å; T107-Q109 VanDerWaalsContact C-N 3.27Å; T107-Q109 PolarHBondContact O-N 2.85Å; T107-Q110 PolarHBondContact O-N 2.89Å; T107-M111 WeakPolarHBondContact O-CB 3.29Å; T107-M111 PolarHBondContact O-N 3.37Å; T107-Y137 WeakPolarHBondContact OG1-CE1 3.38Å; T107-Y137 PolarHBondContact OG1-OH 3.01Å; T107-F196 HydrophobicContact CG2-CB 3.79Å; T107-F196 HydrophobicContact CG2-CD1 3.92Å; T107-F196 HydrophobicContact CG2-CD2 4.11Å; T107-F196 HydrophobicContact CG2-CG 3.66Å; T107-I198 HydrophobicContact CG2-CD1 3.74Å; T107-M229 HydrophobicContact CG2-CE 3.73Å
108	L	97.9	Very high	94.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	16%	0.161	C	C	.	.	H	α-helix	trans	-61.9	-36.9	174.2	-70.5	174.1	0	0	0	112	K57 L60 V104 L105 Y137 F140 M144 V147 I172	K57-L108 PolarHBondContact NZ-O 3.44Å; L60-L108 HydrophobicContact CD1-CB 4.19Å; L60-L108 HydrophobicContact CD1-CD1 3.99Å; L60-L108 HydrophobicContact CD2-CB 4.26Å; V104-L108 HydrophobicContact CG1-CD1 3.88Å; V104-L108 WeakPolarHBondContact O-CB 3.24Å; V104-L108 VanDerWaalsContact O-CG 3.28Å; V104-L108 WeakPolarHBondContact O-CG 3.41Å; V104-L108 PolarHBondContact O-N 3.39Å; V104-L108 VanDerWaalsContact O-N 3.07Å; L105-L108 PolarHBondContact O-N 2.85Å; L108-Y137 HydrophobicContact CD1-CD1 4.33Å; L108-Y137 HydrophobicContact CD2-CD1 4.29Å; L108-Y137 HydrophobicContact CG-CD1 4.19Å; L108-Y137 HydrophobicContact CG-CE1 4.38Å; L108-F140 HydrophobicContact CD1-CB 3.67Å; L108-M144 HydrophobicContact CB-SD 4.34Å; L108-M144 HydrophobicContact CD2-SD 4.29Å; L108-V147 HydrophobicContact CD2-CG1 4Å; L108-V147 HydrophobicContact CD2-CG2 4.34Å; L108-I172 HydrophobicContact CD2-CD1 3.83Å
109	Q	97	Very high	95	Very high	32 Å²	32	27.6 Å²	27.6	15%	0.15	15%	0.154	C	C	.	.	H	α-helix	trans	-61.7	-46.5	175.1	179.3	62.7	8.8	0	0	111.9	L55 M56 K57 L60 I84 L105 T107	L55-Q109 PolarHBondContact O-NE2 3.19Å; L55-Q109 VanDerWaalsContact O-NE2 3.08Å; M56-Q109 HydrophobicContact SD-CB 4.13Å; M56-Q109 HydrophobicContact SD-CG 3.95Å; K57-Q109 WeakPolarHBondContact CE-O 3.47Å; K57-Q109 PolarHBondContact NZ-O 2.78Å; K57-Q109 VanDerWaalsContact NZ-O 3.07Å; L60-Q109 HydrophobicContact CD2-CB 4.12Å; I84-Q109 HydrophobicContact CD1-CG 4.15Å; I84-Q109 HydrophobicContact CG1-CB 4.43Å; I84-Q109 HydrophobicContact CG1-CG 4.12Å; I84-Q109 HydrophobicContact CG2-CG 4.24Å; L105-Q109 VanDerWaalsContact O-CB 3.24Å; L105-Q109 WeakPolarHBondContact O-CB 3.43Å; L105-Q109 PolarHBondContact O-N 2.99Å; T107-Q109 VanDerWaalsContact C-N 3.27Å; T107-Q109 PolarHBondContact O-N 2.85Å
110	Q	95.9	Very high	95.4	Very high	57 Å²	57	26.8 Å²	26.8	27%	0.266	15%	0.151	S	C	.	.	H	α-helix	trans	-84.7	-18.5	-176.1	-67.6	173.2	82.6	0	0	114	T83 I84 A106 T107 F196	T83-Q110 PolarHBondContact O-NE2 3.46Å; I84-Q110 VanDerWaalsContact O-CD 3.3Å; I84-Q110 PolarHBondContact O-OE1 3.06Å; A106-Q110 WeakPolarHBondContact O-CG 3.44Å; A106-Q110 PolarHBondContact O-N 2.85Å; A106-Q110 VanDerWaalsContact O-N 3.15Å; A106-Q110 PolarHBondContact O-NE2 2.61Å; T107-Q110 PolarHBondContact O-N 2.89Å; Q110-F196 HydrophobicContact CB-CE1 3.99Å; Q110-F196 HydrophobicContact CB-CZ 3.56Å
111	M	94.2	Very high	95.7	Very high	3 Å²	3	25.8 Å²	25.8	2%	0.015	14%	0.144	C	C	.	.			trans	-72.9	137.6	-173.6	-174.5	170.8	-64.4	0	0	112.3	K57 T107 P113 L119 C120 H171 I172 F196	K57-M111 PolarHBondContact NZ-O 2.75Å; T107-M111 WeakPolarHBondContact O-CB 3.29Å; T107-M111 PolarHBondContact O-N 3.37Å; M111-P113 HydrophobicContact CG-CG 4.06Å; M111-P113 HydrophobicContact SD-CG 4.35Å; M111-L119 HydrophobicContact CE-CB 3.87Å; M111-L119 HydrophobicContact CG-CD1 3.76Å; M111-L119 HydrophobicContact SD-CB 4.42Å; M111-L119 HydrophobicContact SD-CD1 4.18Å; M111-C120 HydrophobicContact CE-CB 3.58Å; M111-H171 HydrophobicContact SD-CB 3.92Å; M111-I172 HydrophobicContact CE-CD1 4.14Å; M111-I172 HydrophobicContact CE-CG1 3.64Å; M111-I172 HydrophobicContact SD-CD1 4.26Å; M111-I172 HydrophobicContact SD-CG1 3.98Å; M111-F196 HydrophobicContact CE-CD2 4.37Å; M111-F196 HydrophobicContact CE-CE2 4.45Å
112	S	93.5	Very high	96	Very high	78 Å²	78	25.6 Å²	25.6	55%	0.545	14%	0.143	S	C	.	.			trans	-117.8	99.5	163.3	-58.5	0	0	0	0	107.1	E114 L119	S112-E114 PolarHBondContact O-N 3.09Å; S112-L119 VanDerWaalsContact O-CD1 3.24Å; S112-L119 WeakPolarHBondContact O-CD1 3.33Å
113	P	92.8	Very high	96.2	Very high	38 Å²	38	25.6 Å²	25.6	25%	0.247	14%	0.143	C	C	.	.			trans	-61	132.9	-175.4	-29.5	40.9	0	0	0	112.6	M111 E146 V147	M111-P113 HydrophobicContact CG-CG 4.06Å; M111-P113 HydrophobicContact SD-CG 4.35Å; P113-E146 HydrophobicContact CB-CB 4.46Å; P113-E146 HydrophobicContact CB-CG 3.92Å; P113-E146 HydrophobicContact CG-CG 3.75Å; P113-V147 HydrophobicContact CG-CG2 3.71Å
114	E	92.4	Very high	96.1	Very high	92 Å²	92	25.6 Å²	25.6	43%	0.43	14%	0.143	S	C	.	.			trans	-129.7	125.9	177.4	-73.2	176.4	-159.2	0	0	109.2	S112 G116 H117 H171	S112-E114 PolarHBondContact O-N 3.09Å; E114-G116 PolarHBondContact O-N 2.83Å; E114-H117 HydrophobicContact CB-CB 4.4Å; E114-H117 PolarHBondContact O-N 3.24Å; E114-H117 IonicContact OE2-CE1 3.7Å; E114-H117 IonicContact OE2-ND1 3.86Å; E114-H117 PolarHBondContact OE2-ND1 3.03Å; E114-H117 VanDerWaalsContact OE2-ND1 3.09Å; E114-H171 PolarHBondContact O-CD2 3.3Å; E114-H171 PolarHBondContact O-NE2 3.49Å
115	E	92.2	Very high	95.9	Very high	130 Å²	130	27.3 Å²	27.3	61%	0.607	15%	0.151	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.9	134.1	-176.7	-76.1	-68.8	175.1	0	0	112.3	H117 K148	E115-H117 VanDerWaalsContact C-N 3.3Å; E115-H117 PolarHBondContact O-N 2.98Å; E115-K148 WeakPolarHBondContact OE1-CE 3.03Å; E115-K148 IonicContact OE1-NZ 2.62Å; E115-K148 PolarHBondContact OE1-NZ 3.33Å; E115-K148 IonicContact OE2-NZ 3.7Å; E115-K148 PolarHBondContact OE2-NZ 2.68Å
116	G	92.5	Very high	95.5	Very high	41 Å²	41	28.1 Å²	28.1	42%	0.423	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.3	179.6	0	0	0	0	0	115.3	E114	E114-G116 PolarHBondContact O-N 2.83Å
117	H	96.1	Very high	95.2	Very high	57 Å²	57	32.4 Å²	32.4	26%	0.264	17%	0.172	S	C	.	.			trans	-111.8	127.2	-175.7	-62.1	168.5	0	0	0	112.4	E114 E115 L119 H171 H193	E114-H117 HydrophobicContact CB-CB 4.4Å; E114-H117 PolarHBondContact O-N 3.24Å; E114-H117 IonicContact OE2-CE1 3.7Å; E114-H117 IonicContact OE2-ND1 3.86Å; E114-H117 PolarHBondContact OE2-ND1 3.03Å; E114-H117 VanDerWaalsContact OE2-ND1 3.09Å; E115-H117 VanDerWaalsContact C-N 3.3Å; E115-H117 PolarHBondContact O-N 2.98Å; H117-L119 HydrophobicContact CB-CD2 4.2Å; H117-H171 PolarHBondContact O-CD2 3.39Å; H117-H193 HydrophobicContact CB-CB 4.13Å; H117-H193 AromaticContact CD2-CD2 3.21Å; H117-H193 PolarHBondContact CD2-CD2 2.86Å; H117-H193 AromaticContact CD2-NE2 3.71Å; H117-H193 AromaticContact CE1-CD2 3.68Å; H117-H193 AromaticContact CE1-NE2 3.74Å; H117-H193 AromaticContact CG-CD2 3.31Å; H117-H193 AromaticContact ND1-CD2 3.62Å; H117-H193 AromaticContact NE2-CD2 3.46Å; H117-H193 PolarHBondContact NE2-CD2 2.87Å; H117-H193 AromaticContact NE2-NE2 3.46Å; H117-H193 PolarHBondContact NE2-NE2 3.12Å
118	V	98.2	Very high	94.7	Very high	5 Å²	5	32.7 Å²	32.7	3%	0.03	17%	0.173	C	C	.	.			trans	-82.2	119.5	166.5	-171.5	0	0	0	0	108.5	T169 P170 V173 L189 L191 H193 I194	V118-T169 HydrophobicContact CG2-CG2 4.02Å; V118-P170 WeakPolarHBondContact CG2-O 3.3Å; V118-V173 HydrophobicContact CB-CG2 4.43Å; V118-V173 HydrophobicContact CG1-CB 3.97Å; V118-V173 HydrophobicContact CG1-CG2 3.51Å; V118-V173 HydrophobicContact CG2-CG2 3.99Å; V118-L189 HydrophobicContact CG2-CD1 3.88Å; V118-L191 HydrophobicContact CB-CD2 4.38Å; V118-L191 HydrophobicContact CG1-CD2 4.14Å; V118-H193 CarbonylContact O-C 3.27Å; V118-H193 VanDerWaalsContact O-C 3.27Å; V118-I194 HydrophobicContact CB-CD1 4.27Å; V118-I194 HydrophobicContact CG1-CD1 3.68Å; V118-I194 PolarHBondContact O-N 3.07Å
119	L	98.2	Very high	94.3	Very high	2 Å²	2	32.9 Å²	32.9	1%	0.01	17%	0.174	C	C	.	.			trans	-104.8	-29.7	-176.5	-59.6	177.9	0	0	0	112.6	M111 S112 H117 H171 H193 K195 F196	M111-L119 HydrophobicContact CE-CB 3.87Å; M111-L119 HydrophobicContact CG-CD1 3.76Å; M111-L119 HydrophobicContact SD-CB 4.42Å; M111-L119 HydrophobicContact SD-CD1 4.18Å; S112-L119 VanDerWaalsContact O-CD1 3.24Å; S112-L119 WeakPolarHBondContact O-CD1 3.33Å; H117-L119 HydrophobicContact CB-CD2 4.2Å; L119-H171 PolarHBondContact N-O 2.63Å; L119-H193 HydrophobicContact CD2-CB 4.28Å; L119-K195 PolarHBondContact O-N 2.72Å; L119-F196 PolarHBondContact O-N 2.61Å; L119-F196 VanDerWaalsContact O-N 3.09Å
120	C	98.6	Very high	94.2	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	128.6	-178.7	178.7	0	0	0	0	110.8	M111 H171 I172 V173 F196	M111-C120 HydrophobicContact CE-CB 3.58Å; C120-H171 PolarHBondContact N-O 3.24Å; C120-I172 HydrophobicContact CB-CB 4.46Å; C120-I172 HydrophobicContact CB-CG1 4.11Å; C120-I172 HydrophobicContact CB-CG2 4.3Å; C120-V173 PolarHBondContact O-N 3Å; C120-F196 WeakPolarHBondContact CA-O 3.15Å; C120-F196 HydrophobicContact CB-CB 4.15Å; C120-F196 HydrophobicContact CB-CD2 4.13Å
121	L	98.7	Very high	94	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.005	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	122.6	173	-179.7	66.2	0	0	0	109.7	M123 V173 L180 L191 I194 F196 F197 I198 V218	L121-M123 HydrophobicContact CD2-CG 4.43Å; L121-M123 HydrophobicContact CD2-SD 4.48Å; L121-M123 HydrophobicContact CG-CG 4.26Å; L121-V173 CarbonylContact C-O 3.52Å; L121-V173 WeakPolarHBondContact CA-O 3.39Å; L121-V173 HydrophobicContact CD1-CB 4Å; L121-V173 HydrophobicContact CD1-CG1 3.72Å; L121-L180 HydrophobicContact CD1-CD1 3.98Å; L121-L180 HydrophobicContact CD1-CD2 4.33Å; L121-L191 HydrophobicContact CD1-CD2 4.36Å; L121-L191 HydrophobicContact CD2-CD1 3.78Å; L121-L191 HydrophobicContact CD2-CD2 4.36Å; L121-I194 HydrophobicContact CB-CD1 3.66Å; L121-I194 HydrophobicContact CB-CG1 4.38Å; L121-F196 PolarHBondContact N-O 2.85Å; L121-F197 HydrophobicContact CD2-CD2 3.97Å; L121-F197 HydrophobicContact CD2-CE2 3.82Å; L121-I198 PolarHBondContact O-N 2.67Å; L121-V218 HydrophobicContact CD2-CG1 3.57Å
122	V	98.8	Very high	93.8	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	122.8	174.1	-175.6	0	0	0	0	108.7	F103 I133 Y137 V173 V174 G175 I198	F103-V122 HydrophobicContact CE2-CG1 4.19Å; F103-V122 HydrophobicContact CE2-CG2 4.35Å; F103-V122 HydrophobicContact CZ-CG1 4.38Å; V122-I133 HydrophobicContact CG1-CD1 4.13Å; V122-I133 HydrophobicContact CG1-CG2 4.08Å; V122-Y137 HydrophobicContact CG2-CE2 3.84Å; V122-Y137 WeakPolarHBondContact CG2-OH 3.32Å; V122-V173 PolarHBondContact N-O 2.69Å; V122-V174 HydrophobicContact CB-CG1 4.26Å; V122-V174 HydrophobicContact CB-CG2 4.24Å; V122-V174 HydrophobicContact CG1-CG1 4.39Å; V122-V174 CarbonylContact O-C 3.5Å; V122-V174 VanDerWaalsContact O-CA 3.32Å; V122-V174 WeakPolarHBondContact O-CA 3.33Å; V122-G175 PolarHBondContact O-N 3.43Å; V122-I198 CarbonylContact C-O 3.6Å; V122-I198 WeakPolarHBondContact CA-O 3.12Å; V122-I198 HydrophobicContact CB-CB 4.32Å; V122-I198 HydrophobicContact CG1-CB 4.18Å; V122-I198 HydrophobicContact CG1-CG2 4.09Å; V122-I198 HydrophobicContact CG2-CB 3.95Å; V122-I198 HydrophobicContact CG2-CD1 3.64Å; V122-I198 HydrophobicContact CG2-CG1 4.36Å; V122-I198 HydrophobicContact CG2-CG2 4.48Å
123	M	98.5	Very high	93.9	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	144.8	173.5	-62.6	-166.5	-71.7	0	0	111.4	L121 G175 P177 L180 F197 I198 L199 D200 M205 V215 V218	L121-M123 HydrophobicContact CD2-CG 4.43Å; L121-M123 HydrophobicContact CD2-SD 4.48Å; L121-M123 HydrophobicContact CG-CG 4.26Å; M123-G175 VanDerWaalsContact CA-O 3.31Å; M123-G175 WeakPolarHBondContact CA-O 3.47Å; M123-P177 HydrophobicContact SD-CB 4.44Å; M123-P177 HydrophobicContact SD-CG 4.37Å; M123-L180 HydrophobicContact CG-CD1 3.48Å; M123-L180 VanDerWaalsContact CG-CD1 3.48Å; M123-L180 HydrophobicContact SD-CD1 3.82Å; M123-F197 HydrophobicContact CE-CE1 3.95Å; M123-F197 HydrophobicContact CE-CE2 3.72Å; M123-F197 HydrophobicContact CE-CZ 3.17Å; M123-I198 PolarHBondContact N-O 3.12Å; M123-L199 HydrophobicContact CB-CD2 3.78Å; M123-L199 HydrophobicContact CE-CD2 3.64Å; M123-L199 WeakPolarHBondContact O-CA 3.46Å; M123-D200 PolarHBondContact O-N 3.25Å; M123-M205 HydrophobicContact CB-SD 4.04Å; M123-M205 WeakPolarHBondContact O-CE 3.5Å; M123-V215 HydrophobicContact CE-CB 4.23Å; M123-V215 HydrophobicContact CE-CG1 3.85Å; M123-V215 HydrophobicContact CE-CG2 4.06Å; M123-V218 HydrophobicContact CE-CB 4.22Å; M123-V218 HydrophobicContact CE-CG1 3.98Å; M123-V218 HydrophobicContact SD-CB 4.17Å; M123-V218 HydrophobicContact SD-CG1 3.85Å; M123-V218 HydrophobicContact SD-CG2 4.25Å
124	C	95.7	Very high	94	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.5	161.4	173.9	60.3	0	0	0	0	110.4	L129 A130 I133 G175 T176 P177 D200 M205	C124-L129 HydrophobicContact CB-CB 4.32Å; C124-L129 HydrophobicContact CB-CD2 3.63Å; C124-L129 HydrophobicContact CB-CG 3.82Å; C124-A130 WeakPolarHBondContact SG-CA 3.41Å; C124-A130 VanDerWaalsContact SG-CB 3.56Å; C124-A130 PolarHBondContact SG-N 3.03Å; C124-I133 HydrophobicContact CB-CD1 4.29Å; C124-G175 PolarHBondContact N-O 3.47Å; C124-G175 VanDerWaalsContact N-O 3.12Å; C124-T176 WeakPolarHBondContact O-CA 3.44Å; C124-P177 VanDerWaalsContact O-CD 3.32Å; C124-P177 WeakPolarHBondContact O-CD 3.33Å; C124-D200 HydrophobicContact CB-CB 4.49Å; C124-M205 VanDerWaalsContact C-SD 3.5Å; C124-M205 WeakPolarHBondContact CA-SD 3.36Å
125	H	91.8	Very high	94.1	Very high	36 Å²	36	23.9 Å²	23.9	17%	0.167	12%	0.119	C	C	.	.	S	Bend	trans	-79.9	-19.3	-170.8	72.7	-60.7	0	0	0	114.7	E201 K204 M205 M211	H125-E201 IonicContact CE1-OE2 3.66Å; H125-E201 PolarHBondContact CE1-OE2 3.49Å; H125-E201 IonicContact ND1-OE2 3.15Å; H125-E201 IonicContact NE2-OE2 3.45Å; H125-K204 HydrophobicContact CB-CB 4.13Å; H125-M205 HydrophobicContact CB-CG 3.72Å; H125-M211 HydrophobicContact CB-SD 4.11Å
126	T	89.5	Confident	94.2	Very high	18 Å²	18	18.6 Å²	18.6	11%	0.11	9%	0.094	C	C	.	.			trans	-118.6	150.7	-179	62.6	0	0	0	0	112.8	E128 L129 A130	T126-E128 VanDerWaalsContact C-N 3.27Å; T126-E128 PolarHBondContact O-N 3.11Å; T126-L129 PolarHBondContact O-N 2.84Å; T126-L129 WeakPolarHBondContact OG1-CB 3.06Å; T126-L129 PolarHBondContact OG1-N 3.37Å; T126-A130 PolarHBondContact O-N 3.48Å; T126-A130 VanDerWaalsContact O-N 3.12Å
127	R	89.7	Confident	94.5	Very high	90 Å²	90	16.7 Å²	16.7	34%	0.34	7%	0.074	S	C	.	.	H	α-helix	trans	-66.8	-34.7	178.4	-51.3	177.1	177.8	173.1	-1.3	111	A130 F131 F153 G154 T176 Q338	R127-A130 PolarHBondContact O-N 3.37Å; R127-F131 PolarHBondContact O-N 2.58Å; R127-F131 VanDerWaalsContact O-N 3.08Å; R127-F153 HydrophobicContact CB-CB 4.04Å; R127-F153 HydrophobicContact CB-CD1 4.42Å; R127-F153 HydrophobicContact CB-CD2 3.7Å; R127-F153 HydrophobicContact CB-CE2 4.31Å; R127-F153 HydrophobicContact CB-CG 3.78Å; R127-F153 HydrophobicContact CG-CB 3.97Å; R127-F153 HydrophobicContact CG-CD2 4.06Å; R127-F153 HydrophobicContact CG-CG 4.18Å; R127-G154 WeakPolarHBondContact CD-O 3.41Å; R127-G154 VanDerWaalsContact CZ-C 3.45Å; R127-G154 PolarHBondContact NE-O 3.04Å; R127-G154 PolarHBondContact NH1-O 3.44Å; R127-T176 HydrophobicContact CG-CG2 4.26Å; R127-Q338 VanDerWaalsContact NH1-OE1 3.16Å
128	E	87	Confident	94.5	Very high	6 Å²	6	18 Å²	18	3%	0.028	8%	0.08	C	C	.	.	H	α-helix	trans	-71.2	-42	-179.3	-66	63.6	-130.8	0	0	111	T126 A130 F131 Q132 Q338 R341 M366	T126-E128 VanDerWaalsContact C-N 3.27Å; T126-E128 PolarHBondContact O-N 3.11Å; E128-A130 VanDerWaalsContact C-N 3.35Å; E128-F131 PolarHBondContact O-N 3.45Å; E128-Q132 WeakPolarHBondContact O-CB 3.19Å; E128-Q132 PolarHBondContact O-N 3.48Å; E128-Q338 PolarHBondContact OE1-NE2 3.48Å; E128-R341 VanDerWaalsContact CD-CZ 3.46Å; E128-R341 IonicContact OE1-CZ 3.97Å; E128-R341 IonicContact OE1-NE 2.74Å; E128-R341 IonicContact OE1-NH1 3.55Å; E128-R341 PolarHBondContact OE1-NH1 3.5Å; E128-R341 IonicContact OE1-NH2 3.84Å; E128-R341 PolarHBondContact OE1-NH2 2.93Å; E128-R341 IonicContact OE2-CZ 3.72Å; E128-R341 IonicContact OE2-NH1 3.75Å; E128-R341 IonicContact OE2-NH2 2.8Å; E128-R341 PolarHBondContact OE2-NH2 3.49Å; E128-M366 HydrophobicContact CB-CG 3.7Å; E128-M366 HydrophobicContact CB-SD 3.63Å; E128-M366 HydrophobicContact CG-CG 4.44Å; E128-M366 HydrophobicContact CG-SD 3.7Å
129	L	89.8	Confident	94.3	Very high	4 Å²	4	21.1 Å²	21.1	2%	0.021	9%	0.092	C	C	.	.	H	α-helix	trans	-64.3	-41.5	174.4	-176.7	51.5	0	0	0	111.2	C124 T126 F131 Q132 I133 E201 G365	C124-L129 HydrophobicContact CB-CB 4.32Å; C124-L129 HydrophobicContact CB-CD2 3.63Å; C124-L129 HydrophobicContact CB-CG 3.82Å; T126-L129 PolarHBondContact O-N 2.84Å; T126-L129 WeakPolarHBondContact OG1-CB 3.06Å; T126-L129 PolarHBondContact OG1-N 3.37Å; L129-F131 VanDerWaalsContact C-N 3.33Å; L129-F131 PolarHBondContact O-N 2.68Å; L129-Q132 PolarHBondContact O-N 2.94Å; L129-I133 HydrophobicContact CD1-CD1 3.81Å; L129-I133 HydrophobicContact CD1-CG1 3.91Å; L129-I133 HydrophobicContact CG-CD1 3.77Å; L129-I133 HydrophobicContact CG-CG1 4.34Å; L129-I133 WeakPolarHBondContact O-CB 3.28Å; L129-I133 VanDerWaalsContact O-CG1 3.3Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 2.8Å; L129-E201 HydrophobicContact CD2-CB 4.28Å; L129-E201 HydrophobicContact CD2-CG 3.9Å; L129-G365 VanDerWaalsContact CA-O 3.24Å; L129-G365 WeakPolarHBondContact CA-O 3.37Å; L129-G365 WeakPolarHBondContact CB-O 3.32Å; L129-G365 WeakPolarHBondContact CD1-O 3.39Å; L129-G365 PolarHBondContact N-O 2.89Å
130	A	94.3	Very high	94.2	Very high	0 Å²	0	21 Å²	21	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-58.8	-46	176.2	0	0	0	0	0	111.5	C124 T126 R127 E128 S134 V151 F153 V174	C124-A130 WeakPolarHBondContact SG-CA 3.41Å; C124-A130 VanDerWaalsContact SG-CB 3.56Å; C124-A130 PolarHBondContact SG-N 3.03Å; T126-A130 PolarHBondContact O-N 3.48Å; T126-A130 VanDerWaalsContact O-N 3.12Å; R127-A130 PolarHBondContact O-N 3.37Å; E128-A130 VanDerWaalsContact C-N 3.35Å; A130-S134 PolarHBondContact O-N 3.39Å; A130-V151 HydrophobicContact CB-CG2 4.04Å; A130-V151 WeakPolarHBondContact O-CG2 3.47Å; A130-F153 HydrophobicContact CB-CD1 3.86Å; A130-V174 HydrophobicContact CB-CG1 4.13Å; A130-V174 VanDerWaalsContact O-CG1 3.29Å; A130-V174 WeakPolarHBondContact O-CG1 3.25Å
131	F	92.3	Very high	94.1	Very high	38 Å²	38	21.6 Å²	21.6	17%	0.167	10%	0.095	C	C	.	.	H	α-helix	trans	-63.1	-42.1	175.5	-176.6	-98.4	0	0	0	112.2	R127 E128 L129 S134 K135 F153 L342	R127-F131 PolarHBondContact O-N 2.58Å; R127-F131 VanDerWaalsContact O-N 3.08Å; E128-F131 PolarHBondContact O-N 3.45Å; L129-F131 VanDerWaalsContact C-N 3.33Å; L129-F131 PolarHBondContact O-N 2.68Å; F131-S134 PolarHBondContact O-N 3.03Å; F131-S134 PolarHBondContact O-OG 3.33Å; F131-K135 HydrophobicContact CD1-CG 4.32Å; F131-K135 HydrophobicContact CE1-CG 3.96Å; F131-K135 HydrophobicContact CZ-CD 4.37Å; F131-K135 VanDerWaalsContact CZ-CE 3.43Å; F131-K135 HydrophobicContact CZ-CG 4.19Å; F131-K135 WeakPolarHBondContact O-CG 3.41Å; F131-K135 PolarHBondContact O-N 3.35Å; F131-K135 VanDerWaalsContact O-N 3.08Å; F131-F153 HydrophobicContact CB-CE1 4.08Å; F131-L342 HydrophobicContact CB-CD2 4.02Å; F131-L342 HydrophobicContact CD1-CD2 3.87Å; F131-L342 HydrophobicContact CD2-CD1 4.16Å; F131-L342 HydrophobicContact CD2-CD2 4.36Å; F131-L342 HydrophobicContact CE1-CD2 4.43Å; F131-L342 HydrophobicContact CE2-CD1 4.46Å; F131-L342 HydrophobicContact CG-CD1 4.42Å; F131-L342 HydrophobicContact CG-CD2 3.82Å
132	Q	89.3	Confident	94.1	Very high	15 Å²	15	27.6 Å²	27.6	7%	0.07	12%	0.121	C	C	.	.	H	α-helix	trans	-64.2	-47.5	178.9	-171.2	-162.2	-46.3	0	0	111.8	E128 L129 S134 K135 E136 G365 D367	E128-Q132 WeakPolarHBondContact O-CB 3.19Å; E128-Q132 PolarHBondContact O-N 3.48Å; L129-Q132 PolarHBondContact O-N 2.94Å; Q132-S134 VanDerWaalsContact C-N 3.27Å; Q132-S134 PolarHBondContact O-N 3.37Å; Q132-K135 WeakPolarHBondContact O-CA 3.2Å; Q132-K135 WeakPolarHBondContact O-CB 3.32Å; Q132-K135 PolarHBondContact O-N 2.85Å; Q132-E136 PolarHBondContact O-N 3.15Å; Q132-G365 PolarHBondContact OE1-O 2.92Å; Q132-D367 VanDerWaalsContact CD-CB 3.48Å
133	I	95.1	Very high	94	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-59.9	-40.8	177.9	-68.2	167.2	0	0	0	110.2	T100 F103 V122 C124 L129 K135 E136 Y137 V174 D200	T100-I133 HydrophobicContact CG2-CG1 4.07Å; F103-I133 HydrophobicContact CE2-CG2 3.87Å; F103-I133 HydrophobicContact CZ-CD1 4.15Å; F103-I133 HydrophobicContact CZ-CG1 4.24Å; F103-I133 HydrophobicContact CZ-CG2 4.11Å; V122-I133 HydrophobicContact CG1-CD1 4.13Å; V122-I133 HydrophobicContact CG1-CG2 4.08Å; C124-I133 HydrophobicContact CB-CD1 4.29Å; L129-I133 HydrophobicContact CD1-CD1 3.81Å; L129-I133 HydrophobicContact CD1-CG1 3.91Å; L129-I133 HydrophobicContact CG-CD1 3.77Å; L129-I133 HydrophobicContact CG-CG1 4.34Å; L129-I133 WeakPolarHBondContact O-CB 3.28Å; L129-I133 VanDerWaalsContact O-CG1 3.3Å; L129-I133 WeakPolarHBondContact O-CG1 3.36Å; L129-I133 PolarHBondContact O-N 2.8Å; I133-K135 VanDerWaalsContact C-N 3.28Å; I133-K135 PolarHBondContact O-N 3.1Å; I133-E136 PolarHBondContact O-N 2.59Å; I133-E136 VanDerWaalsContact O-N 3.16Å; I133-Y137 HydrophobicContact CG2-CD2 3.87Å; I133-Y137 HydrophobicContact CG2-CE2 3.73Å; I133-Y137 WeakPolarHBondContact O-CD2 3.27Å; I133-Y137 PolarHBondContact O-N 3.06Å; I133-V174 HydrophobicContact CB-CG1 3.9Å; I133-V174 HydrophobicContact CG2-CG1 3.82Å; I133-V174 HydrophobicContact CG2-CG2 3.99Å; I133-D200 HydrophobicContact CD1-CB 3.97Å
134	S	96.1	Very high	93.9	Very high	1 Å²	1	30.5 Å²	30.5	1%	0.007	13%	0.133	C	C	.	.	H	α-helix	trans	-62.6	-37.5	176.6	79.1	0	0	0	0	111.9	A130 F131 Q132 Y137 E138	A130-S134 PolarHBondContact O-N 3.39Å; F131-S134 PolarHBondContact O-N 3.03Å; F131-S134 PolarHBondContact O-OG 3.33Å; Q132-S134 VanDerWaalsContact C-N 3.27Å; Q132-S134 PolarHBondContact O-N 3.37Å; S134-Y137 PolarHBondContact O-N 3.31Å; S134-E138 WeakPolarHBondContact O-CG 3.49Å; S134-E138 PolarHBondContact O-N 3.44Å
135	K	93.7	Very high	93.8	Very high	58 Å²	58	36.2 Å²	36.2	25%	0.252	17%	0.17	S	C	.	.	H	α-helix	trans	-67.6	-33.8	173.6	-65.8	-47	-177.9	-170.5	0	113.4	F131 Q132 I133 E138 R139	F131-K135 HydrophobicContact CD1-CG 4.32Å; F131-K135 HydrophobicContact CE1-CG 3.96Å; F131-K135 HydrophobicContact CZ-CD 4.37Å; F131-K135 VanDerWaalsContact CZ-CE 3.43Å; F131-K135 HydrophobicContact CZ-CG 4.19Å; F131-K135 WeakPolarHBondContact O-CG 3.41Å; F131-K135 PolarHBondContact O-N 3.35Å; F131-K135 VanDerWaalsContact O-N 3.08Å; Q132-K135 WeakPolarHBondContact O-CA 3.2Å; Q132-K135 WeakPolarHBondContact O-CB 3.32Å; Q132-K135 PolarHBondContact O-N 2.85Å; I133-K135 VanDerWaalsContact C-N 3.28Å; I133-K135 PolarHBondContact O-N 3.1Å; K135-E138 WeakPolarHBondContact CD-OE2 3.34Å; K135-E138 WeakPolarHBondContact CE-OE2 3.33Å; K135-E138 IonicContact NZ-OE1 2.67Å; K135-E138 PolarHBondContact NZ-OE1 2.99Å; K135-E138 IonicContact NZ-OE2 2.62Å; K135-E138 PolarHBondContact NZ-OE2 2.97Å; K135-E138 PolarHBondContact O-N 3.23Å; K135-R139 VanDerWaalsContact O-CB 3.3Å; K135-R139 WeakPolarHBondContact O-CB 3.42Å; K135-R139 PolarHBondContact O-N 3.19Å
136	E	94.7	Very high	94	Very high	19 Å²	19	39 Å²	39	9%	0.089	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-42.7	172.6	-70.4	-59.4	114.1	0	0	111.3	T100 V104 Q132 I133 E138 R139 F140	T100-E136 HydrophobicContact CG2-CB 4.15Å; T100-E136 HydrophobicContact CG2-CG 4.03Å; V104-E136 HydrophobicContact CG2-CB 4.28Å; Q132-E136 PolarHBondContact O-N 3.15Å; I133-E136 PolarHBondContact O-N 2.59Å; I133-E136 VanDerWaalsContact O-N 3.16Å; E136-E138 PolarHBondContact O-N 3.33Å; E136-R139 PolarHBondContact O-N 3.27Å; E136-R139 IonicContact OE1-NH1 3.03Å; E136-F140 VanDerWaalsContact O-CD2 3.23Å; E136-F140 WeakPolarHBondContact O-CD2 3.44Å; E136-F140 PolarHBondContact O-N 2.92Å; E136-F140 WeakPolarHBondContact OE2-CE2 3.37Å
137	Y	98	Very high	94.4	Very high	0 Å²	0	39 Å²	39	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58	-48.5	171.2	-83.4	-72.1	0	0	0	112	F103 V104 T107 L108 V122 I133 S134 R139 F140 S141 I172 V174	F103-Y137 HydrophobicContact CE2-CE2 4.18Å; V104-Y137 HydrophobicContact CB-CD1 4.37Å; V104-Y137 HydrophobicContact CB-CE1 4.16Å; V104-Y137 HydrophobicContact CG1-CD1 3.76Å; V104-Y137 HydrophobicContact CG1-CE1 4Å; V104-Y137 HydrophobicContact CG1-CG 4.2Å; V104-Y137 HydrophobicContact CG2-CD1 4.23Å; V104-Y137 HydrophobicContact CG2-CD2 4.01Å; V104-Y137 HydrophobicContact CG2-CE1 4.06Å; V104-Y137 HydrophobicContact CG2-CE2 3.82Å; V104-Y137 HydrophobicContact CG2-CG 4.21Å; T107-Y137 WeakPolarHBondContact OG1-CE1 3.38Å; T107-Y137 PolarHBondContact OG1-OH 3.01Å; L108-Y137 HydrophobicContact CD1-CD1 4.33Å; L108-Y137 HydrophobicContact CD2-CD1 4.29Å; L108-Y137 HydrophobicContact CG-CD1 4.19Å; L108-Y137 HydrophobicContact CG-CE1 4.38Å; V122-Y137 HydrophobicContact CG2-CE2 3.84Å; V122-Y137 WeakPolarHBondContact CG2-OH 3.32Å; I133-Y137 HydrophobicContact CG2-CD2 3.87Å; I133-Y137 HydrophobicContact CG2-CE2 3.73Å; I133-Y137 WeakPolarHBondContact O-CD2 3.27Å; I133-Y137 PolarHBondContact O-N 3.06Å; S134-Y137 PolarHBondContact O-N 3.31Å; Y137-R139 VanDerWaalsContact C-N 3.26Å; Y137-R139 PolarHBondContact O-N 2.79Å; Y137-F140 PolarHBondContact O-N 3.05Å; Y137-S141 VanDerWaalsContact O-CB 3.22Å; Y137-S141 WeakPolarHBondContact O-CB 3.39Å; Y137-S141 PolarHBondContact O-N 3.43Å; Y137-S141 PolarHBondContact O-OG 3.29Å; Y137-I172 HydrophobicContact CD1-CD1 3.4Å; Y137-I172 HydrophobicContact CD1-CG2 4.11Å; Y137-I172 HydrophobicContact CD2-CG2 3.91Å; Y137-I172 HydrophobicContact CE1-CD1 3.61Å; Y137-I172 HydrophobicContact CE1-CG2 4Å; Y137-I172 HydrophobicContact CE2-CG2 3.8Å; Y137-I172 HydrophobicContact CG-CD1 4.15Å; Y137-I172 HydrophobicContact CG-CG2 4.06Å; Y137-V174 HydrophobicContact CD2-CG2 4.03Å; Y137-V174 HydrophobicContact CE2-CG2 4.16Å
138	E	96.7	Very high	94.7	Very high	84 Å²	84	36.9 Å²	36.9	39%	0.393	18%	0.176	S	C	.	.	H	α-helix	trans	-58.3	-39.8	178.9	-72.9	171.8	-157	0	0	111.8	S134 K135 E136 K142 I149	S134-E138 WeakPolarHBondContact O-CG 3.49Å; S134-E138 PolarHBondContact O-N 3.44Å; K135-E138 WeakPolarHBondContact CD-OE2 3.34Å; K135-E138 WeakPolarHBondContact CE-OE2 3.33Å; K135-E138 IonicContact NZ-OE1 2.67Å; K135-E138 PolarHBondContact NZ-OE1 2.99Å; K135-E138 IonicContact NZ-OE2 2.62Å; K135-E138 PolarHBondContact NZ-OE2 2.97Å; K135-E138 PolarHBondContact O-N 3.23Å; E136-E138 PolarHBondContact O-N 3.33Å; E138-K142 PolarHBondContact O-N 3.49Å; E138-I149 HydrophobicContact CB-CD1 4.29Å; E138-I149 HydrophobicContact CG-CD1 3.81Å
139	R	94.3	Very high	95.3	Very high	71 Å²	71	38.5 Å²	38.5	27%	0.268	19%	0.185	S	C	.	.	H	α-helix	trans	-67.1	-48.2	-179.8	-167.8	-165.8	176.3	177.1	-2.9	111.3	C67 K135 E136 Y137 K142 E369	C67-R139 PolarHBondContact O-NH2 2.81Å; C67-R139 WeakPolarHBondContact SG-CD 3.49Å; C67-R139 WeakPolarHBondContact SG-CG 3.38Å; C67-R139 PolarHBondContact SG-NE 3.14Å; K135-R139 VanDerWaalsContact O-CB 3.3Å; K135-R139 WeakPolarHBondContact O-CB 3.42Å; K135-R139 PolarHBondContact O-N 3.19Å; E136-R139 PolarHBondContact O-N 3.27Å; E136-R139 IonicContact OE1-NH1 3.03Å; Y137-R139 VanDerWaalsContact C-N 3.26Å; Y137-R139 PolarHBondContact O-N 2.79Å; R139-K142 WeakPolarHBondContact O-CB 3.15Å; R139-E369 IonicContact NH1-OE1 3.86Å
140	F	96.4	Very high	95.6	Very high	1 Å²	1	38.6 Å²	38.6	0%	0.004	19%	0.187	C	C	.	.	H	α-helix	trans	-78.4	-20.6	-179.2	-74	-67.7	0	0	0	113.7	L60 A63 I64 C67 F69 A101 V104 L105 L108 E136 Y137	L60-F140 HydrophobicContact CD1-CB 4.18Å; L60-F140 WeakPolarHBondContact CD1-O 3.49Å; A63-F140 VanDerWaalsContact CB-O 3.29Å; A63-F140 WeakPolarHBondContact CB-O 3.36Å; I64-F140 HydrophobicContact CG1-CD1 4.09Å; I64-F140 HydrophobicContact CG1-CE1 3.92Å; C67-F140 HydrophobicContact CB-CE1 4.28Å; F69-F140 HydrophobicContact CD2-CE1 4.31Å; F69-F140 HydrophobicContact CD2-CZ 4.1Å; F69-F140 HydrophobicContact CE2-CE1 4.24Å; F69-F140 AromaticContact CE2-CZ 3.6Å; F69-F140 HydrophobicContact CE2-CZ 3.6Å; F69-F140 AromaticContact CZ-CZ 3.93Å; F69-F140 HydrophobicContact CZ-CZ 3.93Å; A101-F140 HydrophobicContact CB-CE2 4.27Å; A101-F140 HydrophobicContact CB-CZ 4.29Å; V104-F140 HydrophobicContact CB-CD2 4.48Å; V104-F140 HydrophobicContact CG1-CB 3.85Å; V104-F140 HydrophobicContact CG1-CD2 3.65Å; V104-F140 HydrophobicContact CG1-CG 4.09Å; L105-F140 HydrophobicContact CD2-CB 4.37Å; L105-F140 HydrophobicContact CD2-CD1 3.52Å; L105-F140 HydrophobicContact CD2-CE1 3.85Å; L105-F140 HydrophobicContact CD2-CG 3.91Å; L105-F140 HydrophobicContact CD2-CZ 4.49Å; L108-F140 HydrophobicContact CD1-CB 3.67Å; E136-F140 VanDerWaalsContact O-CD2 3.23Å; E136-F140 WeakPolarHBondContact O-CD2 3.44Å; E136-F140 PolarHBondContact O-N 2.92Å; E136-F140 WeakPolarHBondContact OE2-CE2 3.37Å; Y137-F140 PolarHBondContact O-N 3.05Å
141	S	96.8	Very high	95.8	Very high	12 Å²	12	40.5 Å²	40.5	8%	0.084	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	12	174.6	80.5	0	0	0	0	113.5	Y137 Y143 M144	Y137-S141 VanDerWaalsContact O-CB 3.22Å; Y137-S141 WeakPolarHBondContact O-CB 3.39Å; Y137-S141 PolarHBondContact O-N 3.43Å; Y137-S141 PolarHBondContact O-OG 3.29Å; S141-Y143 PolarHBondContact O-N 3Å; S141-M144 PolarHBondContact O-N 2.99Å
142	K	96.9	Very high	96	Very high	127 Å²	127	38.9 Å²	38.9	55%	0.552	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.9	-33.8	-177.9	178	-178.9	174.6	-171.2	0	113.9	D66 E138 R139	D66-K142 IonicContact OD2-NZ 3.69Å; D66-K142 PolarHBondContact OD2-NZ 2.94Å; E138-K142 PolarHBondContact O-N 3.49Å; R139-K142 WeakPolarHBondContact O-CB 3.15Å
143	Y	97.4	Very high	96.3	Very high	55 Å²	55	38.6 Å²	38.6	22%	0.216	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.3	15.9	-178.7	-61	-69.6	0	0	0	113.7	R62 A63 D66 S141	R62-Y143 HydrophobicContact CB-CD2 3.97Å; R62-Y143 HydrophobicContact CB-CE2 4.05Å; R62-Y143 HydrophobicContact CG-CD2 3.89Å; R62-Y143 HydrophobicContact CG-CE2 3.51Å; R62-Y143 PolarHBondContact NE-OH 3.19Å; A63-Y143 HydrophobicContact CB-CD2 4.1Å; D66-Y143 WeakPolarHBondContact OD2-CE2 3.27Å; D66-Y143 VanDerWaalsContact OD2-CZ 3.29Å; D66-Y143 PolarHBondContact OD2-OH 3.07Å; S141-Y143 PolarHBondContact O-N 3Å
144	M	97	Very high	96.2	Very high	6 Å²	6	39.4 Å²	39.4	3%	0.03	20%	0.198	C	C	.	.			trans	-123.5	73.6	178.6	-59.8	179	-178.9	0	0	109.6	K57 E59 L60 L108 S141 E146 V147	K57-M144 HydrophobicContact CB-CE 4.36Å; K57-M144 HydrophobicContact CD-CE 4.07Å; E59-M144 HydrophobicContact CB-CE 4.02Å; E59-M144 HydrophobicContact CB-CG 4.08Å; L60-M144 HydrophobicContact CB-CE 3.72Å; L60-M144 HydrophobicContact CD1-CE 4.21Å; L60-M144 HydrophobicContact CG-CE 4.4Å; L108-M144 HydrophobicContact CB-SD 4.34Å; L108-M144 HydrophobicContact CD2-SD 4.29Å; S141-M144 PolarHBondContact O-N 2.99Å; M144-E146 PolarHBondContact O-N 2.92Å; M144-E146 VanDerWaalsContact O-N 3.13Å; M144-V147 HydrophobicContact CB-CB 4.28Å; M144-V147 HydrophobicContact CB-CG2 3.74Å; M144-V147 WeakPolarHBondContact O-CB 3.13Å; M144-V147 PolarHBondContact O-N 2.95Å; M144-V147 HydrophobicContact SD-CG2 4.33Å
145	P	94.2	Very high	95.7	Very high	120 Å²	120	41.9 Å²	41.9	78%	0.779	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-21.1	-170.3	26.3	-36.1	0	0	0	114.6	V147	P145-V147 VanDerWaalsContact C-N 3.31Å
146	E	95	Very high	95.5	Very high	95 Å²	95	40.7 Å²	40.7	44%	0.444	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-20.1	174.5	69.1	-78.5	179.3	0	0	113	P113 M144 K148 H171	P113-E146 HydrophobicContact CB-CB 4.46Å; P113-E146 HydrophobicContact CB-CG 3.92Å; P113-E146 HydrophobicContact CG-CG 3.75Å; M144-E146 PolarHBondContact O-N 2.92Å; M144-E146 VanDerWaalsContact O-N 3.13Å; E146-K148 PolarHBondContact O-N 2.96Å; E146-H171 PolarHBondContact O-CE1 3.44Å; E146-H171 PolarHBondContact O-ND1 2.79Å
147	V	97.4	Very high	95.3	Very high	16 Å²	16	44.6 Å²	44.6	10%	0.097	24%	0.243	C	C	.	.			trans	-77.1	122.7	-179.6	176.9	0	0	0	0	109.8	L108 P113 M144 P145 I149 I172	L108-V147 HydrophobicContact CD2-CG1 4Å; L108-V147 HydrophobicContact CD2-CG2 4.34Å; P113-V147 HydrophobicContact CG-CG2 3.71Å; M144-V147 HydrophobicContact CB-CB 4.28Å; M144-V147 HydrophobicContact CB-CG2 3.74Å; M144-V147 WeakPolarHBondContact O-CB 3.13Å; M144-V147 PolarHBondContact O-N 2.95Å; M144-V147 HydrophobicContact SD-CG2 4.33Å; P145-V147 VanDerWaalsContact C-N 3.31Å; V147-I149 HydrophobicContact CG1-CG1 4.26Å; V147-I172 HydrophobicContact CG1-CD1 3.69Å; V147-I172 HydrophobicContact CG1-CG1 4.43Å
148	K	97.5	Very high	95.1	Very high	46 Å²	46	47.2 Å²	47.2	20%	0.2	26%	0.258	C	S	.	.			trans	-113.5	131.2	-179.5	-64.5	172.9	-175.4	179.8	0	108.9	E115 E146 N168 P170 H171 I172	E115-K148 WeakPolarHBondContact OE1-CE 3.03Å; E115-K148 IonicContact OE1-NZ 2.62Å; E115-K148 PolarHBondContact OE1-NZ 3.33Å; E115-K148 IonicContact OE2-NZ 3.7Å; E115-K148 PolarHBondContact OE2-NZ 2.68Å; E146-K148 PolarHBondContact O-N 2.96Å; K148-N168 WeakPolarHBondContact CD-OD1 3.49Å; K148-N168 WeakPolarHBondContact CE-OD1 3.3Å; K148-N168 PolarHBondContact NZ-OD1 2.72Å; K148-P170 HydrophobicContact CB-CB 4.38Å; K148-P170 CarbonylContact O-C 3.58Å; K148-H171 PolarHBondContact N-ND1 3.1Å; K148-H171 PolarHBondContact O-N 2.98Å; K148-I172 PolarHBondContact O-N 3.35Å
149	I	97.9	Very high	95	Very high	40 Å²	40	50 Å²	50	21%	0.205	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	130.4	-175.4	-58.4	147	0	0	0	108.7	E138 V147 I172	E138-I149 HydrophobicContact CB-CD1 4.29Å; E138-I149 HydrophobicContact CG-CD1 3.81Å; V147-I149 HydrophobicContact CG1-CG1 4.26Å; I149-I172 WeakPolarHBondContact CA-O 3.46Å; I149-I172 HydrophobicContact CG1-CB 4.24Å; I149-I172 HydrophobicContact CG1-CD1 4.27Å
150	G	97.4	Very high	95	Very high	6 Å²	6	53 Å²	53	6%	0.062	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.6	174.3	0	0	0	0	0	110.7	P170 I172 V173 V174	G150-P170 VanDerWaalsContact N-CB 3.33Å; G150-I172 PolarHBondContact N-O 2.93Å; G150-V173 WeakPolarHBondContact O-CA 3.44Å; G150-V174 PolarHBondContact O-N 3.34Å
151	V	97.4	Very high	94.9	Very high	41 Å²	41	53.6 Å²	53.6	25%	0.248	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.2	177	65.4	0	0	0	0	111.1	A130 F153 V174	A130-V151 HydrophobicContact CB-CG2 4.04Å; A130-V151 WeakPolarHBondContact O-CG2 3.47Å; V151-F153 HydrophobicContact CG1-CE1 4.34Å; V151-F153 HydrophobicContact CG2-CD1 3.7Å; V151-F153 HydrophobicContact CG2-CE1 3.59Å; V151-V174 CarbonylContact C-O 3.42Å; V151-V174 VanDerWaalsContact CA-O 3.22Å; V151-V174 WeakPolarHBondContact CA-O 3.32Å; V151-V174 HydrophobicContact CG2-CB 4.34Å
152	F	97.7	Very high	94.8	Very high	4 Å²	4	55 Å²	55	2%	0.018	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	116.1	-173.3	-49.4	-67.4	0	0	0	112	D161 L165 P170 V173 V174 G175 T176 R179 L180 L183	F152-D161 HydrophobicContact CD1-CB 3.61Å; F152-D161 VanDerWaalsContact CD1-CG 3.47Å; F152-D161 HydrophobicContact CE1-CB 3.9Å; F152-L165 HydrophobicContact CE1-CG 4.23Å; F152-L165 HydrophobicContact CE2-CD2 3.76Å; F152-L165 HydrophobicContact CE2-CG 4.25Å; F152-L165 HydrophobicContact CZ-CD1 4.27Å; F152-L165 HydrophobicContact CZ-CD2 3.58Å; F152-L165 HydrophobicContact CZ-CG 3.72Å; F152-P170 HydrophobicContact CE2-CG 4.39Å; F152-P170 HydrophobicContact CZ-CG 4.46Å; F152-V173 HydrophobicContact CD2-CG1 3.72Å; F152-V173 HydrophobicContact CE2-CG1 3.94Å; F152-V173 HydrophobicContact CE2-CG2 4.06Å; F152-V174 PolarHBondContact N-O 2.85Å; F152-G175 WeakPolarHBondContact O-CA 3.43Å; F152-T176 PolarHBondContact O-N 2.62Å; F152-T176 VanDerWaalsContact O-N 3.16Å; F152-R179 HydrophobicContact CB-CG 3.89Å; F152-L180 HydrophobicContact CB-CD2 4.28Å; F152-L180 HydrophobicContact CD2-CD2 4.19Å; F152-L183 HydrophobicContact CB-CD1 3.72Å; F152-L183 HydrophobicContact CD1-CD1 4.16Å; F152-L183 HydrophobicContact CD2-CD1 4.24Å; F152-L183 HydrophobicContact CG-CD1 3.78Å
153	F	95.4	Very high	94.7	Very high	9 Å²	9	54.2 Å²	54.2	4%	0.039	29%	0.291	C	S	.	.			trans	-148.2	159.7	178	50.8	-107.9	0	0	0	112.8	R127 A130 F131 V151 T156 T176 R179 Q338 L342	R127-F153 HydrophobicContact CB-CB 4.04Å; R127-F153 HydrophobicContact CB-CD1 4.42Å; R127-F153 HydrophobicContact CB-CD2 3.7Å; R127-F153 HydrophobicContact CB-CE2 4.31Å; R127-F153 HydrophobicContact CB-CG 3.78Å; R127-F153 HydrophobicContact CG-CB 3.97Å; R127-F153 HydrophobicContact CG-CD2 4.06Å; R127-F153 HydrophobicContact CG-CG 4.18Å; A130-F153 HydrophobicContact CB-CD1 3.86Å; F131-F153 HydrophobicContact CB-CE1 4.08Å; V151-F153 HydrophobicContact CG1-CE1 4.34Å; V151-F153 HydrophobicContact CG2-CD1 3.7Å; V151-F153 HydrophobicContact CG2-CE1 3.59Å; F153-T156 HydrophobicContact CD2-CG2 4.06Å; F153-T156 HydrophobicContact CE2-CG2 3.55Å; F153-T156 HydrophobicContact CZ-CG2 4.41Å; F153-T156 PolarHBondContact O-OG1 2.82Å; F153-T156 VanDerWaalsContact O-OG1 3.13Å; F153-T176 WeakPolarHBondContact CA-OG1 3.28Å; F153-T176 HydrophobicContact CB-CG2 3.77Å; F153-R179 PolarHBondContact O-NH1 3.19Å; F153-R179 PolarHBondContact O-NH2 3.28Å; F153-Q338 HydrophobicContact CD2-CG 4.12Å; F153-Q338 HydrophobicContact CE2-CG 3.59Å; F153-L342 HydrophobicContact CE2-CD1 4.32Å; F153-L342 HydrophobicContact CZ-CD1 3.87Å
154	G	91.5	Very high	94.5	Very high	17 Å²	17	54.1 Å²	54.1	18%	0.175	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56	158.2	-178.4	0	0	0	0	0	114.7	R127 T156	R127-G154 WeakPolarHBondContact CD-O 3.41Å; R127-G154 VanDerWaalsContact CZ-C 3.45Å; R127-G154 PolarHBondContact NE-O 3.04Å; R127-G154 PolarHBondContact NH1-O 3.44Å; G154-T156 VanDerWaalsContact C-N 3.3Å; G154-T156 PolarHBondContact O-N 3.05Å
155	G	87.1	Confident	94.4	Very high	52 Å²	52	54 Å²	54	54%	0.536	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	83.2	-1.5	176.2	0	0	0	0	0	115.5
156	T	88.8	Confident	94.4	Very high	34 Å²	34	55.6 Å²	55.6	21%	0.209	29%	0.286	C	S	.	.	S	Bend	trans	-106.1	164.9	167.2	64.4	0	0	0	0	111.2	F153 G154 V158 R179 Q338	F153-T156 HydrophobicContact CD2-CG2 4.06Å; F153-T156 HydrophobicContact CE2-CG2 3.55Å; F153-T156 HydrophobicContact CZ-CG2 4.41Å; F153-T156 PolarHBondContact O-OG1 2.82Å; F153-T156 VanDerWaalsContact O-OG1 3.13Å; G154-T156 VanDerWaalsContact C-N 3.3Å; G154-T156 PolarHBondContact O-N 3.05Å; T156-V158 PolarHBondContact O-N 2.75Å; T156-R179 PolarHBondContact O-NH2 3.38Å; T156-R179 PolarHBondContact OG1-NH1 3.2Å; T156-Q338 HydrophobicContact CG2-CB 4.5Å; T156-Q338 HydrophobicContact CG2-CG 4.21Å
157	N	90.6	Very high	94.3	Very high	100 Å²	100	57.5 Å²	57.5	54%	0.535	30%	0.3	S	S	.	.			trans	-67.5	111.4	179.4	-175.7	-8.4	0	0	0	111.9	K159 K160	N157-K159 VanDerWaalsContact C-N 3.26Å; N157-K159 PolarHBondContact O-N 2.77Å; N157-K159 WeakPolarHBondContact OD1-CB 3.46Å; N157-K159 PolarHBondContact OD1-N 2.89Å; N157-K160 HydrophobicContact CB-CB 4.43Å; N157-K160 WeakPolarHBondContact O-CB 3.49Å; N157-K160 PolarHBondContact O-N 2.89Å; N157-K160 VanDerWaalsContact O-N 3.15Å
158	V	94	Very high	94	Very high	55 Å²	55	60.6 Å²	60.6	33%	0.333	32%	0.315	S	S	.	.	H	α-helix	trans	-59.6	-34	-179.8	-179.7	0	0	0	0	112.4	T156 K160 D161 E162 L183	T156-V158 PolarHBondContact O-N 2.75Å; V158-K160 VanDerWaalsContact C-N 3.26Å; V158-K160 PolarHBondContact O-N 3.27Å; V158-D161 WeakPolarHBondContact O-CB 3.2Å; V158-D161 PolarHBondContact O-N 3.43Å; V158-D161 VanDerWaalsContact O-N 3.1Å; V158-E162 HydrophobicContact CG1-CG 4.29Å; V158-E162 WeakPolarHBondContact O-CG 3.14Å; V158-E162 PolarHBondContact O-N 3.28Å; V158-L183 HydrophobicContact CG1-CD2 4.21Å
159	K	94.2	Very high	93.9	Very high	143 Å²	143	60 Å²	60	62%	0.622	32%	0.316	S	S	*	.	H	α-helix	trans	-62.7	-35.3	179.6	-66.8	-175.4	175.4	-176.7	0	112.2	N157 D161 E162 E163	N157-K159 VanDerWaalsContact C-N 3.26Å; N157-K159 PolarHBondContact O-N 2.77Å; N157-K159 WeakPolarHBondContact OD1-CB 3.46Å; N157-K159 PolarHBondContact OD1-N 2.89Å; K159-D161 VanDerWaalsContact C-N 3.33Å; K159-E162 PolarHBondContact O-N 3.01Å; K159-E163 WeakPolarHBondContact O-CB 3.19Å; K159-E163 WeakPolarHBondContact O-CG 3.08Å; K159-E163 PolarHBondContact O-N 2.85Å
160	K	93.6	Very high	93.9	Very high	134 Å²	134	58.3 Å²	58.3	58%	0.583	31%	0.307	S	S	*	.	H	α-helix	trans	-66	-38.8	175.8	-173	-177.8	177.4	-177.6	0	111.2	N157 V158 E163 T164	N157-K160 HydrophobicContact CB-CB 4.43Å; N157-K160 WeakPolarHBondContact O-CB 3.49Å; N157-K160 PolarHBondContact O-N 2.89Å; N157-K160 VanDerWaalsContact O-N 3.15Å; V158-K160 VanDerWaalsContact C-N 3.26Å; V158-K160 PolarHBondContact O-N 3.27Å; K160-E163 PolarHBondContact O-N 2.69Å; K160-T164 WeakPolarHBondContact O-CB 3.39Å; K160-T164 PolarHBondContact O-N 3.01Å; K160-T164 PolarHBondContact O-OG1 2.96Å
161	D	95.2	Very high	94	Very high	13 Å²	13	58.1 Å²	58.1	7%	0.07	31%	0.305	C	S	.	.	H	α-helix	trans	-64.8	-45.3	174.8	-62.8	1.3	0	0	0	110.7	F152 V158 K159 E163 T164 L165 R179 L183	F152-D161 HydrophobicContact CD1-CB 3.61Å; F152-D161 VanDerWaalsContact CD1-CG 3.47Å; F152-D161 HydrophobicContact CE1-CB 3.9Å; V158-D161 WeakPolarHBondContact O-CB 3.2Å; V158-D161 PolarHBondContact O-N 3.43Å; V158-D161 VanDerWaalsContact O-N 3.1Å; K159-D161 VanDerWaalsContact C-N 3.33Å; D161-E163 PolarHBondContact O-N 3.3Å; D161-T164 WeakPolarHBondContact O-CB 3.38Å; D161-T164 PolarHBondContact O-N 3.35Å; D161-L165 WeakPolarHBondContact O-CG 3.38Å; D161-L165 PolarHBondContact O-N 3.33Å; D161-R179 IonicContact OD2-CZ 2.76Å; D161-R179 IonicContact OD2-NH1 3.09Å; D161-R179 PolarHBondContact OD2-NH1 3.36Å; D161-L183 HydrophobicContact CB-CD1 4.35Å; D161-L183 HydrophobicContact CB-CD2 4.09Å
162	E	95.1	Very high	94	Very high	43 Å²	43	56.1 Å²	56.1	20%	0.201	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-44.5	176	-67.1	-177.3	-174.1	0	0	112.1	V158 K159 L165 R166 L183 V188	V158-E162 HydrophobicContact CG1-CG 4.29Å; V158-E162 WeakPolarHBondContact O-CG 3.14Å; V158-E162 PolarHBondContact O-N 3.28Å; K159-E162 PolarHBondContact O-N 3.01Å; E162-L165 PolarHBondContact O-N 2.99Å; E162-R166 VanDerWaalsContact O-CG 3.31Å; E162-R166 WeakPolarHBondContact O-CG 3.32Å; E162-R166 PolarHBondContact O-N 3.26Å; E162-R166 IonicContact OE2-CZ 3.86Å; E162-R166 IonicContact OE2-NH2 2.86Å; E162-R166 PolarHBondContact OE2-NH2 3.31Å; E162-L183 HydrophobicContact CG-CD2 4.25Å; E162-V188 HydrophobicContact CB-CG1 4.2Å; E162-V188 HydrophobicContact CB-CG2 4.44Å; E162-V188 HydrophobicContact CG-CB 4.43Å; E162-V188 HydrophobicContact CG-CG1 3.99Å; E162-V188 HydrophobicContact CG-CG2 3.94Å
163	E	94.1	Very high	94.1	Very high	110 Å²	110	56 Å²	56	51%	0.514	29%	0.292	S	S	.	.	H	α-helix	trans	-62.8	-42.5	176.3	-75.8	169.1	-167.8	0	0	111.7	K159 K160 D161 L165 R166 N167	K159-E163 WeakPolarHBondContact O-CB 3.19Å; K159-E163 WeakPolarHBondContact O-CG 3.08Å; K159-E163 PolarHBondContact O-N 2.85Å; K160-E163 PolarHBondContact O-N 2.69Å; D161-E163 PolarHBondContact O-N 3.3Å; E163-L165 VanDerWaalsContact C-N 3.35Å; E163-L165 PolarHBondContact O-N 2.81Å; E163-R166 PolarHBondContact O-N 3.36Å; E163-N167 WeakPolarHBondContact O-CB 3.47Å; E163-N167 PolarHBondContact O-N 2.87Å; E163-N167 PolarHBondContact O-ND2 3.15Å
164	T	93.5	Very high	94.2	Very high	53 Å²	53	55.5 Å²	55.5	33%	0.325	29%	0.29	S	S	.	.	H	α-helix	trans	-59.9	-47.4	176.4	-57.2	0	0	0	0	110.5	K160 D161 R166 N167 N168	K160-T164 WeakPolarHBondContact O-CB 3.39Å; K160-T164 PolarHBondContact O-N 3.01Å; K160-T164 PolarHBondContact O-OG1 2.96Å; D161-T164 WeakPolarHBondContact O-CB 3.38Å; D161-T164 PolarHBondContact O-N 3.35Å; T164-R166 PolarHBondContact O-N 3.45Å; T164-N167 PolarHBondContact O-N 3.37Å; T164-N168 CarbonylContact O-C 3.19Å; T164-N168 WeakPolarHBondContact O-CA 3.37Å; T164-N168 PolarHBondContact O-N 2.99Å; T164-N168 VanDerWaalsContact O-O 3.14Å
165	L	95.3	Very high	94.5	Very high	4 Å²	4	54.7 Å²	54.7	2%	0.021	28%	0.282	C	S	.	.	H	α-helix	trans	-65.2	-36.1	-179.6	-73.4	169.4	0	0	0	113.4	F152 D161 E162 E163 T169 P170 L183 V188 L189	F152-L165 HydrophobicContact CE1-CG 4.23Å; F152-L165 HydrophobicContact CE2-CD2 3.76Å; F152-L165 HydrophobicContact CE2-CG 4.25Å; F152-L165 HydrophobicContact CZ-CD1 4.27Å; F152-L165 HydrophobicContact CZ-CD2 3.58Å; F152-L165 HydrophobicContact CZ-CG 3.72Å; D161-L165 WeakPolarHBondContact O-CG 3.38Å; D161-L165 PolarHBondContact O-N 3.33Å; E162-L165 PolarHBondContact O-N 2.99Å; E163-L165 VanDerWaalsContact C-N 3.35Å; E163-L165 PolarHBondContact O-N 2.81Å; L165-T169 PolarHBondContact O-OG1 2.8Å; L165-P170 HydrophobicContact CD2-CG 4.36Å; L165-L183 HydrophobicContact CD1-CB 4.32Å; L165-L183 HydrophobicContact CD1-CD1 4.1Å; L165-L183 HydrophobicContact CD1-CD2 4.14Å; L165-L183 HydrophobicContact CD1-CG 4.41Å; L165-V188 HydrophobicContact CD1-CB 4.45Å; L165-V188 HydrophobicContact CD1-CG2 3.74Å; L165-L189 HydrophobicContact CD1-CB 3.96Å; L165-L189 HydrophobicContact CD2-CD1 3.86Å
166	R	92.5	Very high	95	Very high	153 Å²	153	53 Å²	53	58%	0.577	26%	0.261	S	S	*	.	H	α-helix	trans	-74.3	-37.9	178.4	-71.7	178.2	-160.9	151.5	13.6	113.3	E162 E163 T164	E162-R166 VanDerWaalsContact O-CG 3.31Å; E162-R166 WeakPolarHBondContact O-CG 3.32Å; E162-R166 PolarHBondContact O-N 3.26Å; E162-R166 IonicContact OE2-CZ 3.86Å; E162-R166 IonicContact OE2-NH2 2.86Å; E162-R166 PolarHBondContact OE2-NH2 3.31Å; E163-R166 PolarHBondContact O-N 3.36Å; T164-R166 PolarHBondContact O-N 3.45Å
167	N	92.8	Very high	95.4	Very high	135 Å²	135	51.6 Å²	51.6	72%	0.722	25%	0.252	S	S	*	.	H	α-helix	trans	-100.4	-24	-170.1	-62.4	-30.6	0	0	0	113.4	E163 T164	E163-N167 WeakPolarHBondContact O-CB 3.47Å; E163-N167 PolarHBondContact O-N 2.87Å; E163-N167 PolarHBondContact O-ND2 3.15Å; T164-N167 PolarHBondContact O-N 3.37Å
168	N	92.9	Very high	95.7	Very high	80 Å²	80	48.6 Å²	48.6	43%	0.428	25%	0.245	S	C	.	.	S	Bend	trans	-150.8	69.4	-176.8	-170	37.3	0	0	0	110.4	K148 T164 P170	K148-N168 WeakPolarHBondContact CD-OD1 3.49Å; K148-N168 WeakPolarHBondContact CE-OD1 3.3Å; K148-N168 PolarHBondContact NZ-OD1 2.72Å; T164-N168 CarbonylContact O-C 3.19Å; T164-N168 WeakPolarHBondContact O-CA 3.37Å; T164-N168 PolarHBondContact O-N 2.99Å; T164-N168 VanDerWaalsContact O-O 3.14Å; N168-P170 WeakPolarHBondContact O-CD 3.41Å
169	T	95.4	Very high	95.8	Very high	34 Å²	34	47 Å²	47	21%	0.209	23%	0.234	C	C	.	.			trans	-58.3	121.9	-178	-47.9	0	0	0	0	110.6	V118 L165	V118-T169 HydrophobicContact CG2-CG2 4.02Å; L165-T169 PolarHBondContact O-OG1 2.8Å
170	P	97.8	Very high	96	Very high	4 Å²	4	40.3 Å²	40.3	3%	0.026	20%	0.204	C	C	.	.			trans	-78.8	148.1	-179.4	32.4	-36.2	0	0	0	112	V118 K148 G150 F152 L165 N168 V173	V118-P170 WeakPolarHBondContact CG2-O 3.3Å; K148-P170 HydrophobicContact CB-CB 4.38Å; K148-P170 CarbonylContact O-C 3.58Å; G150-P170 VanDerWaalsContact N-CB 3.33Å; F152-P170 HydrophobicContact CE2-CG 4.39Å; F152-P170 HydrophobicContact CZ-CG 4.46Å; L165-P170 HydrophobicContact CD2-CG 4.36Å; N168-P170 WeakPolarHBondContact O-CD 3.41Å; P170-V173 HydrophobicContact CG-CG2 3.62Å
171	H	98.4	Very high	96.2	Very high	2 Å²	2	34.1 Å²	34.1	1%	0.009	18%	0.177	C	C	.	.	S	Bend	trans	-75	-29.9	171.7	-55.4	119.5	0	0	0	111.8	M111 E114 H117 L119 C120 E146 K148	M111-H171 HydrophobicContact SD-CB 3.92Å; E114-H171 PolarHBondContact O-CD2 3.3Å; E114-H171 PolarHBondContact O-NE2 3.49Å; H117-H171 PolarHBondContact O-CD2 3.39Å; L119-H171 PolarHBondContact N-O 2.63Å; C120-H171 PolarHBondContact N-O 3.24Å; E146-H171 PolarHBondContact O-CE1 3.44Å; E146-H171 PolarHBondContact O-ND1 2.79Å; K148-H171 PolarHBondContact N-ND1 3.1Å; K148-H171 PolarHBondContact O-N 2.98Å
172	I	98.7	Very high	96.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.6	-179.8	-56.9	172.6	0	0	0	108.7	L108 M111 C120 Y137 V147 K148 I149 G150 V174	L108-I172 HydrophobicContact CD2-CD1 3.83Å; M111-I172 HydrophobicContact CE-CD1 4.14Å; M111-I172 HydrophobicContact CE-CG1 3.64Å; M111-I172 HydrophobicContact SD-CD1 4.26Å; M111-I172 HydrophobicContact SD-CG1 3.98Å; C120-I172 HydrophobicContact CB-CB 4.46Å; C120-I172 HydrophobicContact CB-CG1 4.11Å; C120-I172 HydrophobicContact CB-CG2 4.3Å; Y137-I172 HydrophobicContact CD1-CD1 3.4Å; Y137-I172 HydrophobicContact CD1-CG2 4.11Å; Y137-I172 HydrophobicContact CD2-CG2 3.91Å; Y137-I172 HydrophobicContact CE1-CD1 3.61Å; Y137-I172 HydrophobicContact CE1-CG2 4Å; Y137-I172 HydrophobicContact CE2-CG2 3.8Å; Y137-I172 HydrophobicContact CG-CD1 4.15Å; Y137-I172 HydrophobicContact CG-CG2 4.06Å; V147-I172 HydrophobicContact CG1-CD1 3.69Å; V147-I172 HydrophobicContact CG1-CG1 4.43Å; K148-I172 PolarHBondContact O-N 3.35Å; I149-I172 WeakPolarHBondContact CA-O 3.46Å; I149-I172 HydrophobicContact CG1-CB 4.24Å; I149-I172 HydrophobicContact CG1-CD1 4.27Å; G150-I172 PolarHBondContact N-O 2.93Å; I172-V174 HydrophobicContact CG2-CG2 4.26Å
173	V	98.6	Very high	96.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	124.7	175.1	171.9	0	0	0	0	109.6	V118 C120 L121 V122 G150 F152 P170 L180 L189	V118-V173 HydrophobicContact CB-CG2 4.43Å; V118-V173 HydrophobicContact CG1-CB 3.97Å; V118-V173 HydrophobicContact CG1-CG2 3.51Å; V118-V173 HydrophobicContact CG2-CG2 3.99Å; C120-V173 PolarHBondContact O-N 3Å; L121-V173 CarbonylContact C-O 3.52Å; L121-V173 WeakPolarHBondContact CA-O 3.39Å; L121-V173 HydrophobicContact CD1-CB 4Å; L121-V173 HydrophobicContact CD1-CG1 3.72Å; V122-V173 PolarHBondContact N-O 2.69Å; G150-V173 WeakPolarHBondContact O-CA 3.44Å; F152-V173 HydrophobicContact CD2-CG1 3.72Å; F152-V173 HydrophobicContact CE2-CG1 3.94Å; F152-V173 HydrophobicContact CE2-CG2 4.06Å; P170-V173 HydrophobicContact CG-CG2 3.62Å; V173-L180 HydrophobicContact CG1-CD2 3.48Å; V173-L180 VanDerWaalsContact CG1-CD2 3.48Å; V173-L189 HydrophobicContact CG2-CD1 4.32Å
174	V	98.6	Very high	96.6	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	135.1	173.2	-171.5	0	0	0	0	108.9	V122 A130 I133 Y137 G150 V151 F152 I172	V122-V174 HydrophobicContact CB-CG1 4.26Å; V122-V174 HydrophobicContact CB-CG2 4.24Å; V122-V174 HydrophobicContact CG1-CG1 4.39Å; V122-V174 CarbonylContact O-C 3.5Å; V122-V174 VanDerWaalsContact O-CA 3.32Å; V122-V174 WeakPolarHBondContact O-CA 3.33Å; A130-V174 HydrophobicContact CB-CG1 4.13Å; A130-V174 VanDerWaalsContact O-CG1 3.29Å; A130-V174 WeakPolarHBondContact O-CG1 3.25Å; I133-V174 HydrophobicContact CB-CG1 3.9Å; I133-V174 HydrophobicContact CG2-CG1 3.82Å; I133-V174 HydrophobicContact CG2-CG2 3.99Å; Y137-V174 HydrophobicContact CD2-CG2 4.03Å; Y137-V174 HydrophobicContact CE2-CG2 4.16Å; G150-V174 PolarHBondContact O-N 3.34Å; V151-V174 CarbonylContact C-O 3.42Å; V151-V174 VanDerWaalsContact CA-O 3.22Å; V151-V174 WeakPolarHBondContact CA-O 3.32Å; V151-V174 HydrophobicContact CG2-CB 4.34Å; F152-V174 PolarHBondContact N-O 2.85Å; I172-V174 HydrophobicContact CG2-CG2 4.26Å
175	G	97.9	Very high	96.7	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.3	177.3	178.5	0	0	0	0	0	116.9	V122 M123 C124 F152	V122-G175 PolarHBondContact O-N 3.43Å; M123-G175 VanDerWaalsContact CA-O 3.31Å; M123-G175 WeakPolarHBondContact CA-O 3.47Å; C124-G175 PolarHBondContact N-O 3.47Å; C124-G175 VanDerWaalsContact N-O 3.12Å; F152-G175 WeakPolarHBondContact O-CA 3.43Å
176	T	96.8	Very high	96.7	Very high	16 Å²	16	36.8 Å²	36.8	10%	0.098	19%	0.194	C	C	.	.			trans	-90.8	140.1	172.7	57.4	0	0	0	0	110.4	C124 R127 F152 F153 G178 R179 L180	C124-T176 WeakPolarHBondContact O-CA 3.44Å; R127-T176 HydrophobicContact CG-CG2 4.26Å; F152-T176 PolarHBondContact O-N 2.62Å; F152-T176 VanDerWaalsContact O-N 3.16Å; F153-T176 WeakPolarHBondContact CA-OG1 3.28Å; F153-T176 HydrophobicContact CB-CG2 3.77Å; T176-G178 PolarHBondContact O-N 2.84Å; T176-R179 PolarHBondContact O-N 2.77Å; T176-R179 VanDerWaalsContact O-N 3.09Å; T176-L180 PolarHBondContact O-N 3.05Å; T176-L180 VanDerWaalsContact O-N 3.16Å
177	P	97.8	Very high	96.7	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.026	21%	0.207	C	C	.	.	H	α-helix	trans	-48.7	-51.2	-172.8	-30.3	34	0	0	0	114.5	M123 C124 R179 L180 L181 M205 D214 V215	M123-P177 HydrophobicContact SD-CB 4.44Å; M123-P177 HydrophobicContact SD-CG 4.37Å; C124-P177 VanDerWaalsContact O-CD 3.32Å; C124-P177 WeakPolarHBondContact O-CD 3.33Å; P177-R179 VanDerWaalsContact C-N 3.34Å; P177-R179 PolarHBondContact O-N 3.48Å; P177-L180 PolarHBondContact O-N 2.85Å; P177-L181 WeakPolarHBondContact O-CB 2.94Å; P177-L181 PolarHBondContact O-N 3.4Å; P177-M205 HydrophobicContact CG-CG 4.49Å; P177-M205 HydrophobicContact CG-SD 3.9Å; P177-D214 HydrophobicContact CB-CB 3.67Å; P177-V215 HydrophobicContact CB-CG2 3.93Å; P177-V215 HydrophobicContact CG-CG2 3.57Å
178	G	96.5	Very high	96.9	Very high	38 Å²	38	35.1 Å²	35.1	39%	0.392	18%	0.18	S	C	.	.	H	α-helix	trans	-62.3	-35.1	-177.1	0	0	0	0	0	114.5	T176 A182 D214	T176-G178 PolarHBondContact O-N 2.84Å; G178-A182 WeakPolarHBondContact O-CB 3.26Å; G178-A182 PolarHBondContact O-N 3.36Å; G178-D214 WeakPolarHBondContact CA-OD2 3.39Å
179	R	97	Very high	97.1	Very high	22 Å²	22	31.7 Å²	31.7	8%	0.083	16%	0.161	C	C	.	.	H	α-helix	trans	-72.2	-44.6	175.9	174.8	60.1	65.4	88.8	-3.5	111.1	F152 F153 T156 D161 T176 P177 L181 A182 L183	F152-R179 HydrophobicContact CB-CG 3.89Å; F153-R179 PolarHBondContact O-NH1 3.19Å; F153-R179 PolarHBondContact O-NH2 3.28Å; T156-R179 PolarHBondContact O-NH2 3.38Å; T156-R179 PolarHBondContact OG1-NH1 3.2Å; D161-R179 IonicContact OD2-CZ 2.76Å; D161-R179 IonicContact OD2-NH1 3.09Å; D161-R179 PolarHBondContact OD2-NH1 3.36Å; T176-R179 PolarHBondContact O-N 2.77Å; T176-R179 VanDerWaalsContact O-N 3.09Å; P177-R179 VanDerWaalsContact C-N 3.34Å; P177-R179 PolarHBondContact O-N 3.48Å; R179-L181 VanDerWaalsContact C-N 3.34Å; R179-L181 PolarHBondContact O-N 3.4Å; R179-A182 WeakPolarHBondContact O-CB 3.39Å; R179-A182 PolarHBondContact O-N 2.94Å; R179-L183 HydrophobicContact CG-CD1 4.04Å; R179-L183 WeakPolarHBondContact O-CG 3.27Å; R179-L183 PolarHBondContact O-N 3.48Å
180	L	98.2	Very high	97.1	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-62.6	-43.5	179.4	-67.8	168.5	0	0	0	111.2	L121 M123 F152 V173 T176 P177 A182 L183 L184 L189	L121-L180 HydrophobicContact CD1-CD1 3.98Å; L121-L180 HydrophobicContact CD1-CD2 4.33Å; M123-L180 HydrophobicContact CG-CD1 3.48Å; M123-L180 VanDerWaalsContact CG-CD1 3.48Å; M123-L180 HydrophobicContact SD-CD1 3.82Å; F152-L180 HydrophobicContact CB-CD2 4.28Å; F152-L180 HydrophobicContact CD2-CD2 4.19Å; V173-L180 HydrophobicContact CG1-CD2 3.48Å; V173-L180 VanDerWaalsContact CG1-CD2 3.48Å; T176-L180 PolarHBondContact O-N 3.05Å; T176-L180 VanDerWaalsContact O-N 3.16Å; P177-L180 PolarHBondContact O-N 2.85Å; L180-A182 VanDerWaalsContact C-N 3.31Å; L180-A182 PolarHBondContact O-N 2.86Å; L180-L183 PolarHBondContact O-N 2.72Å; L180-L184 WeakPolarHBondContact O-CG 3.22Å; L180-L184 PolarHBondContact O-N 3.19Å; L180-L189 HydrophobicContact CD2-CD2 4.15Å
181	L	97.8	Very high	97.1	Very high	4 Å²	4	32.7 Å²	32.7	2%	0.021	17%	0.17	C	C	.	.	H	α-helix	trans	-61.7	-39	175.6	-174.6	59.5	0	0	0	112.3	P177 R179 L184 R185 D214 D217 V218	P177-L181 WeakPolarHBondContact O-CB 2.94Å; P177-L181 PolarHBondContact O-N 3.4Å; R179-L181 VanDerWaalsContact C-N 3.34Å; R179-L181 PolarHBondContact O-N 3.4Å; L181-L184 PolarHBondContact O-N 3.12Å; L181-R185 HydrophobicContact CD1-CG 4.4Å; L181-R185 WeakPolarHBondContact O-CB 3.4Å; L181-R185 VanDerWaalsContact O-CG 3.29Å; L181-R185 WeakPolarHBondContact O-CG 3.44Å; L181-R185 PolarHBondContact O-N 2.96Å; L181-D214 HydrophobicContact CD2-CB 4.05Å; L181-D214 VanDerWaalsContact CD2-OD1 3.29Å; L181-D214 WeakPolarHBondContact CD2-OD1 3.26Å; L181-D217 HydrophobicContact CD1-CB 3.88Å; L181-D217 HydrophobicContact CD2-CB 4.26Å; L181-V218 HydrophobicContact CB-CG2 3.98Å; L181-V218 HydrophobicContact CD1-CG2 4.16Å
182	A	96.9	Very high	97	Very high	50 Å²	50	37.7 Å²	37.7	41%	0.413	20%	0.197	S	C	.	.	H	α-helix	trans	-62.8	-44.2	174.9	0	0	0	0	0	112.2	G178 R179 L180 R185 S186	G178-A182 WeakPolarHBondContact O-CB 3.26Å; G178-A182 PolarHBondContact O-N 3.36Å; R179-A182 WeakPolarHBondContact O-CB 3.39Å; R179-A182 PolarHBondContact O-N 2.94Å; L180-A182 VanDerWaalsContact C-N 3.31Å; L180-A182 PolarHBondContact O-N 2.86Å; A182-R185 PolarHBondContact O-N 3.44Å; A182-S186 PolarHBondContact O-N 3.16Å; A182-S186 PolarHBondContact O-OG 2.9Å
183	L	97.8	Very high	97	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.2	-34.2	178.7	-66.9	167.9	0	0	0	112.8	F152 V158 D161 E162 L165 R179 L180 S186 R187 V188 L189	F152-L183 HydrophobicContact CB-CD1 3.72Å; F152-L183 HydrophobicContact CD1-CD1 4.16Å; F152-L183 HydrophobicContact CD2-CD1 4.24Å; F152-L183 HydrophobicContact CG-CD1 3.78Å; V158-L183 HydrophobicContact CG1-CD2 4.21Å; D161-L183 HydrophobicContact CB-CD1 4.35Å; D161-L183 HydrophobicContact CB-CD2 4.09Å; E162-L183 HydrophobicContact CG-CD2 4.25Å; L165-L183 HydrophobicContact CD1-CB 4.32Å; L165-L183 HydrophobicContact CD1-CD1 4.1Å; L165-L183 HydrophobicContact CD1-CD2 4.14Å; L165-L183 HydrophobicContact CD1-CG 4.41Å; R179-L183 HydrophobicContact CG-CD1 4.04Å; R179-L183 WeakPolarHBondContact O-CG 3.27Å; R179-L183 PolarHBondContact O-N 3.48Å; L180-L183 PolarHBondContact O-N 2.72Å; L183-S186 PolarHBondContact O-OG 2.94Å; L183-S186 VanDerWaalsContact O-OG 3.13Å; L183-R187 PolarHBondContact O-N 2.82Å; L183-V188 HydrophobicContact CB-CG2 4.09Å; L183-V188 HydrophobicContact CD2-CG2 3.75Å; L183-V188 WeakPolarHBondContact O-CG2 3.41Å; L183-V188 PolarHBondContact O-N 3.46Å; L183-L189 HydrophobicContact CB-CB 4.05Å; L183-L189 HydrophobicContact CB-CD2 4.37Å; L183-L189 PolarHBondContact O-N 3.43Å
184	L	97.2	Very high	96.9	Very high	8 Å²	8	41.9 Å²	41.9	4%	0.042	22%	0.216	C	C	.	.	H	α-helix	trans	-65.7	-46.5	171	-79.4	167.7	0	0	0	111.8	L180 L181 S186 R187 L189 L191 V218 M221	L180-L184 WeakPolarHBondContact O-CG 3.22Å; L180-L184 PolarHBondContact O-N 3.19Å; L181-L184 PolarHBondContact O-N 3.12Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.44Å; L184-R187 WeakPolarHBondContact O-CA 3.48Å; L184-R187 PolarHBondContact O-N 2.98Å; L184-L189 HydrophobicContact CD2-CB 4.36Å; L184-L189 HydrophobicContact CD2-CD2 4.37Å; L184-L189 HydrophobicContact CD2-CG 4.1Å; L184-L189 WeakPolarHBondContact CD2-O 3.24Å; L184-L189 HydrophobicContact CG-CD2 4.13Å; L184-L189 HydrophobicContact CG-CG 4.35Å; L184-L191 HydrophobicContact CD1-CD1 3.7Å; L184-L191 HydrophobicContact CD2-CB 4.47Å; L184-L191 HydrophobicContact CD2-CD1 3.73Å; L184-L191 HydrophobicContact CD2-CG 3.78Å; L184-L191 HydrophobicContact CG-CD1 4.17Å; L184-V218 HydrophobicContact CD1-CB 4.27Å; L184-V218 HydrophobicContact CD1-CG1 4Å; L184-V218 HydrophobicContact CD1-CG2 3.91Å; L184-M221 HydrophobicContact CB-CE 3.96Å; L184-M221 HydrophobicContact CB-SD 4.05Å; L184-M221 HydrophobicContact CD1-SD 3.99Å; L184-M221 HydrophobicContact CD2-CE 4.24Å; L184-M221 HydrophobicContact CG-SD 4.43Å
185	R	95.8	Very high	96.8	Very high	166 Å²	166	46.5 Å²	46.5	63%	0.626	24%	0.236	S	C	*	.	H	α-helix	trans	-65.7	-32.8	-179.8	-75.5	176.8	177	173.1	2.5	112.5	L181 A182 R187 D217	L181-R185 HydrophobicContact CD1-CG 4.4Å; L181-R185 WeakPolarHBondContact O-CB 3.4Å; L181-R185 VanDerWaalsContact O-CG 3.29Å; L181-R185 WeakPolarHBondContact O-CG 3.44Å; L181-R185 PolarHBondContact O-N 2.96Å; A182-R185 PolarHBondContact O-N 3.44Å; R185-R187 PolarHBondContact O-N 2.98Å; R185-D217 IonicContact NH2-OD2 2.77Å; R185-D217 PolarHBondContact NH2-OD2 3.48Å
186	S	94.5	Very high	96.8	Very high	56 Å²	56	47 Å²	47	39%	0.392	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-1.6	171.8	64.6	0	0	0	0	113.8	A182 L183 L184 V188	A182-S186 PolarHBondContact O-N 3.16Å; A182-S186 PolarHBondContact O-OG 2.9Å; L183-S186 PolarHBondContact O-OG 2.94Å; L183-S186 VanDerWaalsContact O-OG 3.13Å; L184-S186 VanDerWaalsContact C-N 3.31Å; L184-S186 PolarHBondContact O-N 3.44Å; S186-V188 PolarHBondContact O-N 3.41Å
187	R	94	Very high	96.9	Very high	228 Å²	228	46.2 Å²	46.2	86%	0.86	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.3	22.8	177.7	-52.7	-176.6	179.9	-176.6	-1.6	114.7	L183 L184 R185	L183-R187 PolarHBondContact O-N 2.82Å; L184-R187 WeakPolarHBondContact O-CA 3.48Å; L184-R187 PolarHBondContact O-N 2.98Å; R185-R187 PolarHBondContact O-N 2.98Å
188	V	95.5	Very high	96.9	Very high	24 Å²	24	46 Å²	46	15%	0.145	23%	0.232	C	C	.	.	S	Bend	trans	-88.2	-22.2	172.3	-61	0	0	0	0	112.5	E162 L165 L183 S186	E162-V188 HydrophobicContact CB-CG1 4.2Å; E162-V188 HydrophobicContact CB-CG2 4.44Å; E162-V188 HydrophobicContact CG-CB 4.43Å; E162-V188 HydrophobicContact CG-CG1 3.99Å; E162-V188 HydrophobicContact CG-CG2 3.94Å; L165-V188 HydrophobicContact CD1-CB 4.45Å; L165-V188 HydrophobicContact CD1-CG2 3.74Å; L183-V188 HydrophobicContact CB-CG2 4.09Å; L183-V188 HydrophobicContact CD2-CG2 3.75Å; L183-V188 WeakPolarHBondContact O-CG2 3.41Å; L183-V188 PolarHBondContact O-N 3.46Å; S186-V188 PolarHBondContact O-N 3.41Å
189	L	97.4	Very high	97	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.042	21%	0.214	C	C	.	.			trans	-106	128.4	173.2	177.7	58.5	0	0	0	108.1	V118 L165 V173 L180 L183 L184 L191	V118-L189 HydrophobicContact CG2-CD1 3.88Å; L165-L189 HydrophobicContact CD1-CB 3.96Å; L165-L189 HydrophobicContact CD2-CD1 3.86Å; V173-L189 HydrophobicContact CG2-CD1 4.32Å; L180-L189 HydrophobicContact CD2-CD2 4.15Å; L183-L189 HydrophobicContact CB-CB 4.05Å; L183-L189 HydrophobicContact CB-CD2 4.37Å; L183-L189 PolarHBondContact O-N 3.43Å; L184-L189 HydrophobicContact CD2-CB 4.36Å; L184-L189 HydrophobicContact CD2-CD2 4.37Å; L184-L189 HydrophobicContact CD2-CG 4.1Å; L184-L189 WeakPolarHBondContact CD2-O 3.24Å; L184-L189 HydrophobicContact CG-CD2 4.13Å; L184-L189 HydrophobicContact CG-CG 4.35Å; L189-L191 HydrophobicContact CD1-CD2 4.12Å; L189-L191 HydrophobicContact CD2-CD2 4.31Å; L189-L191 HydrophobicContact CG-CD2 4.18Å; L189-L191 HydrophobicContact CG-CG 4.3Å
190	S	96.5	Very high	97	Very high	57 Å²	57	43.5 Å²	43.5	40%	0.399	21%	0.212	S	C	.	.			trans	-109.1	143.7	164.4	167.6	0	0	0	0	109	D192	S190-D192 PolarHBondContact OG-N 2.95Å; S190-D192 PolarHBondContact OG-OD2 3.19Å
191	L	97.5	Very high	96.7	Very high	2 Å²	2	44.2 Å²	44.2	1%	0.01	22%	0.215	C	C	.	.			trans	-123	19.7	177	-64.7	178	0	0	0	111.7	V118 L121 L184 L189 H193 I194 V218 T222 P223	V118-L191 HydrophobicContact CB-CD2 4.38Å; V118-L191 HydrophobicContact CG1-CD2 4.14Å; L121-L191 HydrophobicContact CD1-CD2 4.36Å; L121-L191 HydrophobicContact CD2-CD1 3.78Å; L121-L191 HydrophobicContact CD2-CD2 4.36Å; L184-L191 HydrophobicContact CD1-CD1 3.7Å; L184-L191 HydrophobicContact CD2-CB 4.47Å; L184-L191 HydrophobicContact CD2-CD1 3.73Å; L184-L191 HydrophobicContact CD2-CG 3.78Å; L184-L191 HydrophobicContact CG-CD1 4.17Å; L189-L191 HydrophobicContact CD1-CD2 4.12Å; L189-L191 HydrophobicContact CD2-CD2 4.31Å; L189-L191 HydrophobicContact CG-CD2 4.18Å; L189-L191 HydrophobicContact CG-CG 4.3Å; L191-H193 PolarHBondContact O-N 3.35Å; L191-H193 VanDerWaalsContact O-N 3.09Å; L191-I194 HydrophobicContact CB-CG1 3.71Å; L191-I194 HydrophobicContact CD2-CD1 3.82Å; L191-I194 HydrophobicContact CD2-CG1 3.77Å; L191-I194 HydrophobicContact CG-CG1 4.26Å; L191-I194 WeakPolarHBondContact O-CG1 3.31Å; L191-I194 PolarHBondContact O-N 3.09Å; L191-V218 HydrophobicContact CD1-CG1 4Å; L191-T222 HydrophobicContact CB-CG2 4.08Å; L191-T222 HydrophobicContact CD1-CG2 4Å; L191-P223 WeakPolarHBondContact O-CD 3.29Å
192	D	96.6	Very high	96.5	Very high	108 Å²	108	44 Å²	44	58%	0.578	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-11.8	-173.6	-59.8	-39.6	0	0	0	113.5	S190 P223	S190-D192 PolarHBondContact OG-N 2.95Å; S190-D192 PolarHBondContact OG-OD2 3.19Å; D192-P223 WeakPolarHBondContact O-CG 3.49Å
193	H	97.2	Very high	96.2	Very high	85 Å²	85	42.4 Å²	42.4	39%	0.394	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-118.9	15.6	-178.4	-59.1	-42.5	0	0	0	113.4	H117 V118 L119 L191 K195	H117-H193 HydrophobicContact CB-CB 4.13Å; H117-H193 AromaticContact CD2-CD2 3.21Å; H117-H193 PolarHBondContact CD2-CD2 2.86Å; H117-H193 AromaticContact CD2-NE2 3.71Å; H117-H193 AromaticContact CE1-CD2 3.68Å; H117-H193 AromaticContact CE1-NE2 3.74Å; H117-H193 AromaticContact CG-CD2 3.31Å; H117-H193 AromaticContact ND1-CD2 3.62Å; H117-H193 AromaticContact NE2-CD2 3.46Å; H117-H193 PolarHBondContact NE2-CD2 2.87Å; H117-H193 AromaticContact NE2-NE2 3.46Å; H117-H193 PolarHBondContact NE2-NE2 3.12Å; V118-H193 CarbonylContact O-C 3.27Å; V118-H193 VanDerWaalsContact O-C 3.27Å; L119-H193 HydrophobicContact CD2-CB 4.28Å; L191-H193 PolarHBondContact O-N 3.35Å; L191-H193 VanDerWaalsContact O-N 3.09Å; H193-K195 PolarHBondContact O-N 3.2Å; H193-K195 VanDerWaalsContact O-N 3.16Å
194	I	97.6	Very high	95.8	Very high	2 Å²	2	45.7 Å²	45.7	1%	0.01	21%	0.212	C	C	.	.			trans	-61	120.3	176.2	-71.1	-62.7	0	0	0	110.5	V118 L121 L191 F196 F197 T222 K226	V118-I194 HydrophobicContact CB-CD1 4.27Å; V118-I194 HydrophobicContact CG1-CD1 3.68Å; V118-I194 PolarHBondContact O-N 3.07Å; L121-I194 HydrophobicContact CB-CD1 3.66Å; L121-I194 HydrophobicContact CB-CG1 4.38Å; L191-I194 HydrophobicContact CB-CG1 3.71Å; L191-I194 HydrophobicContact CD2-CD1 3.82Å; L191-I194 HydrophobicContact CD2-CG1 3.77Å; L191-I194 HydrophobicContact CG-CG1 4.26Å; L191-I194 WeakPolarHBondContact O-CG1 3.31Å; L191-I194 PolarHBondContact O-N 3.09Å; I194-F196 WeakPolarHBondContact CG2-O 3.33Å; I194-F197 HydrophobicContact CG2-CB 4.45Å; I194-T222 HydrophobicContact CB-CG2 4.29Å; I194-T222 HydrophobicContact CG1-CG2 4.22Å; I194-T222 HydrophobicContact CG2-CG2 4.32Å; I194-K226 HydrophobicContact CG2-CD 4.05Å
195	K	96.8	Very high	95.7	Very high	98 Å²	98	45.3 Å²	45.3	43%	0.426	21%	0.21	S	C	.	.			trans	-100.4	-28	170.5	-64.1	-177.7	-179.7	175	0	111.9	L119 H193 K226 Q227	L119-K195 PolarHBondContact O-N 2.72Å; H193-K195 PolarHBondContact O-N 3.2Å; H193-K195 VanDerWaalsContact O-N 3.16Å; K195-K226 CarbonylContact O-C 3.58Å; K195-K226 WeakPolarHBondContact O-CA 3.28Å; K195-K226 WeakPolarHBondContact O-CB 3.36Å; K195-Q227 PolarHBondContact O-N 2.64Å
196	F	98.1	Very high	95.7	Very high	10 Å²	10	37.5 Å²	37.5	4%	0.044	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123	-176.6	-47.7	-75.9	0	0	0	111	T107 Q110 M111 L119 C120 L121 I194 Q227 M229	T107-F196 HydrophobicContact CG2-CB 3.79Å; T107-F196 HydrophobicContact CG2-CD1 3.92Å; T107-F196 HydrophobicContact CG2-CD2 4.11Å; T107-F196 HydrophobicContact CG2-CG 3.66Å; Q110-F196 HydrophobicContact CB-CE1 3.99Å; Q110-F196 HydrophobicContact CB-CZ 3.56Å; M111-F196 HydrophobicContact CE-CD2 4.37Å; M111-F196 HydrophobicContact CE-CE2 4.45Å; L119-F196 PolarHBondContact O-N 2.61Å; L119-F196 VanDerWaalsContact O-N 3.09Å; C120-F196 WeakPolarHBondContact CA-O 3.15Å; C120-F196 HydrophobicContact CB-CB 4.15Å; C120-F196 HydrophobicContact CB-CD2 4.13Å; L121-F196 PolarHBondContact N-O 2.85Å; I194-F196 WeakPolarHBondContact CG2-O 3.33Å; F196-Q227 HydrophobicContact CD1-CB 4.13Å; F196-Q227 VanDerWaalsContact CD1-OE1 3.28Å; F196-M229 HydrophobicContact CB-CE 4.47Å; F196-M229 HydrophobicContact CD1-CE 4.31Å
197	F	98.2	Very high	95.6	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	111.6	176.8	-172.8	-80.4	0	0	0	110	L121 M123 I194 L199 V215 V218 F219 T222 K226 Q227 V228 M229	L121-F197 HydrophobicContact CD2-CD2 3.97Å; L121-F197 HydrophobicContact CD2-CE2 3.82Å; M123-F197 HydrophobicContact CE-CE1 3.95Å; M123-F197 HydrophobicContact CE-CE2 3.72Å; M123-F197 HydrophobicContact CE-CZ 3.17Å; I194-F197 HydrophobicContact CG2-CB 4.45Å; F197-L199 HydrophobicContact CD1-CD2 4.39Å; F197-L199 HydrophobicContact CD1-CG 4.44Å; F197-L199 HydrophobicContact CE1-CD1 4.34Å; F197-L199 HydrophobicContact CE1-CD2 3.61Å; F197-L199 HydrophobicContact CE1-CG 3.88Å; F197-L199 HydrophobicContact CZ-CD2 4.18Å; F197-V215 HydrophobicContact CZ-CG1 4.45Å; F197-V218 HydrophobicContact CE2-CG1 4.32Å; F197-F219 AromaticContact CD1-CD2 3.98Å; F197-F219 HydrophobicContact CD1-CD2 3.98Å; F197-F219 HydrophobicContact CD1-CE2 4.37Å; F197-F219 HydrophobicContact CD2-CD2 4.05Å; F197-F219 AromaticContact CE1-CD2 3.75Å; F197-F219 HydrophobicContact CE1-CD2 3.75Å; F197-F219 HydrophobicContact CE1-CE2 4.49Å; F197-F219 HydrophobicContact CE2-CB 4.07Å; F197-F219 AromaticContact CE2-CD2 3.82Å; F197-F219 HydrophobicContact CE2-CD2 3.82Å; F197-F219 HydrophobicContact CE2-CG 4.43Å; F197-F219 HydrophobicContact CG-CD2 4.11Å; F197-F219 HydrophobicContact CG-CE2 4.48Å; F197-F219 HydrophobicContact CZ-CB 3.84Å; F197-F219 AromaticContact CZ-CD2 3.64Å; F197-F219 HydrophobicContact CZ-CD2 3.64Å; F197-F219 HydrophobicContact CZ-CG 4.24Å; F197-T222 HydrophobicContact CD2-CG2 4.13Å; F197-T222 HydrophobicContact CE2-CG2 4.31Å; F197-K226 HydrophobicContact CB-CD 4.03Å; F197-Q227 PolarHBondContact N-O 3Å; F197-V228 HydrophobicContact CB-CG2 4.44Å; F197-V228 HydrophobicContact CD1-CG1 4.32Å; F197-V228 WeakPolarHBondContact O-CA 3.17Å; F197-M229 PolarHBondContact O-N 2.88Å
198	I	98.6	Very high	95.5	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	133.2	-170.7	-58.5	158.1	0	0	0	110.3	F103 T107 L121 V122 M123 M229 F231	F103-I198 HydrophobicContact CB-CD1 3.93Å; F103-I198 HydrophobicContact CB-CG1 4.44Å; F103-I198 HydrophobicContact CB-CG2 4.28Å; F103-I198 HydrophobicContact CD1-CG2 4.02Å; F103-I198 HydrophobicContact CD2-CD1 3.79Å; F103-I198 HydrophobicContact CD2-CG2 4.06Å; F103-I198 HydrophobicContact CE1-CG2 4.28Å; F103-I198 HydrophobicContact CE2-CG2 4.37Å; F103-I198 HydrophobicContact CG-CD1 4.13Å; F103-I198 HydrophobicContact CG-CG2 3.88Å; F103-I198 HydrophobicContact CZ-CG2 4.45Å; T107-I198 HydrophobicContact CG2-CD1 3.74Å; L121-I198 PolarHBondContact O-N 2.67Å; V122-I198 CarbonylContact C-O 3.6Å; V122-I198 WeakPolarHBondContact CA-O 3.12Å; V122-I198 HydrophobicContact CB-CB 4.32Å; V122-I198 HydrophobicContact CG1-CB 4.18Å; V122-I198 HydrophobicContact CG1-CG2 4.09Å; V122-I198 HydrophobicContact CG2-CB 3.95Å; V122-I198 HydrophobicContact CG2-CD1 3.64Å; V122-I198 HydrophobicContact CG2-CG1 4.36Å; V122-I198 HydrophobicContact CG2-CG2 4.48Å; M123-I198 PolarHBondContact N-O 3.12Å; I198-M229 CarbonylContact C-O 3.3Å; I198-M229 VanDerWaalsContact CA-O 3.27Å; I198-M229 WeakPolarHBondContact CA-O 3.37Å; I198-M229 HydrophobicContact CD1-CE 3.9Å; I198-M229 HydrophobicContact CG1-CB 4.25Å; I198-M229 HydrophobicContact CG1-CE 3.73Å; I198-F231 HydrophobicContact CG2-CD2 4.21Å; I198-F231 HydrophobicContact CG2-CE2 4.22Å
199	L	98.1	Very high	95.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	111.5	169.6	-60	-170.4	0	0	0	110.1	M123 F197 C202 M205 L206 V215 M229 M230 F231	M123-L199 HydrophobicContact CB-CD2 3.78Å; M123-L199 HydrophobicContact CE-CD2 3.64Å; M123-L199 WeakPolarHBondContact O-CA 3.46Å; F197-L199 HydrophobicContact CD1-CD2 4.39Å; F197-L199 HydrophobicContact CD1-CG 4.44Å; F197-L199 HydrophobicContact CE1-CD1 4.34Å; F197-L199 HydrophobicContact CE1-CD2 3.61Å; F197-L199 HydrophobicContact CE1-CG 3.88Å; F197-L199 HydrophobicContact CZ-CD2 4.18Å; L199-C202 HydrophobicContact CB-CB 3.67Å; L199-C202 HydrophobicContact CD1-CB 4.31Å; L199-M205 HydrophobicContact CB-CE 3.56Å; L199-M205 HydrophobicContact CD1-CE 4.39Å; L199-M205 HydrophobicContact CD2-CE 3.78Å; L199-M205 HydrophobicContact CD2-SD 4.48Å; L199-M205 HydrophobicContact CG-CE 4.1Å; L199-L206 HydrophobicContact CD1-CD1 4.26Å; L199-L206 HydrophobicContact CD1-CD2 4.16Å; L199-L206 HydrophobicContact CD1-CG 4.33Å; L199-V215 HydrophobicContact CD1-CG1 3.92Å; L199-V215 HydrophobicContact CD2-CG1 4.06Å; L199-M229 PolarHBondContact N-O 3.39Å; L199-M230 HydrophobicContact CB-CG 4.12Å; L199-M230 HydrophobicContact CD1-CE 3.62Å; L199-M230 HydrophobicContact CD1-CG 4.35Å; L199-M230 HydrophobicContact CD1-SD 4.05Å; L199-M230 HydrophobicContact CG-CE 4.28Å; L199-M230 HydrophobicContact CG-CG 4.38Å; L199-M230 WeakPolarHBondContact O-CA 3.35Å; L199-F231 PolarHBondContact O-N 2.86Å
200	D	95.7	Very high	95.2	Very high	7 Å²	7	38.6 Å²	38.6	4%	0.037	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	140.4	171.9	-163.2	17	0	0	0	111.3	F103 M123 C124 I133 C202 M205	F103-D200 HydrophobicContact CE1-CB 4.19Å; F103-D200 HydrophobicContact CZ-CB 4.36Å; M123-D200 PolarHBondContact O-N 3.25Å; C124-D200 HydrophobicContact CB-CB 4.49Å; I133-D200 HydrophobicContact CD1-CB 3.97Å; D200-C202 VanDerWaalsContact C-N 3.28Å; D200-C202 PolarHBondContact O-N 2.93Å; D200-M205 WeakPolarHBondContact O-CE 3.42Å
201	E	91.9	Very high	95.1	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.07	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	50.7	-162.7	-61.8	-159.7	-159.4	0	0	112.1	H125 L129 D203 K204 F231 R364 G365	H125-E201 IonicContact CE1-OE2 3.66Å; H125-E201 PolarHBondContact CE1-OE2 3.49Å; H125-E201 IonicContact ND1-OE2 3.15Å; H125-E201 IonicContact NE2-OE2 3.45Å; L129-E201 HydrophobicContact CD2-CB 4.28Å; L129-E201 HydrophobicContact CD2-CG 3.9Å; E201-D203 PolarHBondContact O-N 2.66Å; E201-D203 VanDerWaalsContact O-N 3.16Å; E201-K204 PolarHBondContact O-N 3.49Å; E201-F231 WeakPolarHBondContact CA-O 3.23Å; E201-F231 PolarHBondContact N-O 2.94Å; E201-R364 WeakPolarHBondContact OE2-CB 3.33Å; E201-R364 IonicContact OE2-NH1 3.87Å; E201-G365 VanDerWaalsContact OE1-CA 3.31Å; E201-G365 WeakPolarHBondContact OE1-CA 3.38Å; E201-G365 PolarHBondContact OE1-N 2.92Å
202	C	93.9	Very high	95	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-63	-21.5	-174.3	67.4	0	0	0	0	113.8	L199 D200 K204 M205 L206 M230 F231	L199-C202 HydrophobicContact CB-CB 3.67Å; L199-C202 HydrophobicContact CD1-CB 4.31Å; D200-C202 VanDerWaalsContact C-N 3.28Å; D200-C202 PolarHBondContact O-N 2.93Å; C202-K204 VanDerWaalsContact C-N 3.32Å; C202-K204 PolarHBondContact O-N 3.17Å; C202-M205 HydrophobicContact CB-CE 4.45Å; C202-M205 PolarHBondContact O-N 3.25Å; C202-L206 HydrophobicContact CB-CD1 4.33Å; C202-L206 VanDerWaalsContact O-CB 3.3Å; C202-L206 WeakPolarHBondContact O-CB 3.37Å; C202-L206 VanDerWaalsContact O-CG 3.29Å; C202-L206 WeakPolarHBondContact O-CG 3.43Å; C202-L206 PolarHBondContact O-N 2.8Å; C202-M230 HydrophobicContact CB-CB 4.32Å; C202-F231 PolarHBondContact N-O 3.2Å; C202-F231 VanDerWaalsContact N-O 3.07Å
203	D	91.7	Very high	95	Very high	17 Å²	17	42.9 Å²	42.9	9%	0.091	21%	0.213	C	C	.	.	H	α-helix	trans	-58.6	-41.9	175.9	63.5	-52.6	0	0	0	112.9	E201 G207 S232 T234 L235 L239 R364	E201-D203 PolarHBondContact O-N 2.66Å; E201-D203 VanDerWaalsContact O-N 3.16Å; D203-G207 WeakPolarHBondContact O-CA 3.48Å; D203-G207 PolarHBondContact O-N 2.86Å; D203-S232 WeakPolarHBondContact CB-OG 3.11Å; D203-S232 WeakPolarHBondContact OD1-CB 3.32Å; D203-S232 PolarHBondContact OD1-OG 3.3Å; D203-T234 WeakPolarHBondContact CB-O 3.31Å; D203-T234 PolarHBondContact OD2-OG1 3.01Å; D203-L235 HydrophobicContact CB-CD2 4.3Å; D203-L239 VanDerWaalsContact CA-CD2 3.46Å; D203-L239 HydrophobicContact CB-CD2 4.01Å; D203-R364 IonicContact OD1-NH1 3.13Å; D203-R364 IonicContact OD2-CZ 3.58Å; D203-R364 IonicContact OD2-NH1 3.54Å; D203-R364 PolarHBondContact OD2-NH1 2.65Å; D203-R364 IonicContact OD2-NH2 3.37Å
204	K	89.8	Confident	95.1	Very high	68 Å²	68	41 Å²	41	30%	0.296	21%	0.206	S	C	.	.	H	α-helix	trans	-74.4	-42	177.8	-74.5	-69.9	174.8	-173.1	0	112.4	H125 E201 C202 D208 R364	H125-K204 HydrophobicContact CB-CB 4.13Å; E201-K204 PolarHBondContact O-N 3.49Å; C202-K204 VanDerWaalsContact C-N 3.32Å; C202-K204 PolarHBondContact O-N 3.17Å; K204-D208 WeakPolarHBondContact O-CB 3.32Å; K204-D208 PolarHBondContact O-N 3.39Å; K204-R364 VanDerWaalsContact CE-NE 3.27Å; K204-R364 VanDerWaalsContact CE-NH1 3.27Å
205	M	94.1	Very high	95.1	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-66.1	-39	179.5	-68.3	-170.4	-69.6	0	0	112.4	M123 C124 H125 P177 L199 D200 C202 M211 R212 V215	M123-M205 HydrophobicContact CB-SD 4.04Å; M123-M205 WeakPolarHBondContact O-CE 3.5Å; C124-M205 VanDerWaalsContact C-SD 3.5Å; C124-M205 WeakPolarHBondContact CA-SD 3.36Å; H125-M205 HydrophobicContact CB-CG 3.72Å; P177-M205 HydrophobicContact CG-CG 4.49Å; P177-M205 HydrophobicContact CG-SD 3.9Å; L199-M205 HydrophobicContact CB-CE 3.56Å; L199-M205 HydrophobicContact CD1-CE 4.39Å; L199-M205 HydrophobicContact CD2-CE 3.78Å; L199-M205 HydrophobicContact CD2-SD 4.48Å; L199-M205 HydrophobicContact CG-CE 4.1Å; D200-M205 WeakPolarHBondContact O-CE 3.42Å; C202-M205 HydrophobicContact CB-CE 4.45Å; C202-M205 PolarHBondContact O-N 3.25Å; M205-M211 CarbonylContact O-C 3.55Å; M205-R212 VanDerWaalsContact O-CA 3.31Å; M205-R212 WeakPolarHBondContact O-CA 3.42Å; M205-R212 PolarHBondContact O-N 3.29Å; M205-V215 HydrophobicContact CB-CG2 4.2Å; M205-V215 HydrophobicContact SD-CG2 4.22Å
206	L	95.2	Very high	95.1	Very high	2 Å²	2	39 Å²	39	1%	0.01	20%	0.198	C	C	.	.	H	α-helix	trans	-91.2	-21.1	-176.8	-58.4	179.5	0	0	0	113.1	L199 C202 R212 V215 M230 L239 V242 F246	L199-L206 HydrophobicContact CD1-CD1 4.26Å; L199-L206 HydrophobicContact CD1-CD2 4.16Å; L199-L206 HydrophobicContact CD1-CG 4.33Å; C202-L206 HydrophobicContact CB-CD1 4.33Å; C202-L206 VanDerWaalsContact O-CB 3.3Å; C202-L206 WeakPolarHBondContact O-CB 3.37Å; C202-L206 VanDerWaalsContact O-CG 3.29Å; C202-L206 WeakPolarHBondContact O-CG 3.43Å; C202-L206 PolarHBondContact O-N 2.8Å; L206-R212 HydrophobicContact CD2-CG 4.33Å; L206-R212 WeakPolarHBondContact O-CD 3.02Å; L206-V215 HydrophobicContact CD2-CG1 4.12Å; L206-M230 HydrophobicContact CD1-SD 4.08Å; L206-L239 HydrophobicContact CB-CD1 3.73Å; L206-L239 HydrophobicContact CB-CD2 4.28Å; L206-L239 HydrophobicContact CB-CG 4.38Å; L206-V242 HydrophobicContact CB-CG1 4.47Å; L206-V242 HydrophobicContact CD1-CG1 4.43Å; L206-F246 HydrophobicContact CD1-CE2 4.41Å; L206-F246 HydrophobicContact CD2-CE2 3.78Å; L206-F246 HydrophobicContact CD2-CZ 3.87Å
207	G	92.2	Very high	95.1	Very high	53 Å²	53	41.1 Å²	41.1	55%	0.546	21%	0.21	S	C	.	.	H	α-helix	trans	-77.9	-32.1	174.6	0	0	0	0	0	113.4	D203	D203-G207 WeakPolarHBondContact O-CA 3.48Å; D203-G207 PolarHBondContact O-N 2.86Å
208	D	92.7	Very high	95.1	Very high	70 Å²	70	41.1 Å²	41.1	37%	0.374	21%	0.21	S	C	.	.	S	Bend	trans	-82.5	125.1	172.5	-176.8	-72.4	0	0	0	110.5	K204 D210 M211 R212	K204-D208 WeakPolarHBondContact O-CB 3.32Å; K204-D208 PolarHBondContact O-N 3.39Å; D208-D210 PolarHBondContact O-N 2.94Å; D208-D210 PolarHBondContact OD1-N 2.62Å; D208-M211 HydrophobicContact CB-CB 4.14Å; D208-M211 HydrophobicContact CB-CE 3.42Å; D208-M211 VanDerWaalsContact CB-CE 3.42Å; D208-M211 HydrophobicContact CB-CG 4.42Å; D208-M211 PolarHBondContact OD1-N 3.19Å; D208-R212 WeakPolarHBondContact O-CB 3.47Å; D208-R212 PolarHBondContact O-N 3.28Å
209	L	92.2	Very high	95.1	Very high	115 Å²	115	43.1 Å²	43.1	60%	0.602	22%	0.219	S	C	*	.	H	α-helix	trans	-65.6	-35.6	-173.1	-72.2	174.9	0	0	0	113.5	R213	L209-R213 WeakPolarHBondContact O-CD 3.36Å; L209-R213 VanDerWaalsContact O-CG 3.25Å; L209-R213 WeakPolarHBondContact O-CG 3.4Å; L209-R213 PolarHBondContact O-N 2.81Å; L209-R213 VanDerWaalsContact O-N 3.16Å
210	D	93.7	Very high	95	Very high	102 Å²	102	50.3 Å²	50.3	55%	0.545	25%	0.25	S	C	.	.	H	α-helix	trans	-77.9	-45.3	-177.3	-70.8	-28.5	0	0	0	110.1	D208 R212 R213 D214	D208-D210 PolarHBondContact O-N 2.94Å; D208-D210 PolarHBondContact OD1-N 2.62Å; D210-R212 VanDerWaalsContact C-N 3.28Å; D210-R212 PolarHBondContact O-N 3.45Å; D210-R213 WeakPolarHBondContact O-CB 3.46Å; D210-R213 PolarHBondContact O-N 3.37Å; D210-R213 IonicContact OD1-NH1 2.66Å; D210-R213 PolarHBondContact OD1-NH1 3.02Å; D210-R213 VanDerWaalsContact OD1-NH1 3.15Å; D210-D214 PolarHBondContact O-N 3.29Å; D210-D214 VanDerWaalsContact O-N 3.14Å
211	M	94.4	Very high	95	Very high	52 Å²	52	53.9 Å²	53.9	26%	0.256	27%	0.267	S	S	.	.	H	α-helix	trans	-61.5	-37.8	172.8	-71.3	-169.4	-83.9	0	0	112	H125 M205 D208 R213 D214 V215	H125-M211 HydrophobicContact CB-SD 4.11Å; M205-M211 CarbonylContact O-C 3.55Å; D208-M211 HydrophobicContact CB-CB 4.14Å; D208-M211 HydrophobicContact CB-CE 3.42Å; D208-M211 VanDerWaalsContact CB-CE 3.42Å; D208-M211 HydrophobicContact CB-CG 4.42Å; D208-M211 PolarHBondContact OD1-N 3.19Å; M211-R213 VanDerWaalsContact C-N 3.34Å; M211-R213 PolarHBondContact O-N 3.07Å; M211-D214 PolarHBondContact O-N 2.89Å; M211-V215 WeakPolarHBondContact O-CG2 3.36Å; M211-V215 PolarHBondContact O-N 2.89Å
212	R	96.6	Very high	95.2	Very high	59 Å²	59	53.9 Å²	53.9	22%	0.223	27%	0.268	C	S	.	.	H	α-helix	trans	-62.3	-42	177.3	178.3	-179.3	175	172	-0.5	111.6	M205 L206 D208 D210 D214 V215 Q216 V242	M205-R212 VanDerWaalsContact O-CA 3.31Å; M205-R212 WeakPolarHBondContact O-CA 3.42Å; M205-R212 PolarHBondContact O-N 3.29Å; L206-R212 HydrophobicContact CD2-CG 4.33Å; L206-R212 WeakPolarHBondContact O-CD 3.02Å; D208-R212 WeakPolarHBondContact O-CB 3.47Å; D208-R212 PolarHBondContact O-N 3.28Å; D210-R212 VanDerWaalsContact C-N 3.28Å; D210-R212 PolarHBondContact O-N 3.45Å; R212-D214 VanDerWaalsContact C-N 3.32Å; R212-V215 PolarHBondContact O-N 3.35Å; R212-Q216 HydrophobicContact CG-CG 4.38Å; R212-Q216 WeakPolarHBondContact O-CB 3.06Å; R212-Q216 VanDerWaalsContact O-CG 3.24Å; R212-Q216 WeakPolarHBondContact O-CG 3.42Å; R212-Q216 PolarHBondContact O-N 3.42Å; R212-V242 VanDerWaalsContact CZ-CG1 3.48Å
213	R	97.2	Very high	95.3	Very high	145 Å²	145	55.8 Å²	55.8	55%	0.547	28%	0.281	S	S	.	.	H	α-helix	trans	-60.6	-45.6	176.4	-74.7	165.2	179.8	170.9	-3.4	110.4	L209 D210 M211 V215 Q216 D217	L209-R213 WeakPolarHBondContact O-CD 3.36Å; L209-R213 VanDerWaalsContact O-CG 3.25Å; L209-R213 WeakPolarHBondContact O-CG 3.4Å; L209-R213 PolarHBondContact O-N 2.81Å; L209-R213 VanDerWaalsContact O-N 3.16Å; D210-R213 WeakPolarHBondContact O-CB 3.46Å; D210-R213 PolarHBondContact O-N 3.37Å; D210-R213 IonicContact OD1-NH1 2.66Å; D210-R213 PolarHBondContact OD1-NH1 3.02Å; D210-R213 VanDerWaalsContact OD1-NH1 3.15Å; M211-R213 VanDerWaalsContact C-N 3.34Å; M211-R213 PolarHBondContact O-N 3.07Å; R213-V215 PolarHBondContact O-N 2.7Å; R213-Q216 PolarHBondContact O-N 3.05Å; R213-D217 PolarHBondContact O-N 3Å
214	D	98	Very high	95.3	Very high	46 Å²	46	65 Å²	65	25%	0.246	31%	0.314	C	S	.	.	H	α-helix	trans	-60.3	-46.4	177.5	-72.2	-8.7	0	0	0	111.5	P177 G178 L181 D210 M211 R212 Q216 D217 V218	P177-D214 HydrophobicContact CB-CB 3.67Å; G178-D214 WeakPolarHBondContact CA-OD2 3.39Å; L181-D214 HydrophobicContact CD2-CB 4.05Å; L181-D214 VanDerWaalsContact CD2-OD1 3.29Å; L181-D214 WeakPolarHBondContact CD2-OD1 3.26Å; D210-D214 PolarHBondContact O-N 3.29Å; D210-D214 VanDerWaalsContact O-N 3.14Å; M211-D214 PolarHBondContact O-N 2.89Å; R212-D214 VanDerWaalsContact C-N 3.32Å; D214-Q216 VanDerWaalsContact C-N 3.33Å; D214-Q216 PolarHBondContact O-N 3.38Å; D214-D217 PolarHBondContact O-N 3.1Å; D214-V218 VanDerWaalsContact O-CG2 3.26Å; D214-V218 WeakPolarHBondContact O-CG2 3.43Å; D214-V218 PolarHBondContact O-N 3.05Å
215	V	98.2	Very high	95.4	Very high	0 Å²	0	70.1 Å²	70.1	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-59.8	-42.6	176.2	169.6	0	0	0	0	111.7	M123 P177 F197 L199 M205 L206 M211 R212 R213 F219 F246	M123-V215 HydrophobicContact CE-CB 4.23Å; M123-V215 HydrophobicContact CE-CG1 3.85Å; M123-V215 HydrophobicContact CE-CG2 4.06Å; P177-V215 HydrophobicContact CB-CG2 3.93Å; P177-V215 HydrophobicContact CG-CG2 3.57Å; F197-V215 HydrophobicContact CZ-CG1 4.45Å; L199-V215 HydrophobicContact CD1-CG1 3.92Å; L199-V215 HydrophobicContact CD2-CG1 4.06Å; M205-V215 HydrophobicContact CB-CG2 4.2Å; M205-V215 HydrophobicContact SD-CG2 4.22Å; L206-V215 HydrophobicContact CD2-CG1 4.12Å; M211-V215 WeakPolarHBondContact O-CG2 3.36Å; M211-V215 PolarHBondContact O-N 2.89Å; R212-V215 PolarHBondContact O-N 3.35Å; R213-V215 PolarHBondContact O-N 2.7Å; V215-F219 VanDerWaalsContact O-CB 3.32Å; V215-F219 WeakPolarHBondContact O-CB 3.31Å; V215-F219 PolarHBondContact O-N 2.85Å; V215-F246 HydrophobicContact CG1-CE1 3.9Å; V215-F246 HydrophobicContact CG1-CZ 3.93Å
216	Q	97.3	Very high	95.4	Very high	59 Å²	59	71.1 Å²	71.1	28%	0.276	34%	0.343	S	S	.	.	H	α-helix	trans	-66.7	-39.8	178.7	-75.2	177.6	-21.5	0	0	112.4	R212 R213 D214 F219 K220 F246	R212-Q216 HydrophobicContact CG-CG 4.38Å; R212-Q216 WeakPolarHBondContact O-CB 3.06Å; R212-Q216 VanDerWaalsContact O-CG 3.24Å; R212-Q216 WeakPolarHBondContact O-CG 3.42Å; R212-Q216 PolarHBondContact O-N 3.42Å; R213-Q216 PolarHBondContact O-N 3.05Å; D214-Q216 VanDerWaalsContact C-N 3.33Å; D214-Q216 PolarHBondContact O-N 3.38Å; Q216-F219 PolarHBondContact O-N 3.19Å; Q216-K220 VanDerWaalsContact O-CG 3.27Å; Q216-K220 WeakPolarHBondContact O-CG 3.25Å; Q216-K220 PolarHBondContact O-N 3.33Å; Q216-K220 VanDerWaalsContact O-N 3.07Å; Q216-F246 HydrophobicContact CG-CE1 4.28Å; Q216-F246 HydrophobicContact CG-CZ 3.7Å
217	D	97.9	Very high	95.4	Very high	53 Å²	53	71.6 Å²	71.6	28%	0.283	35%	0.346	S	S	.	.	H	α-helix	trans	-66.3	-45.1	176.8	-79.1	-3.3	0	0	0	110.9	L181 R185 R213 D214 F219 K220 M221	L181-D217 HydrophobicContact CD1-CB 3.88Å; L181-D217 HydrophobicContact CD2-CB 4.26Å; R185-D217 IonicContact NH2-OD2 2.77Å; R185-D217 PolarHBondContact NH2-OD2 3.48Å; R213-D217 PolarHBondContact O-N 3Å; D214-D217 PolarHBondContact O-N 3.1Å; D217-F219 VanDerWaalsContact C-N 3.34Å; D217-F219 PolarHBondContact O-N 3.21Å; D217-K220 PolarHBondContact O-N 2.89Å; D217-K220 IonicContact OD1-NZ 3.39Å; D217-M221 WeakPolarHBondContact O-CG 3.47Å; D217-M221 PolarHBondContact O-N 3.45Å
218	V	98.3	Very high	95.7	Very high	0 Å²	0	69.2 Å²	69.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-58.4	-46.7	173.2	174.5	0	0	0	0	110.7	L121 M123 L181 L184 L191 F197 D214 K220 M221	L121-V218 HydrophobicContact CD2-CG1 3.57Å; M123-V218 HydrophobicContact CE-CB 4.22Å; M123-V218 HydrophobicContact CE-CG1 3.98Å; M123-V218 HydrophobicContact SD-CB 4.17Å; M123-V218 HydrophobicContact SD-CG1 3.85Å; M123-V218 HydrophobicContact SD-CG2 4.25Å; L181-V218 HydrophobicContact CB-CG2 3.98Å; L181-V218 HydrophobicContact CD1-CG2 4.16Å; L184-V218 HydrophobicContact CD1-CB 4.27Å; L184-V218 HydrophobicContact CD1-CG1 4Å; L184-V218 HydrophobicContact CD1-CG2 3.91Å; L191-V218 HydrophobicContact CD1-CG1 4Å; F197-V218 HydrophobicContact CE2-CG1 4.32Å; D214-V218 VanDerWaalsContact O-CG2 3.26Å; D214-V218 WeakPolarHBondContact O-CG2 3.43Å; D214-V218 PolarHBondContact O-N 3.05Å; V218-K220 VanDerWaalsContact C-N 3.33Å; V218-K220 PolarHBondContact O-N 2.86Å; V218-M221 WeakPolarHBondContact O-CB 3.01Å; V218-M221 PolarHBondContact O-N 2.85Å
219	F	97.3	Very high	95.9	Very high	43 Å²	43	65.9 Å²	65.9	19%	0.189	30%	0.303	C	S	.	.	H	α-helix	trans	-59.6	-40.3	-179.6	-177	-95.2	0	0	0	112.9	F197 V215 Q216 D217 M221 T222 K226 V228 F246	F197-F219 AromaticContact CD1-CD2 3.98Å; F197-F219 HydrophobicContact CD1-CD2 3.98Å; F197-F219 HydrophobicContact CD1-CE2 4.37Å; F197-F219 HydrophobicContact CD2-CD2 4.05Å; F197-F219 AromaticContact CE1-CD2 3.75Å; F197-F219 HydrophobicContact CE1-CD2 3.75Å; F197-F219 HydrophobicContact CE1-CE2 4.49Å; F197-F219 HydrophobicContact CE2-CB 4.07Å; F197-F219 AromaticContact CE2-CD2 3.82Å; F197-F219 HydrophobicContact CE2-CD2 3.82Å; F197-F219 HydrophobicContact CE2-CG 4.43Å; F197-F219 HydrophobicContact CG-CD2 4.11Å; F197-F219 HydrophobicContact CG-CE2 4.48Å; F197-F219 HydrophobicContact CZ-CB 3.84Å; F197-F219 AromaticContact CZ-CD2 3.64Å; F197-F219 HydrophobicContact CZ-CD2 3.64Å; F197-F219 HydrophobicContact CZ-CG 4.24Å; V215-F219 VanDerWaalsContact O-CB 3.32Å; V215-F219 WeakPolarHBondContact O-CB 3.31Å; V215-F219 PolarHBondContact O-N 2.85Å; Q216-F219 PolarHBondContact O-N 3.19Å; D217-F219 VanDerWaalsContact C-N 3.34Å; D217-F219 PolarHBondContact O-N 3.21Å; F219-M221 PolarHBondContact O-N 3.44Å; F219-T222 PolarHBondContact O-N 3.19Å; F219-T222 VanDerWaalsContact O-N 3.13Å; F219-T222 PolarHBondContact O-OG1 3.42Å; F219-K226 VanDerWaalsContact CZ-NZ 3.34Å; F219-V228 HydrophobicContact CE2-CG2 3.99Å; F219-F246 HydrophobicContact CB-CD1 4.13Å; F219-F246 HydrophobicContact CB-CE1 3.89Å; F219-F246 AromaticContact CD1-CD1 3.99Å; F219-F246 HydrophobicContact CD1-CD1 3.99Å; F219-F246 HydrophobicContact CD1-CE1 4.37Å; F219-F246 AromaticContact CD2-CD1 3.56Å; F219-F246 HydrophobicContact CD2-CD1 3.56Å; F219-F246 HydrophobicContact CD2-CE1 4.18Å; F219-F246 HydrophobicContact CE1-CD1 4.27Å; F219-F246 HydrophobicContact CE2-CB 4.23Å; F219-F246 AromaticContact CE2-CD1 3.83Å; F219-F246 HydrophobicContact CE2-CD1 3.83Å; F219-F246 AromaticContact CG-CD1 3.63Å; F219-F246 HydrophobicContact CG-CD1 3.63Å; F219-F246 AromaticContact CG-CE1 3.9Å; F219-F246 HydrophobicContact CG-CE1 3.9Å; F219-F246 HydrophobicContact CZ-CB 4.31Å; F219-F246 HydrophobicContact CZ-CD1 4.19Å; F219-F246 WeakPolarHBondContact CZ-O 3.45Å
220	K	95.8	Very high	96.1	Very high	150 Å²	150	60.4 Å²	60.4	65%	0.652	27%	0.274	S	S	*	.	H	α-helix	trans	-65.4	-19.4	177.3	-70.7	166.3	-168.1	163.8	0	113.5	Q216 D217 V218 T222	Q216-K220 VanDerWaalsContact O-CG 3.27Å; Q216-K220 WeakPolarHBondContact O-CG 3.25Å; Q216-K220 PolarHBondContact O-N 3.33Å; Q216-K220 VanDerWaalsContact O-N 3.07Å; D217-K220 PolarHBondContact O-N 2.89Å; D217-K220 IonicContact OD1-NZ 3.39Å; V218-K220 VanDerWaalsContact C-N 3.33Å; V218-K220 PolarHBondContact O-N 2.86Å; K220-T222 VanDerWaalsContact C-N 3.32Å
221	M	96.9	Very high	96.2	Very high	82 Å²	82	55.5 Å²	55.5	40%	0.404	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.1	6.9	177.6	-59.6	177.2	81.2	0	0	112.8	L184 D217 V218 F219	L184-M221 HydrophobicContact CB-CE 3.96Å; L184-M221 HydrophobicContact CB-SD 4.05Å; L184-M221 HydrophobicContact CD1-SD 3.99Å; L184-M221 HydrophobicContact CD2-CE 4.24Å; L184-M221 HydrophobicContact CG-SD 4.43Å; D217-M221 WeakPolarHBondContact O-CG 3.47Å; D217-M221 PolarHBondContact O-N 3.45Å; V218-M221 WeakPolarHBondContact O-CB 3.01Å; V218-M221 PolarHBondContact O-N 2.85Å; F219-M221 PolarHBondContact O-N 3.44Å
222	T	96.9	Very high	96	Very high	15 Å²	15	53 Å²	53	9%	0.092	24%	0.236	C	C	.	.	S	Bend	trans	-106.7	159.2	174.8	66.2	0	0	0	0	110.9	L191 I194 F197 F219 K220 K226	L191-T222 HydrophobicContact CB-CG2 4.08Å; L191-T222 HydrophobicContact CD1-CG2 4Å; I194-T222 HydrophobicContact CB-CG2 4.29Å; I194-T222 HydrophobicContact CG1-CG2 4.22Å; I194-T222 HydrophobicContact CG2-CG2 4.32Å; F197-T222 HydrophobicContact CD2-CG2 4.13Å; F197-T222 HydrophobicContact CE2-CG2 4.31Å; F219-T222 PolarHBondContact O-N 3.19Å; F219-T222 VanDerWaalsContact O-N 3.13Å; F219-T222 PolarHBondContact O-OG1 3.42Å; K220-T222 VanDerWaalsContact C-N 3.32Å; T222-K226 WeakPolarHBondContact OG1-CD 3.16Å; T222-K226 WeakPolarHBondContact OG1-CE 3.16Å; T222-K226 PolarHBondContact OG1-NZ 3.31Å
223	P	95.3	Very high	95.4	Very high	40 Å²	40	50.5 Å²	50.5	26%	0.26	23%	0.228	S	C	.	.			trans	-52.5	152.8	173.9	-29.5	37.2	0	0	0	112.8	L191 D192 K226	L191-P223 WeakPolarHBondContact O-CD 3.29Å; D192-P223 WeakPolarHBondContact O-CG 3.49Å; P223-K226 WeakPolarHBondContact O-CD 3.48Å; P223-K226 PolarHBondContact O-NZ 3.19Å
224	R	91.1	Very high	94.6	Very high	210 Å²	210	44.3 Å²	44.3	79%	0.792	21%	0.206	S	C	*	.	S	Bend	trans	-65.6	-51.3	175.9	-71.9	-173.1	178.5	-174.9	0.7	111.1	K226	R224-K226 PolarHBondContact O-N 3.22Å
225	E	91.7	Very high	94.1	Very high	176 Å²	176	42.2 Å²	42.2	82%	0.822	20%	0.195	S	C	*	.	S	Bend	trans	-79.1	111.2	177.8	-173.3	177.8	-178.3	0	0	109.9
226	K	94.6	Very high	93.4	Very high	21 Å²	21	45.1 Å²	45.1	9%	0.091	22%	0.215	C	C	.	.			trans	-167.3	152.7	176.5	57.2	-176	-176.2	-76.4	0	108.9	I194 K195 F197 F219 T222 P223 R224 V228	I194-K226 HydrophobicContact CG2-CD 4.05Å; K195-K226 CarbonylContact O-C 3.58Å; K195-K226 WeakPolarHBondContact O-CA 3.28Å; K195-K226 WeakPolarHBondContact O-CB 3.36Å; F197-K226 HydrophobicContact CB-CD 4.03Å; F219-K226 VanDerWaalsContact CZ-NZ 3.34Å; T222-K226 WeakPolarHBondContact OG1-CD 3.16Å; T222-K226 WeakPolarHBondContact OG1-CE 3.16Å; T222-K226 PolarHBondContact OG1-NZ 3.31Å; P223-K226 WeakPolarHBondContact O-CD 3.48Å; P223-K226 PolarHBondContact O-NZ 3.19Å; R224-K226 PolarHBondContact O-N 3.22Å; K226-V228 HydrophobicContact CG-CG2 4.32Å
227	Q	95.8	Very high	92.9	Very high	12 Å²	12	49.5 Å²	49.5	6%	0.056	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	130.1	170.6	-173.2	-176.9	23.2	0	0	109.7	T83 A87 D88 K195 F196 F197 M229	T83-Q227 PolarHBondContact O-NE2 3.47Å; A87-Q227 PolarHBondContact O-NE2 3.41Å; D88-Q227 WeakPolarHBondContact OD1-CA 3.33Å; K195-Q227 PolarHBondContact O-N 2.64Å; F196-Q227 HydrophobicContact CD1-CB 4.13Å; F196-Q227 VanDerWaalsContact CD1-OE1 3.28Å; F197-Q227 PolarHBondContact N-O 3Å; Q227-M229 HydrophobicContact CG-CE 4.36Å; Q227-M229 HydrophobicContact CG-CG 4.15Å
228	V	97.1	Very high	92.5	Very high	3 Å²	3	53.8 Å²	53.8	2%	0.018	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	125.5	177.4	-176.5	0	0	0	0	109.7	D88 I89 F197 F219 K226 M230 F246 M247	D88-V228 VanDerWaalsContact CA-O 3.28Å; D88-V228 WeakPolarHBondContact CA-O 3.36Å; D88-V228 PolarHBondContact OD1-N 3.08Å; I89-V228 PolarHBondContact N-O 2.7Å; F197-V228 HydrophobicContact CB-CG2 4.44Å; F197-V228 HydrophobicContact CD1-CG1 4.32Å; F197-V228 WeakPolarHBondContact O-CA 3.17Å; F219-V228 HydrophobicContact CE2-CG2 3.99Å; K226-V228 HydrophobicContact CG-CG2 4.32Å; V228-M230 HydrophobicContact CG1-CE 3.86Å; V228-M230 HydrophobicContact CG1-CG 4.45Å; V228-F246 HydrophobicContact CG1-CB 4.27Å; V228-M247 HydrophobicContact CB-CE 4.34Å; V228-M247 HydrophobicContact CB-CG 3.91Å; V228-M247 HydrophobicContact CG1-CE 3.87Å; V228-M247 HydrophobicContact CG1-CG 3.97Å
229	M	97.6	Very high	92.1	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	132.7	178.7	-56.9	176.9	-93.3	0	0	110.6	T83 I89 F103 T107 F196 F197 I198 L199 Q227 F231	T83-M229 HydrophobicContact CG2-SD 3.81Å; I89-M229 HydrophobicContact CB-CB 4.33Å; I89-M229 HydrophobicContact CB-CG 4.13Å; I89-M229 HydrophobicContact CG1-CG 4.42Å; I89-M229 CarbonylContact O-C 3.56Å; I89-M229 WeakPolarHBondContact O-CA 3.27Å; F103-M229 HydrophobicContact CB-SD 4.33Å; T107-M229 HydrophobicContact CG2-CE 3.73Å; F196-M229 HydrophobicContact CB-CE 4.47Å; F196-M229 HydrophobicContact CD1-CE 4.31Å; F197-M229 PolarHBondContact O-N 2.88Å; I198-M229 CarbonylContact C-O 3.3Å; I198-M229 VanDerWaalsContact CA-O 3.27Å; I198-M229 WeakPolarHBondContact CA-O 3.37Å; I198-M229 HydrophobicContact CD1-CE 3.9Å; I198-M229 HydrophobicContact CG1-CB 4.25Å; I198-M229 HydrophobicContact CG1-CE 3.73Å; L199-M229 PolarHBondContact N-O 3.39Å; Q227-M229 HydrophobicContact CG-CE 4.36Å; Q227-M229 HydrophobicContact CG-CG 4.15Å; M229-F231 HydrophobicContact CB-CD2 4.5Å; M229-F231 HydrophobicContact CB-CE2 3.59Å; M229-F231 HydrophobicContact CB-CZ 4.16Å
230	M	97.1	Very high	91.8	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	128.7	-177.7	-63.3	-165.4	-178	0	0	110.8	I89 C91 L199 C202 L206 V228 C243 F246 M247	I89-M230 PolarHBondContact O-N 2.72Å; C91-M230 PolarHBondContact N-O 3.08Å; L199-M230 HydrophobicContact CB-CG 4.12Å; L199-M230 HydrophobicContact CD1-CE 3.62Å; L199-M230 HydrophobicContact CD1-CG 4.35Å; L199-M230 HydrophobicContact CD1-SD 4.05Å; L199-M230 HydrophobicContact CG-CE 4.28Å; L199-M230 HydrophobicContact CG-CG 4.38Å; L199-M230 WeakPolarHBondContact O-CA 3.35Å; C202-M230 HydrophobicContact CB-CB 4.32Å; L206-M230 HydrophobicContact CD1-SD 4.08Å; V228-M230 HydrophobicContact CG1-CE 3.86Å; V228-M230 HydrophobicContact CG1-CG 4.45Å; M230-C243 HydrophobicContact SD-CB 3.57Å; M230-C243 VanDerWaalsContact SD-CB 3.57Å; M230-F246 HydrophobicContact CE-CB 3.38Å; M230-F246 HydrophobicContact CE-CD1 4.21Å; M230-F246 HydrophobicContact CE-CD2 3.72Å; M230-F246 HydrophobicContact CE-CG 3.53Å; M230-M247 HydrophobicContact CB-CE 4.18Å; M230-M247 HydrophobicContact CE-CE 4.47Å; M230-M247 HydrophobicContact CG-CE 3.75Å; M230-M247 HydrophobicContact SD-CE 4.23Å
231	F	95.2	Very high	91.5	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	136.6	-176	-61	-90.9	0	0	0	110.4	I89 C91 K99 V102 F103 I198 L199 E201 C202 M229	I89-F231 HydrophobicContact CG2-CE1 4.38Å; I89-F231 HydrophobicContact CG2-CZ 4.3Å; C91-F231 HydrophobicContact CB-CD1 3.44Å; C91-F231 VanDerWaalsContact CB-CD1 3.44Å; C91-F231 HydrophobicContact CB-CE1 3.62Å; C91-F231 HydrophobicContact CB-CG 4.37Å; C91-F231 WeakPolarHBondContact O-CA 3.45Å; K99-F231 HydrophobicContact CB-CD1 4.08Å; K99-F231 HydrophobicContact CD-CB 4.24Å; K99-F231 HydrophobicContact CD-CD1 4.34Å; K99-F231 HydrophobicContact CG-CD1 4.42Å; V102-F231 HydrophobicContact CB-CE1 4.22Å; V102-F231 HydrophobicContact CB-CZ 4.45Å; V102-F231 HydrophobicContact CG1-CE1 4.02Å; V102-F231 HydrophobicContact CG1-CZ 4.07Å; F103-F231 HydrophobicContact CB-CE2 3.69Å; F103-F231 HydrophobicContact CB-CZ 3.96Å; F103-F231 AromaticContact CD1-CD2 3.62Å; F103-F231 HydrophobicContact CD1-CD2 3.62Å; F103-F231 AromaticContact CD1-CE2 3.5Å; F103-F231 HydrophobicContact CD1-CE2 3.5Å; F103-F231 HydrophobicContact CD1-CG 4.25Å; F103-F231 HydrophobicContact CD1-CZ 4.06Å; F103-F231 HydrophobicContact CE1-CD2 4.2Å; F103-F231 HydrophobicContact CE1-CE2 4.49Å; F103-F231 HydrophobicContact CG-CD2 4.49Å; F103-F231 HydrophobicContact CG-CE2 4.01Å; I198-F231 HydrophobicContact CG2-CD2 4.21Å; I198-F231 HydrophobicContact CG2-CE2 4.22Å; L199-F231 PolarHBondContact O-N 2.86Å; E201-F231 WeakPolarHBondContact CA-O 3.23Å; E201-F231 PolarHBondContact N-O 2.94Å; C202-F231 PolarHBondContact N-O 3.2Å; C202-F231 VanDerWaalsContact N-O 3.07Å; M229-F231 HydrophobicContact CB-CD2 4.5Å; M229-F231 HydrophobicContact CB-CE2 3.59Å; M229-F231 HydrophobicContact CB-CZ 4.16Å
232	S	91.1	Very high	91.3	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.6	163	169	178.4	0	0	0	0	111.2	C91 Q92 A93 D203 T234	C91-S232 PolarHBondContact O-N 2.96Å; C91-S232 VanDerWaalsContact O-N 3.07Å; Q92-S232 WeakPolarHBondContact CA-O 3.2Å; A93-S232 PolarHBondContact N-O 3.13Å; A93-S232 VanDerWaalsContact N-O 3.12Å; D203-S232 WeakPolarHBondContact CB-OG 3.11Å; D203-S232 WeakPolarHBondContact OD1-CB 3.32Å; D203-S232 PolarHBondContact OD1-OG 3.3Å; S232-T234 PolarHBondContact OG-N 2.86Å; S232-T234 VanDerWaalsContact OG-N 3.09Å; S232-T234 PolarHBondContact OG-O 3.49Å
233	A	83.5	Confident	91.1	Very high	6 Å²	6	47.1 Å²	47.1	5%	0.05	23%	0.231	C	C	.	.	S	Bend	trans	-83.2	-27.1	167.7	0	0	0	0	0	112.6	Q92 A93	Q92-A233 PolarHBondContact NE2-O 2.88Å; A93-A233 VanDerWaalsContact O-CA 3.24Å; A93-A233 WeakPolarHBondContact O-CA 3.41Å
234	T	81.3	Confident	90.9	Very high	15 Å²	15	48.3 Å²	48.3	9%	0.092	23%	0.233	C	C	.	.			trans	-134	107.1	-171.6	49.2	0	0	0	0	109.3	D203 S232 L387	D203-T234 WeakPolarHBondContact CB-O 3.31Å; D203-T234 PolarHBondContact OD2-OG1 3.01Å; S232-T234 PolarHBondContact OG-N 2.86Å; S232-T234 VanDerWaalsContact OG-N 3.09Å; S232-T234 PolarHBondContact OG-O 3.49Å; T234-L387 HydrophobicContact CG2-CD2 4.25Å
235	L	85.9	Confident	90.9	Very high	2 Å²	2	45 Å²	45	1%	0.01	22%	0.224	C	C	.	.			trans	-120.5	103.6	175.1	-75.3	174.9	0	0	0	110.7	I90 Q92 D203 L239 R240	I90-L235 HydrophobicContact CG2-CD1 3.71Å; Q92-L235 HydrophobicContact CB-CD1 4.21Å; Q92-L235 HydrophobicContact CG-CB 4.38Å; D203-L235 HydrophobicContact CB-CD2 4.3Å; L235-L239 HydrophobicContact CD2-CD2 4Å; L235-R240 HydrophobicContact CB-CG 4.44Å
236	S	85.1	Confident	90.9	Very high	61 Å²	61	37.3 Å²	37.3	43%	0.427	19%	0.188	S	C	.	.			trans	-63.6	151.7	174	69.1	0	0	0	0	111.3	D238 L239 R240	S236-D238 PolarHBondContact O-N 2.92Å; S236-L239 PolarHBondContact O-N 3.38Å; S236-L239 WeakPolarHBondContact OG-CB 3.47Å; S236-L239 PolarHBondContact OG-N 2.88Å; S236-R240 PolarHBondContact O-N 2.85Å
237	K	85.7	Confident	90.6	Very high	150 Å²	150	36.6 Å²	36.6	65%	0.652	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-33.3	178.7	-66	-179.1	-176.8	174.4	0	112.6	L239 P241	K237-L239 VanDerWaalsContact C-N 3.35Å; K237-P241 WeakPolarHBondContact O-CD 3.37Å
238	D	89.1	Confident	89.4	Confident	143 Å²	143	41.7 Å²	41.7	77%	0.765	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-25	179.7	-60.4	-32.9	0	0	0	113.3	S236	S236-D238 PolarHBondContact O-N 2.92Å
239	L	90.3	Very high	87.5	Confident	15 Å²	15	45 Å²	45	8%	0.079	23%	0.226	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-27.7	179.7	-164.8	71.4	0	0	0	112.7	D203 L206 L235 S236 K237 V242 C243	D203-L239 VanDerWaalsContact CA-CD2 3.46Å; D203-L239 HydrophobicContact CB-CD2 4.01Å; L206-L239 HydrophobicContact CB-CD1 3.73Å; L206-L239 HydrophobicContact CB-CD2 4.28Å; L206-L239 HydrophobicContact CB-CG 4.38Å; L235-L239 HydrophobicContact CD2-CD2 4Å; S236-L239 PolarHBondContact O-N 3.38Å; S236-L239 WeakPolarHBondContact OG-CB 3.47Å; S236-L239 PolarHBondContact OG-N 2.88Å; K237-L239 VanDerWaalsContact C-N 3.35Å; L239-V242 HydrophobicContact CD1-CB 4.12Å; L239-V242 HydrophobicContact CD1-CG1 4.47Å; L239-V242 HydrophobicContact CD1-CG2 4.27Å; L239-V242 WeakPolarHBondContact O-CA 3.24Å; L239-V242 VanDerWaalsContact O-CB 3.26Å; L239-V242 WeakPolarHBondContact O-CB 3.13Å; L239-V242 PolarHBondContact O-N 3.07Å; L239-C243 PolarHBondContact O-N 2.94Å
240	R	90.4	Very high	85	Confident	47 Å²	47	49.9 Å²	49.9	18%	0.177	26%	0.256	C	S	.	.	H	α-helix	trans	-54.8	-44.4	178.8	-62.1	179.2	-170.2	-164.4	-1.7	113.3	L235 S236 V242 C243 K244	L235-R240 HydrophobicContact CB-CG 4.44Å; S236-R240 PolarHBondContact O-N 2.85Å; R240-V242 PolarHBondContact O-N 2.98Å; R240-C243 WeakPolarHBondContact O-CB 3.12Å; R240-C243 PolarHBondContact O-N 3.5Å; R240-K244 WeakPolarHBondContact O-CG 3.48Å; R240-K244 PolarHBondContact O-N 2.81Å
241	P	90.4	Very high	82.5	Confident	71 Å²	71	51.9 Å²	51.9	46%	0.461	27%	0.269	S	S	.	.	H	α-helix	trans	-60	-31.2	173.3	-25.1	34	0	0	0	113.6	K237 K245	K237-P241 WeakPolarHBondContact O-CD 3.37Å; P241-K245 WeakPolarHBondContact O-CG 3.47Å; P241-K245 PolarHBondContact O-N 3.23Å
242	V	92.4	Very high	80	Confident	17 Å²	17	58.3 Å²	58.3	10%	0.103	30%	0.304	C	S	.	.	H	α-helix	trans	-68.4	-45.4	175.9	-179.7	0	0	0	0	110.2	L206 R212 L239 R240 K244 K245 F246	L206-V242 HydrophobicContact CB-CG1 4.47Å; L206-V242 HydrophobicContact CD1-CG1 4.43Å; R212-V242 VanDerWaalsContact CZ-CG1 3.48Å; L239-V242 HydrophobicContact CD1-CB 4.12Å; L239-V242 HydrophobicContact CD1-CG1 4.47Å; L239-V242 HydrophobicContact CD1-CG2 4.27Å; L239-V242 WeakPolarHBondContact O-CA 3.24Å; L239-V242 VanDerWaalsContact O-CB 3.26Å; L239-V242 WeakPolarHBondContact O-CB 3.13Å; L239-V242 PolarHBondContact O-N 3.07Å; R240-V242 PolarHBondContact O-N 2.98Å; V242-K244 PolarHBondContact O-N 2.87Å; V242-K245 WeakPolarHBondContact O-CB 3.43Å; V242-K245 PolarHBondContact O-N 3Å; V242-F246 HydrophobicContact CG1-CE2 4.43Å; V242-F246 WeakPolarHBondContact O-CD2 3.49Å
243	C	92.8	Very high	77.9	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-57.1	-48.3	175	-59.5	0	0	0	0	111.3	I90 M230 L239 R240 K245 F246	I90-C243 HydrophobicContact CD1-CB 3.85Å; I90-C243 HydrophobicContact CG1-CB 4.37Å; M230-C243 HydrophobicContact SD-CB 3.57Å; M230-C243 VanDerWaalsContact SD-CB 3.57Å; L239-C243 PolarHBondContact O-N 2.94Å; R240-C243 WeakPolarHBondContact O-CB 3.12Å; R240-C243 PolarHBondContact O-N 3.5Å; C243-K245 PolarHBondContact O-N 2.79Å; C243-F246 WeakPolarHBondContact O-CB 3.47Å; C243-F246 PolarHBondContact O-N 3.16Å
244	K	91.4	Very high	76.1	Confident	66 Å²	66	72.5 Å²	72.5	29%	0.287	38%	0.379	S	S	.	.	H	α-helix	trans	-58.2	-31.7	179.9	-70.3	-179.9	179	-170.9	0	113.5	I90 R240 V242 F246 M247 Q248 P261 E263	I90-K244 HydrophobicContact CD1-CG 3.73Å; R240-K244 WeakPolarHBondContact O-CG 3.48Å; R240-K244 PolarHBondContact O-N 2.81Å; V242-K244 PolarHBondContact O-N 2.87Å; K244-F246 PolarHBondContact O-N 3.36Å; K244-M247 PolarHBondContact O-N 3.41Å; K244-Q248 WeakPolarHBondContact O-CG 3.37Å; K244-Q248 PolarHBondContact O-N 3.25Å; K244-Q248 VanDerWaalsContact O-N 3.13Å; K244-P261 HydrophobicContact CG-CG 4.33Å; K244-E263 WeakPolarHBondContact CE-OE1 3.31Å; K244-E263 WeakPolarHBondContact CE-OE2 3.42Å; K244-E263 VanDerWaalsContact NZ-CD 3.34Å; K244-E263 IonicContact NZ-OE1 2.73Å; K244-E263 PolarHBondContact NZ-OE1 3.36Å; K244-E263 IonicContact NZ-OE2 2.9Å; K244-E263 PolarHBondContact NZ-OE2 3.49Å
245	K	90.9	Very high	74.2	Confident	140 Å²	140	79.5 Å²	79.5	61%	0.609	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-22.2	176.6	-75.7	177.6	179	-174.2	0	114	P241 V242 C243 M247	P241-K245 WeakPolarHBondContact O-CG 3.47Å; P241-K245 PolarHBondContact O-N 3.23Å; V242-K245 WeakPolarHBondContact O-CB 3.43Å; V242-K245 PolarHBondContact O-N 3Å; C243-K245 PolarHBondContact O-N 2.79Å; K245-M247 VanDerWaalsContact C-N 3.35Å
246	F	91.5	Very high	72.2	Confident	15 Å²	15	82.3 Å²	82.3	7%	0.066	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-17.8	173.8	-72.9	-98.6	0	0	0	112.8	L206 V215 Q216 F219 V228 M230 V242 C243 K244	L206-F246 HydrophobicContact CD1-CE2 4.41Å; L206-F246 HydrophobicContact CD2-CE2 3.78Å; L206-F246 HydrophobicContact CD2-CZ 3.87Å; V215-F246 HydrophobicContact CG1-CE1 3.9Å; V215-F246 HydrophobicContact CG1-CZ 3.93Å; Q216-F246 HydrophobicContact CG-CE1 4.28Å; Q216-F246 HydrophobicContact CG-CZ 3.7Å; F219-F246 HydrophobicContact CB-CD1 4.13Å; F219-F246 HydrophobicContact CB-CE1 3.89Å; F219-F246 AromaticContact CD1-CD1 3.99Å; F219-F246 HydrophobicContact CD1-CD1 3.99Å; F219-F246 HydrophobicContact CD1-CE1 4.37Å; F219-F246 AromaticContact CD2-CD1 3.56Å; F219-F246 HydrophobicContact CD2-CD1 3.56Å; F219-F246 HydrophobicContact CD2-CE1 4.18Å; F219-F246 HydrophobicContact CE1-CD1 4.27Å; F219-F246 HydrophobicContact CE2-CB 4.23Å; F219-F246 AromaticContact CE2-CD1 3.83Å; F219-F246 HydrophobicContact CE2-CD1 3.83Å; F219-F246 AromaticContact CG-CD1 3.63Å; F219-F246 HydrophobicContact CG-CD1 3.63Å; F219-F246 AromaticContact CG-CE1 3.9Å; F219-F246 HydrophobicContact CG-CE1 3.9Å; F219-F246 HydrophobicContact CZ-CB 4.31Å; F219-F246 HydrophobicContact CZ-CD1 4.19Å; F219-F246 WeakPolarHBondContact CZ-O 3.45Å; V228-F246 HydrophobicContact CG1-CB 4.27Å; M230-F246 HydrophobicContact CE-CB 3.38Å; M230-F246 HydrophobicContact CE-CD1 4.21Å; M230-F246 HydrophobicContact CE-CD2 3.72Å; M230-F246 HydrophobicContact CE-CG 3.53Å; V242-F246 HydrophobicContact CG1-CE2 4.43Å; V242-F246 WeakPolarHBondContact O-CD2 3.49Å; C243-F246 WeakPolarHBondContact O-CB 3.47Å; C243-F246 PolarHBondContact O-N 3.16Å; K244-F246 PolarHBondContact O-N 3.36Å
247	M	88.5	Confident	70.3	Confident	6 Å²	6	84.6 Å²	84.6	3%	0.03	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-6.2	-176.9	-65.3	158.7	177.1	0	0	112.2	D88 I89 I90 V228 M230 K244 K245 N249 P261	D88-M247 HydrophobicContact CB-CB 4.2Å; D88-M247 HydrophobicContact CB-CG 3.89Å; D88-M247 HydrophobicContact CB-SD 4.27Å; D88-M247 WeakPolarHBondContact OD2-CA 3.24Å; D88-M247 VanDerWaalsContact OD2-CB 3.27Å; D88-M247 WeakPolarHBondContact OD2-CB 3.08Å; D88-M247 WeakPolarHBondContact OD2-CG 3.44Å; I89-M247 WeakPolarHBondContact O-CE 3.32Å; I90-M247 HydrophobicContact CD1-CE 4.32Å; I90-M247 HydrophobicContact CD1-SD 3.72Å; I90-M247 HydrophobicContact CG1-CE 3.52Å; I90-M247 HydrophobicContact CG1-SD 3.49Å; I90-M247 WeakPolarHBondContact CG1-SD 3.18Å; V228-M247 HydrophobicContact CB-CE 4.34Å; V228-M247 HydrophobicContact CB-CG 3.91Å; V228-M247 HydrophobicContact CG1-CE 3.87Å; V228-M247 HydrophobicContact CG1-CG 3.97Å; M230-M247 HydrophobicContact CB-CE 4.18Å; M230-M247 HydrophobicContact CE-CE 4.47Å; M230-M247 HydrophobicContact CG-CE 3.75Å; M230-M247 HydrophobicContact SD-CE 4.23Å; K244-M247 PolarHBondContact O-N 3.41Å; K245-M247 VanDerWaalsContact C-N 3.35Å; M247-N249 PolarHBondContact O-N 3.13Å; M247-P261 HydrophobicContact CB-CB 4.31Å; M247-P261 HydrophobicContact CB-CG 4.38Å; M247-P261 HydrophobicContact CG-CB 4.36Å; M247-P261 HydrophobicContact SD-CB 3.47Å; M247-P261 WeakPolarHBondContact SD-CB 3.46Å; M247-P261 HydrophobicContact SD-CG 3.88Å
248	Q	70	Confident	68.7	Low	119 Å²	119	80.7 Å²	80.7	56%	0.556	44%	0.442	S	S	*	.			trans	-75.4	94.5	175.4	-77.7	171.9	-9	0	0	109.2	K244 V250	K244-Q248 WeakPolarHBondContact O-CG 3.37Å; K244-Q248 PolarHBondContact O-N 3.25Å; K244-Q248 VanDerWaalsContact O-N 3.13Å; Q248-V250 PolarHBondContact O-N 3.23Å
249	N	57.1	Low	67.5	Low	71 Å²	71	78.5 Å²	78.5	38%	0.38	44%	0.437	S	S	.	.			trans	-64.2	92.6	158	-73.4	-34.6	0	0	0	107.3	M247 S251	M247-N249 PolarHBondContact O-N 3.13Å; N249-S251 PolarHBondContact O-N 3.48Å
250	V	45.8	Very low	67	Low	104 Å²	104	81.8 Å²	81.8	63%	0.63	47%	0.466	S	S	*	.			trans	-70.1	82.3	169.8	-175.8	0	0	0	0	106.8	Q248 N252	Q248-V250 PolarHBondContact O-N 3.23Å; V250-N252 PolarHBondContact O-N 3.18Å
251	S	43.8	Very low	66.9	Low	41 Å²	41	80.7 Å²	80.7	29%	0.287	47%	0.465	S	S	.	.			trans	-70.7	111.6	158.9	53.5	0	0	0	0	107.4	N249 D253 S256	N249-S251 PolarHBondContact O-N 3.48Å; S251-D253 PolarHBondContact O-N 3.2Å; S251-D253 PolarHBondContact OG-O 3.01Å; S251-S256 WeakPolarHBondContact CB-OG 3.3Å; S251-S256 VanDerWaalsContact OG-CB 3.3Å; S251-S256 WeakPolarHBondContact OG-CB 3.29Å; S251-S256 PolarHBondContact OG-O 2.97Å; S251-S256 PolarHBondContact OG-OG 3.27Å
252	N	44	Very low	66.9	Low	135 Å²	135	79.3 Å²	79.3	72%	0.722	46%	0.455	S	S	*	.	S	Bend	trans	-68.8	-8.3	169.2	-72.5	-31.4	0	0	0	112	V250	V250-N252 PolarHBondContact O-N 3.18Å
253	D	45.6	Very low	66.9	Low	128 Å²	128	81.9 Å²	81.9	68%	0.684	47%	0.466	S	S	*	.	S	Bend	trans	-94.9	123.3	173.2	-59.5	-38.8	0	0	0	108.3	S251 D255 S256	S251-D253 PolarHBondContact O-N 3.2Å; S251-D253 PolarHBondContact OG-O 3.01Å; D253-D255 PolarHBondContact O-N 3.01Å; D253-S256 PolarHBondContact O-N 2.94Å
254	N	46.4	Very low	66.8	Low	176 Å²	176	82.4 Å²	82.4	94%	0.941	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	17.4	-178.5	-74.8	-38.6	0	0	0	114.8
255	D	41.4	Very low	66.6	Low	163 Å²	163	81.9 Å²	81.9	87%	0.872	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.5	1.8	-175.7	-98.7	-19.3	0	0	0	114.8	D253	D253-D255 PolarHBondContact O-N 3.01Å
256	S	44.6	Very low	66	Low	60 Å²	60	75.5 Å²	75.5	42%	0.42	44%	0.439	S	S	.	.			trans	-93.6	111.9	172.9	143.1	0	0	0	0	110.6	S251 D253 S258	S251-S256 WeakPolarHBondContact CB-OG 3.3Å; S251-S256 VanDerWaalsContact OG-CB 3.3Å; S251-S256 WeakPolarHBondContact OG-CB 3.29Å; S251-S256 PolarHBondContact OG-O 2.97Å; S251-S256 PolarHBondContact OG-OG 3.27Å; D253-S256 PolarHBondContact O-N 2.94Å; S256-S258 VanDerWaalsContact C-N 3.26Å; S256-S258 PolarHBondContact O-N 3.29Å
257	C	44.3	Very low	64.6	Low	110 Å²	110	77.2 Å²	77.2	74%	0.743	45%	0.449	S	S	*	.			trans	-60.6	87.8	167.5	-170.7	0	0	0	0	108.5	C259	C257-C259 VanDerWaalsContact C-N 3.27Å; C257-C259 PolarHBondContact O-N 3.4Å
258	S	52.3	Low	62.9	Low	67 Å²	67	83 Å²	83	47%	0.469	48%	0.48	S	S	.	.			trans	-70.1	94.8	160.6	49.9	0	0	0	0	106.6	S256 A260	S256-S258 VanDerWaalsContact C-N 3.26Å; S256-S258 PolarHBondContact O-N 3.29Å; S258-A260 PolarHBondContact O-N 3.37Å
259	C	64.1	Low	62	Low	98 Å²	98	81.4 Å²	81.4	66%	0.662	47%	0.473	S	S	*	.	P	Polyproline II helix	trans	-56.2	126	170	-68.1	0	0	0	0	107.7	C257	C257-C259 VanDerWaalsContact C-N 3.27Å; C257-C259 PolarHBondContact O-N 3.4Å
260	A	79.3	Confident	61.4	Low	84 Å²	84	81.1 Å²	81.1	69%	0.694	48%	0.48	S	S	*	.	P	Polyproline II helix	trans	-56.2	142.7	174	0	0	0	0	0	109.2	S258 V262	S258-A260 PolarHBondContact O-N 3.37Å; A260-V262 PolarHBondContact O-N 2.86Å
261	P	87.9	Confident	61.3	Low	23 Å²	23	83 Å²	83	15%	0.149	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-60.9	143.9	178.7	27.1	-35	0	0	0	109.6	D88 I90 K244 M247 E263	D88-P261 HydrophobicContact CB-CB 3.92Å; D88-P261 CarbonylContact O-C 3.58Å; D88-P261 WeakPolarHBondContact O-CA 3.4Å; I90-P261 HydrophobicContact CD1-CG 4.33Å; K244-P261 HydrophobicContact CG-CG 4.33Å; M247-P261 HydrophobicContact CB-CB 4.31Å; M247-P261 HydrophobicContact CB-CG 4.38Å; M247-P261 HydrophobicContact CG-CB 4.36Å; M247-P261 HydrophobicContact SD-CB 3.47Å; M247-P261 WeakPolarHBondContact SD-CB 3.46Å; M247-P261 HydrophobicContact SD-CG 3.88Å; P261-E263 PolarHBondContact O-N 3.17Å
262	V	91.4	Very high	61.4	Low	42 Å²	42	81.4 Å²	81.4	26%	0.255	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.2	173.8	174.8	0	0	0	0	107.6	Q82 A87 D88 I89 I90 A260 I264	Q82-V262 HydrophobicContact CB-CG1 4.39Å; Q82-V262 HydrophobicContact CG-CG1 4.22Å; A87-V262 HydrophobicContact CB-CG2 3.96Å; D88-V262 PolarHBondContact O-N 3.18Å; I89-V262 WeakPolarHBondContact CA-O 3.23Å; I89-V262 HydrophobicContact CD1-CB 3.78Å; I89-V262 HydrophobicContact CD1-CG1 4.01Å; I90-V262 PolarHBondContact N-O 3.09Å; A260-V262 PolarHBondContact O-N 2.86Å; V262-I264 HydrophobicContact CG1-CD1 3.94Å; V262-I264 HydrophobicContact CG1-CG1 3.92Å
263	E	92.3	Very high	61.6	Low	71 Å²	71	77 Å²	77	33%	0.332	45%	0.446	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	113.2	-179.8	-63.5	-177.5	-114.1	0	0	110	I90 K244 P261 F265	I90-E263 HydrophobicContact CB-CG 4.35Å; I90-E263 HydrophobicContact CD1-CG 4.48Å; I90-E263 WeakPolarHBondContact O-CA 3.49Å; K244-E263 WeakPolarHBondContact CE-OE1 3.31Å; K244-E263 WeakPolarHBondContact CE-OE2 3.42Å; K244-E263 VanDerWaalsContact NZ-CD 3.34Å; K244-E263 IonicContact NZ-OE1 2.73Å; K244-E263 PolarHBondContact NZ-OE1 3.36Å; K244-E263 IonicContact NZ-OE2 2.9Å; K244-E263 PolarHBondContact NZ-OE2 3.49Å; P261-E263 PolarHBondContact O-N 3.17Å; E263-F265 HydrophobicContact CB-CD2 4.35Å; E263-F265 HydrophobicContact CB-CE2 3.55Å; E263-F265 HydrophobicContact CB-CZ 3.93Å; E263-F265 HydrophobicContact CG-CE2 4.38Å; E263-F265 HydrophobicContact CG-CZ 4.42Å; E263-F265 WeakPolarHBondContact OE2-CZ 3.49Å
264	I	90.6	Very high	62.1	Low	12 Å²	12	72.2 Å²	72.2	6%	0.062	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	113.8	-178.7	-63.9	168.7	0	0	0	108.4	Q78 C79 I89 I90 C91 Q92 V262 V266	Q78-I264 HydrophobicContact CB-CD1 4.36Å; Q78-I264 HydrophobicContact CB-CG2 4.28Å; C79-I264 HydrophobicContact CB-CD1 4.09Å; C79-I264 WeakPolarHBondContact SG-CD1 3.17Å; I89-I264 HydrophobicContact CD1-CD1 4.41Å; I90-I264 PolarHBondContact O-N 3.27Å; C91-I264 CarbonylContact C-O 3.55Å; C91-I264 WeakPolarHBondContact CA-O 3.44Å; Q92-I264 PolarHBondContact N-O 2.72Å; V262-I264 HydrophobicContact CG1-CD1 3.94Å; V262-I264 HydrophobicContact CG1-CG1 3.92Å; I264-V266 HydrophobicContact CG2-CG2 4.06Å
265	F	87.5	Confident	62.8	Low	55 Å²	55	71 Å²	71	24%	0.241	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	96	178.8	-57.7	-74.2	0	0	0	109.2	Q92 E263	Q92-F265 HydrophobicContact CB-CD1 3.56Å; Q92-F265 HydrophobicContact CB-CE1 4.1Å; E263-F265 HydrophobicContact CB-CD2 4.35Å; E263-F265 HydrophobicContact CB-CE2 3.55Å; E263-F265 HydrophobicContact CB-CZ 3.93Å; E263-F265 HydrophobicContact CG-CE2 4.38Å; E263-F265 HydrophobicContact CG-CZ 4.42Å; E263-F265 WeakPolarHBondContact OE2-CZ 3.49Å
266	V	77.2	Confident	64.1	Low	5 Å²	5	64.8 Å²	64.8	3%	0.03	38%	0.383	C	S	.	.	S	Bend	trans	-85.9	112.9	172.8	-174.7	0	0	0	0	107.2	E74 V75 Q92 A93 M97 I264	E74-V266 HydrophobicContact CG-CG1 4.47Å; V75-V266 HydrophobicContact CB-CG2 4.12Å; V75-V266 HydrophobicContact CG2-CG2 4.33Å; Q92-V266 PolarHBondContact O-N 3.17Å; A93-V266 HydrophobicContact CB-CB 3.99Å; A93-V266 HydrophobicContact CB-CG2 4.36Å; M97-V266 HydrophobicContact CE-CG1 4.01Å; M97-V266 HydrophobicContact SD-CG1 4.01Å; I264-V266 HydrophobicContact CG2-CG2 4.06Å
267	D	63.3	Low	65.8	Low	52 Å²	52	62.6 Å²	62.6	28%	0.278	37%	0.366	S	S	.	.	S	Bend	trans	68	97.6	-167.7	-69.4	-48.6	0	0	0	115.6	K94 E269	K94-D267 WeakPolarHBondContact CE-OD2 3.4Å; K94-D267 IonicContact NZ-OD2 2.94Å; K94-D267 PolarHBondContact NZ-OD2 3.08Å; D267-E269 PolarHBondContact O-N 2.97Å
268	N	51.8	Low	67.8	Low	126 Å²	126	61 Å²	61	67%	0.674	35%	0.348	S	S	*	.			trans	-52.1	136.8	160	-82	-28.2	0	0	0	108.9	A270 K271	N268-A270 PolarHBondContact O-N 2.82Å; N268-K271 PolarHBondContact O-N 3.29Å
269	E	50.6	Low	69.6	Low	87 Å²	87	58.9 Å²	58.9	41%	0.407	33%	0.331	S	S	.	.	G	3₁₀ helix	trans	-32	-33.4	-170.1	-64.3	171.3	153.2	0	0	116.5	D267 K271	D267-E269 PolarHBondContact O-N 2.97Å; E269-K271 PolarHBondContact O-N 3.39Å
270	A	44.4	Very low	71	Confident	64 Å²	64	55.2 Å²	55.2	53%	0.529	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-70.9	-17	178.9	0	0	0	0	0	116.3	N268	N268-A270 PolarHBondContact O-N 2.82Å
271	K	43.6	Very low	71.8	Confident	143 Å²	143	53.4 Å²	53.4	62%	0.622	28%	0.279	S	S	*	.	G	3₁₀ helix	trans	-118.5	29.2	179.7	-69.6	-170.6	-179.4	-178	0	113.3	K94 N268 E269 T273	K94-K271 PolarHBondContact NZ-O 3.36Å; N268-K271 PolarHBondContact O-N 3.29Å; E269-K271 PolarHBondContact O-N 3.39Å; K271-T273 PolarHBondContact O-N 3.42Å; K271-T273 PolarHBondContact O-OG1 3.14Å
272	L	46.4	Very low	72.3	Confident	9 Å²	9	53.2 Å²	53.2	5%	0.047	28%	0.278	C	S	.	.			trans	-61.4	8.2	170.4	-83	165.7	0	0	0	114.4	K94 L274 L387 F422	K94-L272 HydrophobicContact CD-CD2 4.29Å; K94-L272 WeakPolarHBondContact CE-O 3.1Å; K94-L272 HydrophobicContact CG-CD2 3.6Å; L272-L274 PolarHBondContact O-N 3.2Å; L272-L387 HydrophobicContact CD1-CD2 4.34Å; L272-L387 HydrophobicContact CD2-CD2 4.4Å; L272-F422 HydrophobicContact CB-CD1 3.91Å; L272-F422 HydrophobicContact CD1-CD1 3.65Å; L272-F422 HydrophobicContact CD1-CE1 3.73Å; L272-F422 HydrophobicContact CG-CD1 4.44Å
273	T	49.2	Very low	72.5	Confident	41 Å²	41	57.9 Å²	57.9	25%	0.252	29%	0.294	S	S	.	.			trans	-41	109.4	166.5	57.3	0	0	0	0	111.5	K94 K271 H275 V424	K94-T273 PolarHBondContact NZ-O 3.07Å; K271-T273 PolarHBondContact O-N 3.42Å; K271-T273 PolarHBondContact O-OG1 3.14Å; T273-H275 PolarHBondContact O-N 2.83Å; T273-H275 PolarHBondContact O-ND1 3.37Å; T273-H275 PolarHBondContact OG1-CE1 3.07Å; T273-H275 PolarHBondContact OG1-ND1 3.15Å; T273-H275 VanDerWaalsContact OG1-ND1 3.17Å; T273-V424 HydrophobicContact CG2-CG1 4.5Å
274	L	56.1	Low	72.7	Confident	28 Å²	28	55.7 Å²	55.7	15%	0.147	29%	0.285	C	S	.	.			trans	-71.5	81.2	173.9	-69.8	134.4	0	0	0	107.4	L272 G276 L277 L387 V390 A391	L272-L274 PolarHBondContact O-N 3.2Å; L274-G276 PolarHBondContact O-N 3.45Å; L274-L277 HydrophobicContact CB-CB 3.63Å; L274-L277 HydrophobicContact CB-CD2 3.83Å; L274-L277 HydrophobicContact CB-CG 4.32Å; L274-L277 HydrophobicContact CD1-CD2 3.72Å; L274-L277 HydrophobicContact CD2-CD2 4.03Å; L274-L277 HydrophobicContact CG-CD2 4.04Å; L274-L277 WeakPolarHBondContact O-CB 3.37Å; L274-L277 PolarHBondContact O-N 2.98Å; L274-L387 HydrophobicContact CD1-CD1 3.52Å; L274-L387 HydrophobicContact CD2-CD1 4.37Å; L274-L387 HydrophobicContact CG-CD1 4.17Å; L274-V390 HydrophobicContact CD1-CG2 3.85Å; L274-A391 HydrophobicContact CD2-CB 3.76Å
275	H	59.5	Low	72.9	Confident	151 Å²	151	62.5 Å²	62.5	70%	0.699	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	124.8	177.9	-75.2	11.3	0	0	0	109.3	T273	T273-H275 PolarHBondContact O-N 2.83Å; T273-H275 PolarHBondContact O-ND1 3.37Å; T273-H275 PolarHBondContact OG1-CE1 3.07Å; T273-H275 PolarHBondContact OG1-ND1 3.15Å; T273-H275 VanDerWaalsContact OG1-ND1 3.17Å
276	G	69.4	Low	73.2	Confident	32 Å²	32	63.7 Å²	63.7	33%	0.33	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.5	-12.2	-176	0	0	0	0	0	115.6	L274 K399 G400	L274-G276 PolarHBondContact O-N 3.45Å; G276-K399 CarbonylContact O-C 3.57Å; G276-K399 VanDerWaalsContact O-CA 3.27Å; G276-K399 WeakPolarHBondContact O-CA 3.49Å; G276-G400 PolarHBondContact O-N 3.35Å
277	L	80.3	Confident	74	Confident	14 Å²	14	67.8 Å²	67.8	7%	0.073	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	108.3	176.6	-178	61.3	0	0	0	111	L274 Q279 V390 A393 G400 A402	L274-L277 HydrophobicContact CB-CB 3.63Å; L274-L277 HydrophobicContact CB-CD2 3.83Å; L274-L277 HydrophobicContact CB-CG 4.32Å; L274-L277 HydrophobicContact CD1-CD2 3.72Å; L274-L277 HydrophobicContact CD2-CD2 4.03Å; L274-L277 HydrophobicContact CG-CD2 4.04Å; L274-L277 WeakPolarHBondContact O-CB 3.37Å; L274-L277 PolarHBondContact O-N 2.98Å; L277-Q279 HydrophobicContact CD2-CG 4.2Å; L277-Q279 HydrophobicContact CG-CG 3.9Å; L277-V390 HydrophobicContact CD2-CB 3.9Å; L277-V390 HydrophobicContact CD2-CG2 3.83Å; L277-V390 WeakPolarHBondContact CD2-O 3.41Å; L277-A393 HydrophobicContact CD1-CB 3.78Å; L277-G400 WeakPolarHBondContact CA-O 3.12Å; L277-G400 VanDerWaalsContact CD1-C 3.5Å; L277-A402 HydrophobicContact CD1-CB 4.08Å
278	H	86.4	Confident	75.6	Confident	78 Å²	78	68.9 Å²	68.9	36%	0.361	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.6	169.9	-71.4	-86.2	0	0	0	109.8	G400 L401 A402 S437	H278-G400 PolarHBondContact N-O 2.95Å; H278-L401 HydrophobicContact CB-CD1 4.12Å; H278-L401 CarbonylContact O-C 3.6Å; H278-L401 WeakPolarHBondContact O-CA 3.42Å; H278-A402 PolarHBondContact O-N 3.22Å; H278-S437 PolarHBondContact CD2-O 3.31Å; H278-S437 PolarHBondContact NE2-O 3.39Å
279	Q	90.9	Very high	77.8	Confident	22 Å²	22	62.9 Å²	62.9	10%	0.103	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	124.4	-175.4	-60.9	179.5	76.3	0	0	109.4	L277 Y386 A402 I426	L277-Q279 HydrophobicContact CD2-CG 4.2Å; L277-Q279 HydrophobicContact CG-CG 3.9Å; Q279-Y386 VanDerWaalsContact OE1-CE1 3.3Å; Q279-Y386 PolarHBondContact OE1-OH 2.87Å; Q279-A402 WeakPolarHBondContact CA-O 3.33Å; Q279-A402 HydrophobicContact CG-CB 4.27Å; Q279-I426 HydrophobicContact CB-CG1 4.14Å; Q279-I426 HydrophobicContact CB-CG2 4.17Å
280	H	94.1	Very high	80	Confident	20 Å²	20	62 Å²	62	9%	0.093	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	153.6	178	-63.3	-64.9	0	0	0	111.6	A402 I403 T404 T427 L429	H280-A402 PolarHBondContact N-O 3.27Å; H280-I403 CarbonylContact O-C 3.46Å; H280-I403 WeakPolarHBondContact O-CA 3.3Å; H280-T404 PolarHBondContact O-N 3.27Å; H280-T427 CarbonylContact C-O 3.56Å; H280-T427 WeakPolarHBondContact CA-O 3.2Å; H280-T427 PolarHBondContact CE1-OG1 2.87Å; H280-T427 PolarHBondContact ND1-OG1 3.12Å; H280-L429 HydrophobicContact CB-CB 4.22Å; H280-L429 HydrophobicContact CB-CD1 3.57Å
281	Y	96	Very high	82.5	Confident	46 Å²	46	66.1 Å²	66.1	18%	0.18	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	153.5	168.4	73.7	-99.5	0	0	0	111.7	K283 T404 I406 L415 I426 T427 S428 L429	Y281-K283 HydrophobicContact CD2-CG 3.96Å; Y281-K283 HydrophobicContact CE2-CD 4Å; Y281-K283 HydrophobicContact CE2-CG 3.82Å; Y281-T404 CarbonylContact C-O 3.58Å; Y281-T404 WeakPolarHBondContact CA-O 3.44Å; Y281-I406 HydrophobicContact CD2-CD1 4.18Å; Y281-I406 HydrophobicContact CG-CD1 4.11Å; Y281-L415 HydrophobicContact CD1-CD2 3.47Å; Y281-L415 VanDerWaalsContact CD1-CD2 3.47Å; Y281-L415 HydrophobicContact CE1-CD2 4.06Å; Y281-L415 HydrophobicContact CG-CD2 3.75Å; Y281-I426 HydrophobicContact CD1-CG2 4.06Å; Y281-I426 VanDerWaalsContact CD1-O 3.27Å; Y281-I426 WeakPolarHBondContact CD1-O 3.43Å; Y281-I426 WeakPolarHBondContact CE1-O 3.43Å; Y281-T427 WeakPolarHBondContact CD1-O 3.48Å; Y281-T427 PolarHBondContact N-O 2.97Å; Y281-S428 CarbonylContact O-C 3.57Å; Y281-S428 WeakPolarHBondContact O-CA 3.42Å; Y281-L429 PolarHBondContact O-N 2.99Å
282	V	96.7	Very high	85	Confident	19 Å²	19	61.5 Å²	61.5	12%	0.115	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	124.5	169.2	-165.7	0	0	0	0	107.8	L284 K292 I403 T404 F405 I406 L429	V282-L284 HydrophobicContact CB-CD2 3.5Å; V282-L284 HydrophobicContact CG1-CD2 3.35Å; V282-L284 WeakPolarHBondContact O-CD2 3.12Å; V282-K292 HydrophobicContact CG1-CG 4.39Å; V282-I403 HydrophobicContact CG2-CG2 3.86Å; V282-T404 PolarHBondContact N-O 3.44Å; V282-F405 HydrophobicContact CB-CD1 3.94Å; V282-F405 HydrophobicContact CB-CE1 4.23Å; V282-F405 HydrophobicContact CG2-CD1 4.11Å; V282-F405 HydrophobicContact CG2-CE1 4.03Å; V282-F405 WeakPolarHBondContact O-CA 3.47Å; V282-I406 PolarHBondContact O-N 2.97Å; V282-L429 HydrophobicContact CG2-CB 3.66Å; V282-L429 HydrophobicContact CG2-CD2 3.62Å; V282-L429 HydrophobicContact CG2-CG 4.18Å
283	K	95.7	Very high	87.4	Confident	140 Å²	140	61 Å²	61	61%	0.609	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	119.4	170.6	-72.3	178.5	-179.1	-178.1	0	108.9	Y281 I406	Y281-K283 HydrophobicContact CD2-CG 3.96Å; Y281-K283 HydrophobicContact CE2-CD 4Å; Y281-K283 HydrophobicContact CE2-CG 3.82Å; K283-I406 WeakPolarHBondContact CA-O 3.35Å; K283-I406 HydrophobicContact CG-CB 4.35Å; K283-I406 HydrophobicContact CG-CG2 4.48Å
284	L	96.2	Very high	89.7	Confident	25 Å²	25	60.6 Å²	60.6	13%	0.131	31%	0.306	C	S	.	.			trans	-156.8	155.4	-179.9	57.9	140.3	0	0	0	111.3	V282 D288 K289 K292 F405 I406 S407	V282-L284 HydrophobicContact CB-CD2 3.5Å; V282-L284 HydrophobicContact CG1-CD2 3.35Å; V282-L284 WeakPolarHBondContact O-CD2 3.12Å; L284-D288 HydrophobicContact CB-CB 4.36Å; L284-D288 HydrophobicContact CD1-CB 4.07Å; L284-K289 HydrophobicContact CD1-CB 3.96Å; L284-K289 HydrophobicContact CD1-CG 3.5Å; L284-K289 VanDerWaalsContact CD1-CG 3.5Å; L284-K289 HydrophobicContact CG-CG 4.25Å; L284-K292 HydrophobicContact CD1-CB 4.05Å; L284-F405 HydrophobicContact CD2-CB 4.16Å; L284-F405 HydrophobicContact CD2-CD1 3.86Å; L284-F405 HydrophobicContact CD2-CE1 4.38Å; L284-F405 HydrophobicContact CD2-CG 3.96Å; L284-I406 PolarHBondContact N-O 3.45Å; L284-S407 WeakPolarHBondContact O-CA 3.36Å; L284-S407 WeakPolarHBondContact O-CB 3.1Å
285	K	95.4	Very high	91.5	Very high	155 Å²	155	62.9 Å²	62.9	67%	0.674	32%	0.316	S	S	*	.			trans	-69.6	154.7	176.4	-60.8	179.4	-179.6	178.1	0	110.2	A287 D288	K285-A287 PolarHBondContact O-N 3.46Å; K285-A287 VanDerWaalsContact O-N 3.15Å; K285-D288 PolarHBondContact O-N 3.45Å
286	E	94.3	Very high	93.2	Very high	80 Å²	80	56 Å²	56	37%	0.374	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-51.1	-40	176.8	-82.9	-61.5	127.8	0	0	113.3	D288 K289 R314 S407	E286-D288 PolarHBondContact O-N 3.26Å; E286-K289 PolarHBondContact O-N 2.92Å; E286-K289 WeakPolarHBondContact OE1-CE 3.46Å; E286-K289 IonicContact OE1-NZ 2.72Å; E286-K289 PolarHBondContact OE1-NZ 2.89Å; E286-K289 IonicContact OE2-NZ 2.61Å; E286-R314 IonicContact OE2-CZ 2.68Å; E286-R314 IonicContact OE2-NH1 3.17Å; E286-R314 IonicContact OE2-NH2 3.08Å; E286-R314 PolarHBondContact OE2-NH2 3.47Å; E286-S407 VanDerWaalsContact OE1-CB 3.24Å; E286-S407 WeakPolarHBondContact OE1-CB 3.47Å; E286-S407 PolarHBondContact OE1-OG 3.42Å
287	A	94.2	Very high	94.4	Very high	91 Å²	91	54.8 Å²	54.8	75%	0.752	27%	0.27	S	S	*	.	G	3₁₀ helix	trans	-64.3	-23.9	-179.7	0	0	0	0	0	113.5	K285	K285-A287 PolarHBondContact O-N 3.46Å; K285-A287 VanDerWaalsContact O-N 3.15Å
288	D	96.5	Very high	95	Very high	75 Å²	75	60 Å²	60	40%	0.401	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-92.6	-9.5	-176.4	-59.7	-47.1	0	0	0	112.6	L284 K285 E286 N290 K291 K292	L284-D288 HydrophobicContact CB-CB 4.36Å; L284-D288 HydrophobicContact CD1-CB 4.07Å; K285-D288 PolarHBondContact O-N 3.45Å; E286-D288 PolarHBondContact O-N 3.26Å; D288-N290 PolarHBondContact O-N 3.33Å; D288-K291 PolarHBondContact O-N 2.68Å; D288-K292 WeakPolarHBondContact O-CB 3.32Å; D288-K292 PolarHBondContact O-N 2.97Å
289	K	97.5	Very high	95.1	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-60	-45.5	-173.8	-76.5	-173.6	167.7	178.6	0	113.2	L284 E286 K292 L293 Y377 D378 F405 E411	L284-K289 HydrophobicContact CD1-CB 3.96Å; L284-K289 HydrophobicContact CD1-CG 3.5Å; L284-K289 VanDerWaalsContact CD1-CG 3.5Å; L284-K289 HydrophobicContact CG-CG 4.25Å; E286-K289 PolarHBondContact O-N 2.92Å; E286-K289 WeakPolarHBondContact OE1-CE 3.46Å; E286-K289 IonicContact OE1-NZ 2.72Å; E286-K289 PolarHBondContact OE1-NZ 2.89Å; E286-K289 IonicContact OE2-NZ 2.61Å; K289-K292 PolarHBondContact O-N 3.36Å; K289-L293 WeakPolarHBondContact O-CB 3.33Å; K289-L293 PolarHBondContact O-N 3.14Å; K289-Y377 HydrophobicContact CB-CE1 4.27Å; K289-Y377 HydrophobicContact CB-CE2 3.69Å; K289-Y377 VanDerWaalsContact CB-CZ 3.47Å; K289-Y377 WeakPolarHBondContact CB-OH 3.32Å; K289-Y377 HydrophobicContact CD-CD1 4.44Å; K289-Y377 HydrophobicContact CD-CE1 4.06Å; K289-Y377 WeakPolarHBondContact CE-O 3.27Å; K289-Y377 PolarHBondContact NZ-O 3.21Å; K289-D378 IonicContact NZ-OD1 3.68Å; K289-F405 HydrophobicContact CB-CD2 4.19Å; K289-F405 HydrophobicContact CB-CE2 4.48Å; K289-F405 HydrophobicContact CD-CB 4.47Å; K289-F405 HydrophobicContact CD-CD2 4.31Å; K289-F405 HydrophobicContact CG-CD2 3.96Å; K289-E411 IonicContact NZ-OE2 3.5Å
290	N	97.1	Very high	95.1	Very high	68 Å²	68	61.2 Å²	61.2	36%	0.364	31%	0.307	S	S	.	.	H	α-helix	trans	-60.9	-48.6	178	-76	-20.7	0	0	0	111.6	D288 K292 L293 L294 M321 Y377	D288-N290 PolarHBondContact O-N 3.33Å; N290-K292 VanDerWaalsContact C-N 3.34Å; N290-K292 PolarHBondContact O-N 2.86Å; N290-L293 PolarHBondContact O-N 3.31Å; N290-L294 WeakPolarHBondContact O-CG 3.5Å; N290-L294 PolarHBondContact O-N 2.89Å; N290-L294 VanDerWaalsContact O-N 3.08Å; N290-M321 HydrophobicContact CB-CE 4.22Å; N290-M321 HydrophobicContact CB-SD 3.72Å; N290-M321 VanDerWaalsContact CG-SD 3.51Å; N290-Y377 PolarHBondContact N-OH 3.45Å; N290-Y377 PolarHBondContact OD1-OH 2.75Å
291	K	96.2	Very high	94.8	Very high	152 Å²	152	66.8 Å²	66.8	66%	0.661	33%	0.333	S	S	*	.	H	α-helix	trans	-59.8	-46.5	179.6	-178.9	-178.7	176.2	-177.5	0	110.7	D288 L294 E295	D288-K291 PolarHBondContact O-N 2.68Å; K291-L294 PolarHBondContact O-N 3.17Å; K291-E295 WeakPolarHBondContact O-CB 3.43Å; K291-E295 PolarHBondContact O-N 3.11Å
292	K	96.8	Very high	94.4	Very high	45 Å²	45	65.4 Å²	65.4	20%	0.196	33%	0.328	C	S	.	.	H	α-helix	trans	-67.6	-37.2	-178.8	-170.8	55.6	175.8	177.5	0	112.2	V282 L284 D288 K289 N290 E295 L296 F405	V282-K292 HydrophobicContact CG1-CG 4.39Å; L284-K292 HydrophobicContact CD1-CB 4.05Å; D288-K292 WeakPolarHBondContact O-CB 3.32Å; D288-K292 PolarHBondContact O-N 2.97Å; K289-K292 PolarHBondContact O-N 3.36Å; N290-K292 VanDerWaalsContact C-N 3.34Å; N290-K292 PolarHBondContact O-N 2.86Å; K292-E295 WeakPolarHBondContact CD-OE2 3.33Å; K292-E295 VanDerWaalsContact NZ-CD 3.33Å; K292-E295 IonicContact NZ-OE1 2.64Å; K292-E295 PolarHBondContact NZ-OE1 3.42Å; K292-E295 IonicContact NZ-OE2 3.32Å; K292-E295 PolarHBondContact NZ-OE2 3.35Å; K292-L296 HydrophobicContact CD-CD1 4.43Å; K292-L296 HydrophobicContact CD-CG 4.35Å; K292-L296 HydrophobicContact CG-CD1 4.13Å; K292-L296 HydrophobicContact CG-CG 4.49Å; K292-L296 VanDerWaalsContact O-CG 3.22Å; K292-L296 WeakPolarHBondContact O-CG 3.32Å; K292-L296 PolarHBondContact O-N 3.12Å; K292-F405 HydrophobicContact CB-CZ 4.32Å; K292-F405 HydrophobicContact CG-CE1 4.28Å; K292-F405 HydrophobicContact CG-CZ 4.15Å
293	L	97.4	Very high	94	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-62.4	-47.7	175.8	178.3	65.3	0	0	0	111.7	K289 N290 L296 L297 I307 L318 F375 Y377 F405	K289-L293 WeakPolarHBondContact O-CB 3.33Å; K289-L293 PolarHBondContact O-N 3.14Å; N290-L293 PolarHBondContact O-N 3.31Å; L293-L296 PolarHBondContact O-N 3.24Å; L293-L297 HydrophobicContact CD1-CD1 4.19Å; L293-L297 HydrophobicContact CD1-CG 4.22Å; L293-L297 HydrophobicContact CG-CD1 3.98Å; L293-L297 HydrophobicContact CG-CG 4.4Å; L293-L297 WeakPolarHBondContact O-CG 3.24Å; L293-L297 PolarHBondContact O-N 3.12Å; L293-I307 HydrophobicContact CD1-CD1 4.09Å; L293-I307 HydrophobicContact CD2-CD1 4Å; L293-L318 HydrophobicContact CD2-CD1 3.69Å; L293-L318 HydrophobicContact CD2-CD2 4.07Å; L293-L318 HydrophobicContact CD2-CG 4.35Å; L293-F375 HydrophobicContact CD1-CB 4.43Å; L293-F375 HydrophobicContact CD1-CD1 3.93Å; L293-F375 HydrophobicContact CD1-CD2 4.05Å; L293-F375 HydrophobicContact CD1-CE1 4.14Å; L293-F375 HydrophobicContact CD1-CE2 4.26Å; L293-F375 HydrophobicContact CD1-CG 3.88Å; L293-F375 HydrophobicContact CD1-CZ 4.3Å; L293-Y377 HydrophobicContact CB-CD2 4.47Å; L293-Y377 HydrophobicContact CB-CE2 4.34Å; L293-Y377 HydrophobicContact CD2-CD2 3.86Å; L293-Y377 HydrophobicContact CD2-CE2 4.01Å; L293-F405 HydrophobicContact CB-CE2 4.06Å; L293-F405 HydrophobicContact CB-CZ 4.26Å
294	L	96.5	Very high	93.8	Very high	31 Å²	31	60.6 Å²	60.6	16%	0.162	31%	0.308	C	S	.	.	H	α-helix	trans	-61	-46.6	178.5	-68.6	172.5	0	0	0	111.2	N290 K291 L296 L297 D298 M321 L322 Q325 F327	N290-L294 WeakPolarHBondContact O-CG 3.5Å; N290-L294 PolarHBondContact O-N 2.89Å; N290-L294 VanDerWaalsContact O-N 3.08Å; K291-L294 PolarHBondContact O-N 3.17Å; L294-L296 VanDerWaalsContact C-N 3.27Å; L294-L296 PolarHBondContact O-N 3.49Å; L294-L297 PolarHBondContact O-N 2.86Å; L294-L297 VanDerWaalsContact O-N 3.13Å; L294-D298 PolarHBondContact O-N 3.18Å; L294-M321 HydrophobicContact CD1-CE 4.14Å; L294-M321 HydrophobicContact CD1-SD 4.48Å; L294-M321 HydrophobicContact CD2-CE 4.04Å; L294-M321 HydrophobicContact CG-CE 4Å; L294-L322 HydrophobicContact CD2-CD2 4Å; L294-Q325 HydrophobicContact CD1-CG 4.14Å; L294-Q325 HydrophobicContact CD2-CB 4.26Å; L294-Q325 HydrophobicContact CD2-CG 4.01Å; L294-F327 HydrophobicContact CD2-CD2 4.23Å; L294-F327 HydrophobicContact CD2-CE2 3.71Å
295	E	94.9	Very high	93.7	Very high	77 Å²	77	59.4 Å²	59.4	36%	0.36	30%	0.302	S	S	.	.	H	α-helix	trans	-53.6	-44.6	174.3	-174.7	-162	137.6	0	0	111.8	K291 K292 D298 L299	K291-E295 WeakPolarHBondContact O-CB 3.43Å; K291-E295 PolarHBondContact O-N 3.11Å; K292-E295 WeakPolarHBondContact CD-OE2 3.33Å; K292-E295 VanDerWaalsContact NZ-CD 3.33Å; K292-E295 IonicContact NZ-OE1 2.64Å; K292-E295 PolarHBondContact NZ-OE1 3.42Å; K292-E295 IonicContact NZ-OE2 3.32Å; K292-E295 PolarHBondContact NZ-OE2 3.35Å; E295-D298 PolarHBondContact O-N 3.41Å; E295-L299 HydrophobicContact CG-CD1 3.99Å; E295-L299 WeakPolarHBondContact O-CB 3.11Å; E295-L299 WeakPolarHBondContact O-CG 3.49Å; E295-L299 PolarHBondContact O-N 3.26Å; E295-L299 VanDerWaalsContact O-N 3.08Å
296	L	95.1	Very high	93.6	Very high	6 Å²	6	52.1 Å²	52.1	3%	0.031	27%	0.271	C	S	.	.	H	α-helix	trans	-72.1	-35.1	179.2	-67.1	173.7	0	0	0	112.9	K292 L293 L294 D298 L299 L300 F375 I403 F405 L429	K292-L296 HydrophobicContact CD-CD1 4.43Å; K292-L296 HydrophobicContact CD-CG 4.35Å; K292-L296 HydrophobicContact CG-CD1 4.13Å; K292-L296 HydrophobicContact CG-CG 4.49Å; K292-L296 VanDerWaalsContact O-CG 3.22Å; K292-L296 WeakPolarHBondContact O-CG 3.32Å; K292-L296 PolarHBondContact O-N 3.12Å; L293-L296 PolarHBondContact O-N 3.24Å; L294-L296 VanDerWaalsContact C-N 3.27Å; L294-L296 PolarHBondContact O-N 3.49Å; L296-D298 VanDerWaalsContact C-N 3.3Å; L296-L299 PolarHBondContact O-N 3.49Å; L296-L300 HydrophobicContact CB-CD1 4.11Å; L296-L300 VanDerWaalsContact O-CB 3.24Å; L296-L300 WeakPolarHBondContact O-CB 3.3Å; L296-L300 WeakPolarHBondContact O-CD1 3.39Å; L296-L300 WeakPolarHBondContact O-CG 3.12Å; L296-L300 PolarHBondContact O-N 3.34Å; L296-F375 HydrophobicContact CB-CE1 4.05Å; L296-F375 HydrophobicContact CB-CZ 4Å; L296-F375 HydrophobicContact CD1-CE1 3.83Å; L296-I403 HydrophobicContact CD1-CD1 4.22Å; L296-I403 HydrophobicContact CD1-CG2 4.23Å; L296-F405 HydrophobicContact CD1-CE1 3.87Å; L296-F405 HydrophobicContact CD1-CZ 4.02Å; L296-L429 HydrophobicContact CD1-CD2 4.1Å; L296-L429 HydrophobicContact CD2-CD2 3.62Å
297	L	94.8	Very high	93.7	Very high	6 Å²	6	48.3 Å²	48.3	3%	0.031	25%	0.253	C	S	.	.	H	α-helix	trans	-68.2	-30.8	175.2	-71.1	172.8	0	0	0	112.2	L293 L294 F302 V305 I307 L322 F327 I355 F375	L293-L297 HydrophobicContact CD1-CD1 4.19Å; L293-L297 HydrophobicContact CD1-CG 4.22Å; L293-L297 HydrophobicContact CG-CD1 3.98Å; L293-L297 HydrophobicContact CG-CG 4.4Å; L293-L297 WeakPolarHBondContact O-CG 3.24Å; L293-L297 PolarHBondContact O-N 3.12Å; L294-L297 PolarHBondContact O-N 2.86Å; L294-L297 VanDerWaalsContact O-N 3.13Å; L297-F302 HydrophobicContact CB-CE1 4.32Å; L297-F302 HydrophobicContact CD2-CD1 4.33Å; L297-F302 HydrophobicContact CD2-CE1 3.7Å; L297-F302 HydrophobicContact CD2-CZ 4.11Å; L297-F302 WeakPolarHBondContact O-CE1 3.2Å; L297-V305 HydrophobicContact CD2-CG1 4.33Å; L297-V305 HydrophobicContact CD2-CG2 4.22Å; L297-I307 HydrophobicContact CD1-CD1 4.49Å; L297-L322 HydrophobicContact CD1-CD2 3.55Å; L297-F327 HydrophobicContact CB-CE1 3.82Å; L297-F327 HydrophobicContact CB-CZ 3.84Å; L297-F327 HydrophobicContact CD1-CE1 4.5Å; L297-I355 HydrophobicContact CD1-CD1 3.91Å; L297-I355 HydrophobicContact CD2-CD1 3.95Å; L297-F375 HydrophobicContact CD2-CE2 3.92Å
298	D	91.5	Very high	93.8	Very high	123 Å²	123	44 Å²	44	66%	0.658	22%	0.217	S	C	*	.	H	α-helix	trans	-76.1	-33.5	174.8	-70.9	-31.1	0	0	0	112.4	L294 E295 L296 F327	L294-D298 PolarHBondContact O-N 3.18Å; E295-D298 PolarHBondContact O-N 3.41Å; L296-D298 VanDerWaalsContact C-N 3.3Å; D298-F327 WeakPolarHBondContact OD1-CZ 3.24Å
299	L	90.1	Very high	93.7	Very high	115 Å²	115	40.4 Å²	40.4	60%	0.602	20%	0.198	S	C	*	.	H	α-helix	trans	-83	-34.1	-177.6	-72.8	172.3	0	0	0	113.8	E295 L296	E295-L299 HydrophobicContact CG-CD1 3.99Å; E295-L299 WeakPolarHBondContact O-CB 3.11Å; E295-L299 WeakPolarHBondContact O-CG 3.49Å; E295-L299 PolarHBondContact O-N 3.26Å; E295-L299 VanDerWaalsContact O-N 3.08Å; L296-L299 PolarHBondContact O-N 3.49Å
300	L	90.3	Very high	93.4	Very high	12 Å²	12	45.5 Å²	45.5	6%	0.063	22%	0.217	C	C	.	.	S	Bend	trans	-93.6	128.6	-170.8	-61	169.9	0	0	0	111.5	L296 F302 I373 F375 L401 I403 I433 Y438	L296-L300 HydrophobicContact CB-CD1 4.11Å; L296-L300 VanDerWaalsContact O-CB 3.24Å; L296-L300 WeakPolarHBondContact O-CB 3.3Å; L296-L300 WeakPolarHBondContact O-CD1 3.39Å; L296-L300 WeakPolarHBondContact O-CG 3.12Å; L296-L300 PolarHBondContact O-N 3.34Å; L300-F302 WeakPolarHBondContact O-CD1 3.48Å; L300-F302 PolarHBondContact O-N 2.89Å; L300-I373 HydrophobicContact CB-CD1 3.9Å; L300-I373 HydrophobicContact CD1-CD1 4.17Å; L300-F375 HydrophobicContact CD1-CZ 3.97Å; L300-L401 HydrophobicContact CD1-CD2 4.03Å; L300-L401 HydrophobicContact CD2-CD2 4.13Å; L300-I403 HydrophobicContact CD1-CD1 3.74Å; L300-I433 HydrophobicContact CD2-CB 4.29Å; L300-I433 HydrophobicContact CD2-CD1 3.78Å; L300-I433 HydrophobicContact CD2-CG1 4.46Å; L300-Y438 HydrophobicContact CD2-CE1 4.24Å; L300-Y438 WeakPolarHBondContact CD2-OH 3.32Å
301	E	87	Confident	93.3	Very high	136 Å²	136	44.8 Å²	44.8	64%	0.636	22%	0.216	S	C	*	.			trans	-77.2	107.4	169.4	-63.9	-170.3	173.2	0	0	111.8	V435 Y438	E301-V435 HydrophobicContact CB-CG1 4.06Å; E301-V435 HydrophobicContact CG-CG1 4.44Å; E301-Y438 PolarHBondContact N-OH 3.47Å; E301-Y438 WeakPolarHBondContact O-CE2 3.45Å
302	F	88.8	Confident	93.2	Very high	18 Å²	18	38.2 Å²	38.2	8%	0.079	19%	0.188	C	C	.	.			trans	-118.8	152	179.2	54	-98.6	0	0	0	112.6	L297 L300 V305 R354 I355 I373	L297-F302 HydrophobicContact CB-CE1 4.32Å; L297-F302 HydrophobicContact CD2-CD1 4.33Å; L297-F302 HydrophobicContact CD2-CE1 3.7Å; L297-F302 HydrophobicContact CD2-CZ 4.11Å; L297-F302 WeakPolarHBondContact O-CE1 3.2Å; L300-F302 WeakPolarHBondContact O-CD1 3.48Å; L300-F302 PolarHBondContact O-N 2.89Å; F302-V305 HydrophobicContact CB-CG2 3.6Å; F302-V305 HydrophobicContact CD1-CG2 3.66Å; F302-V305 HydrophobicContact CD2-CG2 3.32Å; F302-V305 HydrophobicContact CE1-CG2 4.1Å; F302-V305 HydrophobicContact CE2-CG2 3.78Å; F302-V305 HydrophobicContact CG-CG2 3.23Å; F302-V305 HydrophobicContact CZ-CG2 4.15Å; F302-R354 HydrophobicContact CE2-CB 4.26Å; F302-R354 PolarHBondContact O-NH2 2.78Å; F302-I355 HydrophobicContact CE2-CD1 4.36Å; F302-I355 HydrophobicContact CE2-CG1 4.1Å; F302-I355 HydrophobicContact CZ-CD1 4.01Å; F302-I355 HydrophobicContact CZ-CG1 4.26Å; F302-I373 HydrophobicContact CB-CD1 3.61Å; F302-I373 HydrophobicContact CB-CG1 3.91Å
303	N	87.2	Confident	93.1	Very high	56 Å²	56	43.9 Å²	43.9	30%	0.299	22%	0.215	S	C	.	.	S	Bend	trans	-82.2	-61.2	165.9	-72.4	-36.9	0	0	0	109.8	F351 R354 N372 I441	N303-F351 HydrophobicContact CB-CE2 4.42Å; N303-R354 PolarHBondContact O-NE 2.98Å; N303-N372 PolarHBondContact N-OD1 2.87Å; N303-I441 WeakPolarHBondContact ND2-CD1 3.34Å
304	Q	91.8	Very high	93	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	148.6	171.6	-56.6	-169.8	-80	0	0	111.3	F348 F351 K353 R354 R370 V371 N372	Q304-F348 HydrophobicContact CB-CE2 4.07Å; Q304-F348 HydrophobicContact CB-CZ 3.8Å; Q304-F348 HydrophobicContact CG-CE2 4.49Å; Q304-F348 HydrophobicContact CG-CZ 4.5Å; Q304-F348 PolarHBondContact NE2-O 3.29Å; Q304-F351 HydrophobicContact CG-CD2 3.68Å; Q304-F351 HydrophobicContact CG-CE2 3.51Å; Q304-K353 PolarHBondContact NE2-O 3.05Å; Q304-R354 CarbonylContact C-O 3.56Å; Q304-R354 WeakPolarHBondContact CA-O 3.28Å; Q304-R370 HydrophobicContact CG-CB 4.49Å; Q304-V371 HydrophobicContact CB-CG2 4.17Å; Q304-N372 PolarHBondContact O-N 3.42Å; Q304-N372 PolarHBondContact O-OD1 3.39Å
305	V	93.5	Very high	93	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	137.8	-177.2	-176.1	0	0	0	0	109.8	L297 F302 I307 R354 I355 L356 I373 F375	L297-V305 HydrophobicContact CD2-CG1 4.33Å; L297-V305 HydrophobicContact CD2-CG2 4.22Å; F302-V305 HydrophobicContact CB-CG2 3.6Å; F302-V305 HydrophobicContact CD1-CG2 3.66Å; F302-V305 HydrophobicContact CD2-CG2 3.32Å; F302-V305 HydrophobicContact CE1-CG2 4.1Å; F302-V305 HydrophobicContact CE2-CG2 3.78Å; F302-V305 HydrophobicContact CG-CG2 3.23Å; F302-V305 HydrophobicContact CZ-CG2 4.15Å; V305-I307 HydrophobicContact CG1-CD1 4.43Å; V305-I307 HydrophobicContact CG1-CG1 3.83Å; V305-R354 PolarHBondContact N-O 3.26Å; V305-I355 HydrophobicContact CB-CG1 4.33Å; V305-I355 HydrophobicContact CB-CG2 4.41Å; V305-I355 WeakPolarHBondContact O-CA 3.12Å; V305-L356 PolarHBondContact O-N 2.9Å; V305-I373 WeakPolarHBondContact CA-O 3.5Å; V305-I373 HydrophobicContact CG2-CB 4.24Å; V305-F375 HydrophobicContact CG1-CD2 3.42Å; V305-F375 VanDerWaalsContact CG1-CD2 3.42Å; V305-F375 HydrophobicContact CG1-CE2 3.69Å
306	V	94.3	Very high	93.1	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.012	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	127.4	166.5	-176.5	0	0	0	0	109.5	F308 F348 L356 V371 I373 V374 F375	V306-F308 HydrophobicContact CB-CE2 4.34Å; V306-F308 HydrophobicContact CG1-CD1 4.39Å; V306-F308 HydrophobicContact CG1-CD2 4.15Å; V306-F308 HydrophobicContact CG1-CE1 3.9Å; V306-F308 HydrophobicContact CG1-CE2 3.63Å; V306-F308 HydrophobicContact CG1-CZ 3.5Å; V306-F308 VanDerWaalsContact CG1-CZ 3.5Å; V306-F348 HydrophobicContact CG2-CE1 4.08Å; V306-F348 HydrophobicContact CG2-CZ 4.03Å; V306-L356 CarbonylContact C-O 3.44Å; V306-L356 WeakPolarHBondContact CA-O 3.46Å; V306-L356 HydrophobicContact CG1-CD2 4.44Å; V306-L356 HydrophobicContact CG2-CB 4.4Å; V306-L356 HydrophobicContact CG2-CD2 4.36Å; V306-V371 HydrophobicContact CB-CG1 4.45Å; V306-V371 HydrophobicContact CG2-CB 4.4Å; V306-V371 HydrophobicContact CG2-CG1 3.84Å; V306-V371 HydrophobicContact CG2-CG2 3.65Å; V306-I373 PolarHBondContact N-O 3.17Å; V306-V374 CarbonylContact O-C 3.55Å; V306-V374 WeakPolarHBondContact O-CA 3.43Å; V306-F375 PolarHBondContact O-N 3.43Å
307	I	96.1	Very high	93.2	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	111	-179.7	-51.3	178	0	0	0	108.6	L293 L297 V305 L318 L322 I355 L356 V357 A358 F375 Y377	L293-I307 HydrophobicContact CD1-CD1 4.09Å; L293-I307 HydrophobicContact CD2-CD1 4Å; L297-I307 HydrophobicContact CD1-CD1 4.49Å; V305-I307 HydrophobicContact CG1-CD1 4.43Å; V305-I307 HydrophobicContact CG1-CG1 3.83Å; I307-L318 HydrophobicContact CG2-CD2 3.79Å; I307-L322 HydrophobicContact CD1-CD1 3.94Å; I307-I355 HydrophobicContact CD1-CG2 3.52Å; I307-I355 HydrophobicContact CG1-CG2 4.03Å; I307-L356 PolarHBondContact N-O 3.35Å; I307-V357 HydrophobicContact CB-CG2 4.45Å; I307-V357 HydrophobicContact CD1-CG2 4.44Å; I307-V357 WeakPolarHBondContact O-CA 3.35Å; I307-A358 PolarHBondContact O-N 2.8Å; I307-F375 CarbonylContact C-O 3.54Å; I307-F375 WeakPolarHBondContact CA-O 3.43Å; I307-F375 HydrophobicContact CB-CB 4.41Å; I307-F375 HydrophobicContact CG1-CB 4.2Å; I307-F375 HydrophobicContact CG1-CD2 4.2Å; I307-F375 HydrophobicContact CG2-CB 4.1Å; I307-Y377 HydrophobicContact CG2-CG 4.46Å
308	F	95.7	Very high	93.3	Very high	1 Å²	1	49.9 Å²	49.9	0%	0.004	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	126.6	179.4	-67.7	-71.7	0	0	0	111.9	V306 A358 F362 V374 F375 Y377 D378 R389 R392	V306-F308 HydrophobicContact CB-CE2 4.34Å; V306-F308 HydrophobicContact CG1-CD1 4.39Å; V306-F308 HydrophobicContact CG1-CD2 4.15Å; V306-F308 HydrophobicContact CG1-CE1 3.9Å; V306-F308 HydrophobicContact CG1-CE2 3.63Å; V306-F308 HydrophobicContact CG1-CZ 3.5Å; V306-F308 VanDerWaalsContact CG1-CZ 3.5Å; F308-A358 WeakPolarHBondContact CA-O 3.34Å; F308-A358 HydrophobicContact CD1-CB 4.49Å; F308-F362 HydrophobicContact CE1-CB 3.8Å; F308-V374 HydrophobicContact CD2-CG1 3.72Å; F308-V374 HydrophobicContact CE2-CG1 3.69Å; F308-F375 PolarHBondContact N-O 2.84Å; F308-Y377 WeakPolarHBondContact O-CB 3.45Å; F308-Y377 PolarHBondContact O-N 3.07Å; F308-D378 PolarHBondContact O-N 3.26Å; F308-R389 HydrophobicContact CD1-CG 4.1Å; F308-R389 HydrophobicContact CD2-CB 3.7Å; F308-R389 HydrophobicContact CD2-CG 3.72Å; F308-R389 HydrophobicContact CE1-CG 4.17Å; F308-R389 HydrophobicContact CE2-CB 3.58Å; F308-R389 HydrophobicContact CE2-CG 3.8Å; F308-R389 HydrophobicContact CG-CB 4.36Å; F308-R389 HydrophobicContact CG-CG 3.87Å; F308-R389 HydrophobicContact CZ-CB 4.17Å; F308-R389 HydrophobicContact CZ-CG 4.02Å; F308-R392 HydrophobicContact CE2-CG 4.47Å; F308-R392 HydrophobicContact CZ-CG 4.16Å
309	V	95.4	Very high	93.6	Very high	0 Å²	0	44.8 Å²	44.8	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	156.2	176.2	-62.5	0	0	0	0	110.9	R314 C315 L318 V357 A358 T359 Y377 D378	V309-R314 HydrophobicContact CB-CB 4.34Å; V309-C315 HydrophobicContact CG2-CB 3.53Å; V309-L318 HydrophobicContact CG1-CD2 3.75Å; V309-V357 HydrophobicContact CG1-CG1 4.3Å; V309-V357 HydrophobicContact CG2-CG1 4.24Å; V309-A358 PolarHBondContact N-O 2.77Å; V309-T359 HydrophobicContact CG2-CG2 4.4Å; V309-T359 WeakPolarHBondContact O-CA 3.48Å; V309-Y377 HydrophobicContact CG1-CD1 3.82Å; V309-Y377 HydrophobicContact CG1-CG 4.11Å; V309-D378 WeakPolarHBondContact CA-OD2 3.42Å
310	R	91.8	Very high	94	Very high	107 Å²	107	44 Å²	44	40%	0.404	22%	0.217	S	C	.	.	S	Bend	trans	-77.4	-42.1	-175.1	-168.4	-176	-58.9	-88.1	2	112.7	D378 M379 E411	R310-D378 HydrophobicContact CB-CB 3.96Å; R310-D378 PolarHBondContact N-OD2 2.74Å; R310-M379 PolarHBondContact NH2-O 3.46Å; R310-E411 IonicContact NH2-OE1 2.91Å
311	T	93.3	Very high	94.4	Very high	53 Å²	53	45.2 Å²	45.2	33%	0.325	22%	0.223	S	C	.	.	S	Bend	trans	-115.4	153.5	-169.5	76.7	0	0	0	0	113	Q313 R314 C315	T311-Q313 VanDerWaalsContact C-N 3.34Å; T311-Q313 PolarHBondContact O-N 2.73Å; T311-R314 PolarHBondContact O-N 3.2Å; T311-R314 WeakPolarHBondContact OG1-CB 3.42Å; T311-R314 VanDerWaalsContact OG1-CG 3.28Å; T311-R314 WeakPolarHBondContact OG1-CG 3.33Å; T311-R314 PolarHBondContact OG1-N 2.79Å; T311-C315 PolarHBondContact O-N 2.99Å
312	V	94	Very high	94.9	Very high	14 Å²	14	38.8 Å²	38.8	9%	0.085	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-42.9	176.5	178.1	0	0	0	0	111.2	R314 C315 M316 H333 R334 N335 T359	V312-R314 VanDerWaalsContact C-N 3.33Å; V312-R314 PolarHBondContact O-N 3.23Å; V312-C315 WeakPolarHBondContact O-CB 3.49Å; V312-C315 PolarHBondContact O-N 3.12Å; V312-C315 VanDerWaalsContact O-N 3.16Å; V312-M316 HydrophobicContact CG1-CG 4.48Å; V312-M316 HydrophobicContact CG1-SD 4.08Å; V312-M316 WeakPolarHBondContact O-CG 3.32Å; V312-M316 PolarHBondContact O-N 3.37Å; V312-H333 HydrophobicContact CG1-CB 4.13Å; V312-H333 HydrophobicContact CG2-CB 4.26Å; V312-R334 HydrophobicContact CG2-CG 3.84Å; V312-N335 HydrophobicContact CG1-CB 4.3Å; V312-T359 HydrophobicContact CG2-CG2 4.4Å
313	Q	95.7	Very high	95.3	Very high	163 Å²	163	41.3 Å²	41.3	76%	0.762	21%	0.207	S	C	*	.	H	α-helix	trans	-59.6	-44.1	178.2	-69.8	173.4	-21.8	0	0	111.5	T311 M316 A317	T311-Q313 VanDerWaalsContact C-N 3.34Å; T311-Q313 PolarHBondContact O-N 2.73Å; Q313-M316 PolarHBondContact O-N 2.94Å; Q313-A317 WeakPolarHBondContact O-CB 3.46Å; Q313-A317 PolarHBondContact O-N 2.75Å
314	R	95.4	Very high	95.8	Very high	72 Å²	72	43.5 Å²	43.5	27%	0.272	22%	0.218	S	C	.	.	H	α-helix	trans	-64.7	-40.6	175.1	-72.7	173.1	76.1	84.6	-20.9	111.8	E286 V309 T311 V312 M316 A317 L318 Y377 D378	E286-R314 IonicContact OE2-CZ 2.68Å; E286-R314 IonicContact OE2-NH1 3.17Å; E286-R314 IonicContact OE2-NH2 3.08Å; E286-R314 PolarHBondContact OE2-NH2 3.47Å; V309-R314 HydrophobicContact CB-CB 4.34Å; T311-R314 PolarHBondContact O-N 3.2Å; T311-R314 WeakPolarHBondContact OG1-CB 3.42Å; T311-R314 VanDerWaalsContact OG1-CG 3.28Å; T311-R314 WeakPolarHBondContact OG1-CG 3.33Å; T311-R314 PolarHBondContact OG1-N 2.79Å; V312-R314 VanDerWaalsContact C-N 3.33Å; V312-R314 PolarHBondContact O-N 3.23Å; R314-M316 VanDerWaalsContact C-N 3.35Å; R314-M316 PolarHBondContact O-N 2.99Å; R314-A317 PolarHBondContact O-N 3.23Å; R314-L318 WeakPolarHBondContact O-CB 3.49Å; R314-L318 PolarHBondContact O-N 2.88Å; R314-Y377 VanDerWaalsContact NH2-CE1 3.26Å; R314-D378 IonicContact CZ-OD1 3.75Å; R314-D378 IonicContact CZ-OD2 3.71Å; R314-D378 IonicContact NE-OD1 3.26Å; R314-D378 PolarHBondContact NE-OD1 2.53Å; R314-D378 IonicContact NE-OD2 2.78Å; R314-D378 PolarHBondContact NE-OD2 3.19Å; R314-D378 IonicContact NH2-OD1 3.78Å; R314-D378 PolarHBondContact NH2-OD1 3.32Å; R314-D378 IonicContact NH2-OD2 2.91Å
315	C	96.2	Very high	96	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-57.5	-48	176.8	-175.3	0	0	0	0	111.8	V309 T311 V312 N319 H333 V357 T359	V309-C315 HydrophobicContact CG2-CB 3.53Å; T311-C315 PolarHBondContact O-N 2.99Å; V312-C315 WeakPolarHBondContact O-CB 3.49Å; V312-C315 PolarHBondContact O-N 3.12Å; V312-C315 VanDerWaalsContact O-N 3.16Å; C315-N319 VanDerWaalsContact O-CB 3.26Å; C315-N319 WeakPolarHBondContact O-CB 3.27Å; C315-N319 PolarHBondContact O-N 2.83Å; C315-H333 HydrophobicContact CB-CB 4.49Å; C315-V357 HydrophobicContact CB-CG1 4.41Å; C315-V357 PolarHBondContact SG-O 2.84Å; C315-V357 VanDerWaalsContact SG-O 3.39Å; C315-T359 HydrophobicContact CB-CG2 4.11Å
316	M	96.9	Very high	96	Very high	105 Å²	105	57.2 Å²	57.2	52%	0.517	28%	0.283	S	S	.	.	H	α-helix	trans	-66.7	-48.5	178.6	-65.6	174.9	68.6	0	0	111.9	V312 Q313 R314 L318 N319 Q320 H333	V312-M316 HydrophobicContact CG1-CG 4.48Å; V312-M316 HydrophobicContact CG1-SD 4.08Å; V312-M316 WeakPolarHBondContact O-CG 3.32Å; V312-M316 PolarHBondContact O-N 3.37Å; Q313-M316 PolarHBondContact O-N 2.94Å; R314-M316 VanDerWaalsContact C-N 3.35Å; R314-M316 PolarHBondContact O-N 2.99Å; M316-L318 PolarHBondContact O-N 3.01Å; M316-N319 PolarHBondContact O-N 3Å; M316-Q320 WeakPolarHBondContact O-CB 3.28Å; M316-Q320 PolarHBondContact O-N 3.36Å; M316-H333 WeakPolarHBondContact CG-NE2 3.41Å
317	A	97.4	Very high	96.1	Very high	64 Å²	64	58.7 Å²	58.7	53%	0.529	29%	0.289	S	S	.	.	H	α-helix	trans	-61.9	-44.2	-179.1	0	0	0	0	0	112	Q313 R314 Q320 M321	Q313-A317 WeakPolarHBondContact O-CB 3.46Å; Q313-A317 PolarHBondContact O-N 2.75Å; R314-A317 PolarHBondContact O-N 3.23Å; A317-Q320 PolarHBondContact O-N 2.92Å; A317-M321 WeakPolarHBondContact O-CB 3.33Å; A317-M321 PolarHBondContact O-N 3.46Å
318	L	97.8	Very high	96.1	Very high	6 Å²	6	61.2 Å²	61.2	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-67.1	-42.8	179.6	-178.2	61.8	0	0	0	111.6	L293 I307 V309 R314 M316 Q320 M321 L322 V357 Y377	L293-L318 HydrophobicContact CD2-CD1 3.69Å; L293-L318 HydrophobicContact CD2-CD2 4.07Å; L293-L318 HydrophobicContact CD2-CG 4.35Å; I307-L318 HydrophobicContact CG2-CD2 3.79Å; V309-L318 HydrophobicContact CG1-CD2 3.75Å; R314-L318 WeakPolarHBondContact O-CB 3.49Å; R314-L318 PolarHBondContact O-N 2.88Å; M316-L318 PolarHBondContact O-N 3.01Å; L318-Q320 VanDerWaalsContact C-N 3.34Å; L318-Q320 PolarHBondContact O-N 3.26Å; L318-M321 HydrophobicContact CD1-CE 3.47Å; L318-M321 VanDerWaalsContact CD1-CE 3.47Å; L318-M321 HydrophobicContact CD1-SD 4.46Å; L318-M321 PolarHBondContact O-N 3.43Å; L318-L322 HydrophobicContact CG-CD1 4.29Å; L318-L322 WeakPolarHBondContact O-CG 3.48Å; L318-L322 PolarHBondContact O-N 2.9Å; L318-V357 HydrophobicContact CB-CG1 4.36Å; L318-V357 HydrophobicContact CD2-CG1 4.01Å; L318-V357 HydrophobicContact CG-CG1 4.38Å; L318-Y377 HydrophobicContact CD1-CE2 4.28Å; L318-Y377 HydrophobicContact CD2-CD1 4.43Å; L318-Y377 HydrophobicContact CD2-CD2 4.05Å; L318-Y377 HydrophobicContact CD2-CE2 4.3Å; L318-Y377 HydrophobicContact CD2-CG 4.13Å
319	N	98	Very high	96.1	Very high	15 Å²	15	61.3 Å²	61.3	8%	0.08	31%	0.306	C	S	.	.	H	α-helix	trans	-64	-39.5	176.2	179.2	75.2	0	0	0	112.5	C315 M316 L322 I323 S329 I330 A331 V357	C315-N319 VanDerWaalsContact O-CB 3.26Å; C315-N319 WeakPolarHBondContact O-CB 3.27Å; C315-N319 PolarHBondContact O-N 2.83Å; M316-N319 PolarHBondContact O-N 3Å; N319-L322 PolarHBondContact O-N 3.16Å; N319-I323 WeakPolarHBondContact ND2-CD1 3.32Å; N319-I323 VanDerWaalsContact O-CG1 3.3Å; N319-I323 WeakPolarHBondContact O-CG1 3.46Å; N319-I323 PolarHBondContact O-N 2.9Å; N319-S329 WeakPolarHBondContact OD1-CB 3.37Å; N319-S329 PolarHBondContact OD1-OG 2.99Å; N319-I330 VanDerWaalsContact OD1-CA 3.28Å; N319-I330 WeakPolarHBondContact OD1-CA 3.24Å; N319-I330 PolarHBondContact OD1-N 3.09Å; N319-A331 HydrophobicContact CB-CB 3.62Å; N319-A331 PolarHBondContact OD1-N 2.87Å; N319-V357 HydrophobicContact CB-CB 4.29Å; N319-V357 HydrophobicContact CB-CG2 4.14Å
320	Q	97.8	Very high	96.2	Very high	99 Å²	99	61.7 Å²	61.7	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-62.2	-47.1	175.1	-172.6	60.1	50.4	0	0	110.8	M316 A317 L318 L322 I323 D324	M316-Q320 WeakPolarHBondContact O-CB 3.28Å; M316-Q320 PolarHBondContact O-N 3.36Å; A317-Q320 PolarHBondContact O-N 2.92Å; L318-Q320 VanDerWaalsContact C-N 3.34Å; L318-Q320 PolarHBondContact O-N 3.26Å; Q320-L322 VanDerWaalsContact C-N 3.31Å; Q320-L322 PolarHBondContact O-N 3.22Å; Q320-I323 PolarHBondContact O-N 3.15Å; Q320-I323 VanDerWaalsContact O-N 3.15Å; Q320-D324 PolarHBondContact NE2-OD1 3.41Å; Q320-D324 PolarHBondContact O-N 3.14Å
321	M	97.6	Very high	96.4	Very high	38 Å²	38	56.8 Å²	56.8	19%	0.187	29%	0.29	C	S	.	.	H	α-helix	trans	-56.3	-44.7	176	-176.8	-164.2	80.6	0	0	111.9	N290 L294 A317 L318 D324 Q325	N290-M321 HydrophobicContact CB-CE 4.22Å; N290-M321 HydrophobicContact CB-SD 3.72Å; N290-M321 VanDerWaalsContact CG-SD 3.51Å; L294-M321 HydrophobicContact CD1-CE 4.14Å; L294-M321 HydrophobicContact CD1-SD 4.48Å; L294-M321 HydrophobicContact CD2-CE 4.04Å; L294-M321 HydrophobicContact CG-CE 4Å; A317-M321 WeakPolarHBondContact O-CB 3.33Å; A317-M321 PolarHBondContact O-N 3.46Å; L318-M321 HydrophobicContact CD1-CE 3.47Å; L318-M321 VanDerWaalsContact CD1-CE 3.47Å; L318-M321 HydrophobicContact CD1-SD 4.46Å; L318-M321 PolarHBondContact O-N 3.43Å; M321-D324 PolarHBondContact O-N 3Å; M321-Q325 WeakPolarHBondContact O-CG 3.48Å; M321-Q325 PolarHBondContact O-N 3.09Å
322	L	98	Very high	96.4	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-63.1	-41.8	177.8	-71.3	169.8	0	0	0	112	L294 L297 I307 L318 N319 Q320 Q325 Q326 F327 I355 V357	L294-L322 HydrophobicContact CD2-CD2 4Å; L297-L322 HydrophobicContact CD1-CD2 3.55Å; I307-L322 HydrophobicContact CD1-CD1 3.94Å; L318-L322 HydrophobicContact CG-CD1 4.29Å; L318-L322 WeakPolarHBondContact O-CG 3.48Å; L318-L322 PolarHBondContact O-N 2.9Å; N319-L322 PolarHBondContact O-N 3.16Å; Q320-L322 VanDerWaalsContact C-N 3.31Å; Q320-L322 PolarHBondContact O-N 3.22Å; L322-Q325 CarbonylContact O-C 3.53Å; L322-Q325 PolarHBondContact O-N 3.31Å; L322-Q326 PolarHBondContact O-N 3.24Å; L322-F327 HydrophobicContact CB-CB 4.2Å; L322-F327 HydrophobicContact CD2-CB 4.49Å; L322-F327 HydrophobicContact CD2-CD2 4.02Å; L322-F327 HydrophobicContact CD2-CG 4.35Å; L322-F327 WeakPolarHBondContact O-CB 3.36Å; L322-F327 PolarHBondContact O-N 3.44Å; L322-I355 HydrophobicContact CD1-CG2 4.07Å; L322-V357 HydrophobicContact CD1-CG2 3.61Å
323	I	97.4	Very high	96.3	Very high	72 Å²	72	54.3 Å²	54.3	37%	0.369	27%	0.274	S	S	.	.	H	α-helix	trans	-63.9	-41.7	175.6	-69.8	168.9	0	0	0	111.1	N319 Q320 Q325 Q326	N319-I323 WeakPolarHBondContact ND2-CD1 3.32Å; N319-I323 VanDerWaalsContact O-CG1 3.3Å; N319-I323 WeakPolarHBondContact O-CG1 3.46Å; N319-I323 PolarHBondContact O-N 2.9Å; Q320-I323 PolarHBondContact O-N 3.15Å; Q320-I323 VanDerWaalsContact O-N 3.15Å; I323-Q325 PolarHBondContact O-N 3.49Å; I323-Q326 WeakPolarHBondContact O-CA 3.14Å; I323-Q326 PolarHBondContact O-N 3.08Å
324	D	97.2	Very high	95.9	Very high	101 Å²	101	55.2 Å²	55.2	54%	0.54	27%	0.271	S	S	.	.	H	α-helix	trans	-64.2	-31.6	177.8	-63.1	-18.3	0	0	0	111.6	Q320 M321 Q326	Q320-D324 PolarHBondContact NE2-OD1 3.41Å; Q320-D324 PolarHBondContact O-N 3.14Å; M321-D324 PolarHBondContact O-N 3Å; D324-Q326 PolarHBondContact O-N 3.35Å
325	Q	95.6	Very high	95.6	Very high	112 Å²	112	57.4 Å²	57.4	52%	0.523	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	13.4	170.6	-61.8	-55.2	-66.7	0	0	113.3	L294 M321 L322 I323 F327	L294-Q325 HydrophobicContact CD1-CG 4.14Å; L294-Q325 HydrophobicContact CD2-CB 4.26Å; L294-Q325 HydrophobicContact CD2-CG 4.01Å; M321-Q325 WeakPolarHBondContact O-CG 3.48Å; M321-Q325 PolarHBondContact O-N 3.09Å; L322-Q325 CarbonylContact O-C 3.53Å; L322-Q325 PolarHBondContact O-N 3.31Å; I323-Q325 PolarHBondContact O-N 3.49Å; Q325-F327 HydrophobicContact CB-CD2 3.83Å; Q325-F327 HydrophobicContact CB-CE2 4.01Å; Q325-F327 PolarHBondContact O-N 2.94Å
326	Q	94.8	Very high	95.4	Very high	178 Å²	178	58.2 Å²	58.2	83%	0.832	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.5	14.8	176.9	-53.8	178	-1.6	0	0	115.7	L322 I323 D324	L322-Q326 PolarHBondContact O-N 3.24Å; I323-Q326 WeakPolarHBondContact O-CA 3.14Å; I323-Q326 PolarHBondContact O-N 3.08Å; D324-Q326 PolarHBondContact O-N 3.35Å
327	F	96.1	Very high	95.1	Very high	32 Å²	32	56.3 Å²	56.3	14%	0.14	29%	0.292	C	S	.	.			trans	-72.4	138.1	170.3	-71.2	-81.9	0	0	0	110.7	L294 L297 D298 L322 Q325 S329 I355	L294-F327 HydrophobicContact CD2-CD2 4.23Å; L294-F327 HydrophobicContact CD2-CE2 3.71Å; L297-F327 HydrophobicContact CB-CE1 3.82Å; L297-F327 HydrophobicContact CB-CZ 3.84Å; L297-F327 HydrophobicContact CD1-CE1 4.5Å; D298-F327 WeakPolarHBondContact OD1-CZ 3.24Å; L322-F327 HydrophobicContact CB-CB 4.2Å; L322-F327 HydrophobicContact CD2-CB 4.49Å; L322-F327 HydrophobicContact CD2-CD2 4.02Å; L322-F327 HydrophobicContact CD2-CG 4.35Å; L322-F327 WeakPolarHBondContact O-CB 3.36Å; L322-F327 PolarHBondContact O-N 3.44Å; Q325-F327 HydrophobicContact CB-CD2 3.83Å; Q325-F327 HydrophobicContact CB-CE2 4.01Å; Q325-F327 PolarHBondContact O-N 2.94Å; F327-S329 PolarHBondContact O-N 2.89Å; F327-I355 HydrophobicContact CB-CD1 3.93Å; F327-I355 HydrophobicContact CD1-CD1 3.73Å; F327-I355 HydrophobicContact CG-CD1 4.04Å
328	P	95.3	Very high	94.7	Very high	53 Å²	53	53.5 Å²	53.5	34%	0.344	27%	0.268	S	S	.	.			trans	-75.6	70.3	175.9	32.7	-36.5	0	0	0	110.7	K353 R354 I355	P328-K353 HydrophobicContact CB-CD 4.47Å; P328-R354 HydrophobicContact CG-CB 4.01Å; P328-R354 HydrophobicContact CG-CG 4.26Å; P328-R354 PolarHBondContact O-N 3.08Å; P328-I355 PolarHBondContact O-N 3.45Å
329	S	97.1	Very high	94.4	Very high	3 Å²	3	60.1 Å²	60.1	2%	0.021	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	150.5	-175.9	-175	0	0	0	0	112.7	N319 F327 I355	N319-S329 WeakPolarHBondContact OD1-CB 3.37Å; N319-S329 PolarHBondContact OD1-OG 2.99Å; F327-S329 PolarHBondContact O-N 2.89Å; S329-I355 CarbonylContact C-O 3.4Å; S329-I355 VanDerWaalsContact CA-O 3.29Å; S329-I355 WeakPolarHBondContact CA-O 3.42Å
330	I	96.5	Very high	94.2	Very high	9 Å²	9	63.1 Å²	63.1	5%	0.046	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	139	171	-164.4	160.7	0	0	0	110.3	N319 R344 Q347 F348 K353 I355 L356 V357	N319-I330 VanDerWaalsContact OD1-CA 3.28Å; N319-I330 WeakPolarHBondContact OD1-CA 3.24Å; N319-I330 PolarHBondContact OD1-N 3.09Å; I330-R344 HydrophobicContact CD1-CB 3.52Å; I330-R344 HydrophobicContact CD1-CG 3.67Å; I330-R344 HydrophobicContact CG1-CB 4Å; I330-R344 HydrophobicContact CG1-CG 4.1Å; I330-Q347 HydrophobicContact CD1-CB 4.18Å; I330-F348 HydrophobicContact CG2-CB 4.27Å; I330-F348 HydrophobicContact CG2-CD2 4.36Å; I330-K353 HydrophobicContact CB-CB 4.11Å; I330-K353 HydrophobicContact CB-CD 4.45Å; I330-K353 HydrophobicContact CB-CG 3.91Å; I330-K353 HydrophobicContact CD1-CG 4.15Å; I330-K353 HydrophobicContact CG2-CB 3.82Å; I330-K353 HydrophobicContact CG2-CG 4.13Å; I330-I355 PolarHBondContact N-O 3.14Å; I330-L356 HydrophobicContact CG2-CD1 4.07Å; I330-L356 CarbonylContact O-C 3.6Å; I330-L356 WeakPolarHBondContact O-CA 3.49Å; I330-V357 PolarHBondContact O-N 2.83Å
331	A	96	Very high	93.8	Very high	3 Å²	3	58.8 Å²	58.8	3%	0.025	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	140.9	176.6	0	0	0	0	0	111.4	N319 R344 V357	N319-A331 HydrophobicContact CB-CB 3.62Å; N319-A331 PolarHBondContact OD1-N 2.87Å; A331-R344 VanDerWaalsContact O-CD 3.23Å; A331-R344 WeakPolarHBondContact O-CD 3.5Å; A331-R344 PolarHBondContact O-NH1 3.16Å; A331-V357 CarbonylContact C-O 3.58Å; A331-V357 VanDerWaalsContact CA-O 3.27Å; A331-V357 WeakPolarHBondContact CA-O 3.1Å
332	I	93.1	Very high	93.4	Very high	0 Å²	0	58.1 Å²	58.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	128.4	164.7	-42.3	169.2	0	0	0	111.9	M336 R341 R344 L356 V357 A358 T359 F362	I332-M336 HydrophobicContact CB-SD 4.43Å; I332-M336 HydrophobicContact CG2-CE 4.15Å; I332-M336 HydrophobicContact CG2-SD 3.91Å; I332-R341 HydrophobicContact CG2-CB 3.86Å; I332-R341 HydrophobicContact CG2-CG 3.71Å; I332-R344 HydrophobicContact CD1-CB 3.99Å; I332-R344 HydrophobicContact CG1-CB 3.84Å; I332-L356 HydrophobicContact CB-CD1 4.21Å; I332-L356 HydrophobicContact CD1-CD1 3.58Å; I332-L356 HydrophobicContact CG1-CD1 3.58Å; I332-V357 PolarHBondContact N-O 2.92Å; I332-A358 WeakPolarHBondContact O-CA 3.4Å; I332-T359 PolarHBondContact O-N 3.39Å; I332-F362 HydrophobicContact CB-CD2 4.31Å; I332-F362 HydrophobicContact CB-CE1 4Å; I332-F362 HydrophobicContact CB-CE2 3.41Å; I332-F362 VanDerWaalsContact CB-CE2 3.41Å; I332-F362 HydrophobicContact CB-CZ 3.28Å; I332-F362 HydrophobicContact CD1-CE1 3.52Å; I332-F362 HydrophobicContact CD1-CZ 3.56Å; I332-F362 HydrophobicContact CG1-CE1 4.33Å; I332-F362 HydrophobicContact CG1-CZ 4Å; I332-F362 HydrophobicContact CG2-CE1 4.19Å; I332-F362 HydrophobicContact CG2-CE2 3.33Å; I332-F362 HydrophobicContact CG2-CZ 3.12Å
333	H	92.3	Very high	93.1	Very high	16 Å²	16	60.4 Å²	60.4	7%	0.074	31%	0.308	C	S	.	.			trans	-148.3	166.2	-176	59.1	65.5	0	0	0	112.5	V312 C315 M316 N335 M336 T359	V312-H333 HydrophobicContact CG1-CB 4.13Å; V312-H333 HydrophobicContact CG2-CB 4.26Å; C315-H333 HydrophobicContact CB-CB 4.49Å; M316-H333 WeakPolarHBondContact CG-NE2 3.41Å; H333-N335 VanDerWaalsContact C-N 3.3Å; H333-N335 PolarHBondContact ND1-N 2.98Å; H333-N335 PolarHBondContact O-N 3.05Å; H333-M336 VanDerWaalsContact CE1-CG 3.45Å; H333-M336 WeakPolarHBondContact CE1-CG 3.48Å; H333-M336 PolarHBondContact O-N 2.77Å; H333-T359 HydrophobicContact CB-CG2 4.06Å
334	R	86.9	Confident	92.9	Very high	182 Å²	182	60 Å²	60	69%	0.687	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.1	-172.5	71.2	-175.1	-177	-160.3	0.8	116	V312 M336 L361	V312-R334 HydrophobicContact CG2-CG 3.84Å; R334-M336 PolarHBondContact O-N 3.08Å; R334-L361 HydrophobicContact CB-CD2 3.83Å
335	N	90.3	Very high	92.5	Very high	118 Å²	118	55.5 Å²	55.5	63%	0.631	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.1	-5.8	-179.1	-68.8	10.4	0	0	0	113.9	V312 H333	V312-N335 HydrophobicContact CG1-CB 4.3Å; H333-N335 VanDerWaalsContact C-N 3.3Å; H333-N335 PolarHBondContact ND1-N 2.98Å; H333-N335 PolarHBondContact O-N 3.05Å
336	M	91.2	Very high	92.1	Very high	17 Å²	17	53 Å²	53	8%	0.084	27%	0.265	C	S	.	.	S	Bend	trans	-80.2	150.8	177.7	-71.3	164.3	65	0	0	111.3	I332 H333 R334 E340 R341 R344	I332-M336 HydrophobicContact CB-SD 4.43Å; I332-M336 HydrophobicContact CG2-CE 4.15Å; I332-M336 HydrophobicContact CG2-SD 3.91Å; H333-M336 VanDerWaalsContact CE1-CG 3.45Å; H333-M336 WeakPolarHBondContact CE1-CG 3.48Å; H333-M336 PolarHBondContact O-N 2.77Å; R334-M336 PolarHBondContact O-N 3.08Å; M336-E340 HydrophobicContact CE-CB 4.12Å; M336-E340 HydrophobicContact CE-CG 3.64Å; M336-R341 HydrophobicContact CB-CG 3.5Å; M336-R341 HydrophobicContact CE-CG 4.1Å; M336-R341 HydrophobicContact SD-CG 4.34Å; M336-R344 HydrophobicContact CE-CB 4.46Å; M336-R344 VanDerWaalsContact CE-CD 3.4Å; M336-R344 HydrophobicContact CE-CG 3.9Å; M336-R344 VanDerWaalsContact CE-NE 3.25Å
337	A	91.7	Very high	92.1	Very high	64 Å²	64	47.6 Å²	47.6	53%	0.529	24%	0.24	S	C	.	.			trans	-61.1	147.3	169.5	0	0	0	0	0	110.7	E339 E340 R341	A337-E339 VanDerWaalsContact C-N 3.33Å; A337-E339 PolarHBondContact O-N 3.3Å; A337-E340 HydrophobicContact CB-CB 4.37Å; A337-E340 WeakPolarHBondContact O-CB 3.25Å; A337-E340 PolarHBondContact O-N 3.02Å; A337-E340 VanDerWaalsContact O-N 3.14Å; A337-R341 WeakPolarHBondContact O-CG 3.38Å; A337-R341 PolarHBondContact O-N 2.97Å
338	Q	89	Confident	91.8	Very high	5 Å²	5	46.1 Å²	46.1	2%	0.023	23%	0.234	C	C	.	.	H	α-helix	trans	-61.5	-41.3	-174.1	-172.2	58.3	39.2	0	0	112.6	R127 E128 F153 T156 E340 R341 L342	R127-Q338 VanDerWaalsContact NH1-OE1 3.16Å; E128-Q338 PolarHBondContact OE1-NE2 3.48Å; F153-Q338 HydrophobicContact CD2-CG 4.12Å; F153-Q338 HydrophobicContact CE2-CG 3.59Å; T156-Q338 HydrophobicContact CG2-CB 4.5Å; T156-Q338 HydrophobicContact CG2-CG 4.21Å; Q338-E340 VanDerWaalsContact C-N 3.32Å; Q338-E340 PolarHBondContact O-N 3.32Å; Q338-R341 PolarHBondContact O-N 3.04Å; Q338-L342 HydrophobicContact CG-CD1 4.47Å; Q338-L342 WeakPolarHBondContact O-CG 3.48Å; Q338-L342 PolarHBondContact O-N 3.46Å
339	E	90.4	Very high	91.4	Very high	145 Å²	145	47.7 Å²	47.7	68%	0.678	23%	0.233	S	C	*	.	H	α-helix	trans	-61.4	-41.1	176.7	-66	-178.5	170.1	0	0	111.6	A337 L342 A343	A337-E339 VanDerWaalsContact C-N 3.33Å; A337-E339 PolarHBondContact O-N 3.3Å; E339-L342 PolarHBondContact O-N 3.17Å; E339-A343 WeakPolarHBondContact O-CB 3.42Å; E339-A343 PolarHBondContact O-N 2.99Å
340	E	93	Very high	91	Very high	79 Å²	79	51.6 Å²	51.6	37%	0.369	25%	0.253	S	S	.	.	H	α-helix	trans	-65.1	-42.3	176.4	-165.8	-168.8	169	0	0	111.5	M336 A337 Q338 L342 A343 R344	M336-E340 HydrophobicContact CE-CB 4.12Å; M336-E340 HydrophobicContact CE-CG 3.64Å; A337-E340 HydrophobicContact CB-CB 4.37Å; A337-E340 WeakPolarHBondContact O-CB 3.25Å; A337-E340 PolarHBondContact O-N 3.02Å; A337-E340 VanDerWaalsContact O-N 3.14Å; Q338-E340 VanDerWaalsContact C-N 3.32Å; Q338-E340 PolarHBondContact O-N 3.32Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 3.07Å; E340-A343 PolarHBondContact O-N 3.37Å; E340-R344 WeakPolarHBondContact O-CG 3.43Å; E340-R344 PolarHBondContact O-N 3.48Å; E340-R344 IonicContact OE1-CZ 3.87Å; E340-R344 VanDerWaalsContact OE1-CZ 3.26Å; E340-R344 IonicContact OE1-NE 3.62Å; E340-R344 PolarHBondContact OE1-NE 3.16Å; E340-R344 VanDerWaalsContact OE1-NE 3.17Å; E340-R344 IonicContact OE1-NH2 2.95Å; E340-R344 PolarHBondContact OE1-NH2 3.39Å
341	R	90.6	Very high	90.7	Very high	8 Å²	8	54.9 Å²	54.9	3%	0.03	27%	0.267	C	S	.	.	H	α-helix	trans	-59.5	-45.1	177	-67	175.3	63.3	-140.2	-6.8	111.5	E128 I332 M336 A337 Q338 Y345	E128-R341 VanDerWaalsContact CD-CZ 3.46Å; E128-R341 IonicContact OE1-CZ 3.97Å; E128-R341 IonicContact OE1-NE 2.74Å; E128-R341 IonicContact OE1-NH1 3.55Å; E128-R341 PolarHBondContact OE1-NH1 3.5Å; E128-R341 IonicContact OE1-NH2 3.84Å; E128-R341 PolarHBondContact OE1-NH2 2.93Å; E128-R341 IonicContact OE2-CZ 3.72Å; E128-R341 IonicContact OE2-NH1 3.75Å; E128-R341 IonicContact OE2-NH2 2.8Å; E128-R341 PolarHBondContact OE2-NH2 3.49Å; I332-R341 HydrophobicContact CG2-CB 3.86Å; I332-R341 HydrophobicContact CG2-CG 3.71Å; M336-R341 HydrophobicContact CB-CG 3.5Å; M336-R341 HydrophobicContact CE-CG 4.1Å; M336-R341 HydrophobicContact SD-CG 4.34Å; A337-R341 WeakPolarHBondContact O-CG 3.38Å; A337-R341 PolarHBondContact O-N 2.97Å; Q338-R341 PolarHBondContact O-N 3.04Å; R341-Y345 VanDerWaalsContact O-CB 3.32Å; R341-Y345 WeakPolarHBondContact O-CB 3.25Å; R341-Y345 PolarHBondContact O-N 2.94Å
342	L	88.8	Confident	90.5	Very high	24 Å²	24	60.4 Å²	60.4	13%	0.126	29%	0.293	C	S	.	.	H	α-helix	trans	-66.8	-41.1	177.6	-67.6	174.9	0	0	0	111.7	F131 F153 Q338 E339 E340 Y345 Q346	F131-L342 HydrophobicContact CB-CD2 4.02Å; F131-L342 HydrophobicContact CD1-CD2 3.87Å; F131-L342 HydrophobicContact CD2-CD1 4.16Å; F131-L342 HydrophobicContact CD2-CD2 4.36Å; F131-L342 HydrophobicContact CE1-CD2 4.43Å; F131-L342 HydrophobicContact CE2-CD1 4.46Å; F131-L342 HydrophobicContact CG-CD1 4.42Å; F131-L342 HydrophobicContact CG-CD2 3.82Å; F153-L342 HydrophobicContact CE2-CD1 4.32Å; F153-L342 HydrophobicContact CZ-CD1 3.87Å; Q338-L342 HydrophobicContact CG-CD1 4.47Å; Q338-L342 WeakPolarHBondContact O-CG 3.48Å; Q338-L342 PolarHBondContact O-N 3.46Å; E339-L342 PolarHBondContact O-N 3.17Å; E340-L342 VanDerWaalsContact C-N 3.34Å; E340-L342 PolarHBondContact O-N 3.07Å; L342-Y345 WeakPolarHBondContact O-CB 3.44Å; L342-Y345 PolarHBondContact O-N 3.38Å; L342-Q346 WeakPolarHBondContact O-CB 3.23Å; L342-Q346 PolarHBondContact O-N 3.07Å
343	A	92.4	Very high	90.6	Very high	47 Å²	47	63.6 Å²	63.6	39%	0.388	31%	0.307	S	S	.	.	H	α-helix	trans	-62.2	-46	176.2	0	0	0	0	0	111.9	E339 E340 Y345 Q346 Q347	E339-A343 WeakPolarHBondContact O-CB 3.42Å; E339-A343 PolarHBondContact O-N 2.99Å; E340-A343 PolarHBondContact O-N 3.37Å; A343-Y345 VanDerWaalsContact C-N 3.34Å; A343-Q346 PolarHBondContact O-N 3.08Å; A343-Q347 WeakPolarHBondContact O-CG 3.3Å; A343-Q347 PolarHBondContact O-N 3.37Å
344	R	92.7	Very high	90.7	Very high	64 Å²	64	67.3 Å²	67.3	24%	0.242	32%	0.32	C	S	.	.	H	α-helix	trans	-65.9	-37.3	176.6	-67.3	-155.3	-165	-173.1	-5.1	112.3	I330 A331 I332 M336 E340 Q346 Q347 F348	I330-R344 HydrophobicContact CD1-CB 3.52Å; I330-R344 HydrophobicContact CD1-CG 3.67Å; I330-R344 HydrophobicContact CG1-CB 4Å; I330-R344 HydrophobicContact CG1-CG 4.1Å; A331-R344 VanDerWaalsContact O-CD 3.23Å; A331-R344 WeakPolarHBondContact O-CD 3.5Å; A331-R344 PolarHBondContact O-NH1 3.16Å; I332-R344 HydrophobicContact CD1-CB 3.99Å; I332-R344 HydrophobicContact CG1-CB 3.84Å; M336-R344 HydrophobicContact CE-CB 4.46Å; M336-R344 VanDerWaalsContact CE-CD 3.4Å; M336-R344 HydrophobicContact CE-CG 3.9Å; M336-R344 VanDerWaalsContact CE-NE 3.25Å; E340-R344 WeakPolarHBondContact O-CG 3.43Å; E340-R344 PolarHBondContact O-N 3.48Å; E340-R344 IonicContact OE1-CZ 3.87Å; E340-R344 VanDerWaalsContact OE1-CZ 3.26Å; E340-R344 IonicContact OE1-NE 3.62Å; E340-R344 PolarHBondContact OE1-NE 3.16Å; E340-R344 VanDerWaalsContact OE1-NE 3.17Å; E340-R344 IonicContact OE1-NH2 2.95Å; E340-R344 PolarHBondContact OE1-NH2 3.39Å; R344-Q346 VanDerWaalsContact C-N 3.35Å; R344-Q347 PolarHBondContact O-N 2.87Å; R344-F348 PolarHBondContact O-N 3.05Å
345	Y	88.7	Confident	91.1	Very high	6 Å²	6	58.7 Å²	58.7	2%	0.024	29%	0.287	C	S	.	.	H	α-helix	trans	-61.2	-45.5	172.9	171.8	-121.6	0	0	0	111.5	R341 L342 A343 Q347 F348 R349 M366 D367 I368	R341-Y345 VanDerWaalsContact O-CB 3.32Å; R341-Y345 WeakPolarHBondContact O-CB 3.25Å; R341-Y345 PolarHBondContact O-N 2.94Å; L342-Y345 WeakPolarHBondContact O-CB 3.44Å; L342-Y345 PolarHBondContact O-N 3.38Å; A343-Y345 VanDerWaalsContact C-N 3.34Å; Y345-Q347 VanDerWaalsContact C-N 3.34Å; Y345-Q347 PolarHBondContact O-N 3.38Å; Y345-F348 WeakPolarHBondContact O-CB 3.43Å; Y345-F348 PolarHBondContact O-N 3.44Å; Y345-F348 VanDerWaalsContact O-N 3.15Å; Y345-R349 PolarHBondContact O-N 3.01Å; Y345-M366 HydrophobicContact CD1-CE 4.01Å; Y345-M366 HydrophobicContact CD2-CE 2.97Å; Y345-M366 HydrophobicContact CE1-CE 4.05Å; Y345-M366 HydrophobicContact CE2-CE 3.02Å; Y345-M366 HydrophobicContact CG-CE 3.47Å; Y345-M366 VanDerWaalsContact CG-CE 3.47Å; Y345-D367 PolarHBondContact OH-O 3.46Å; Y345-I368 HydrophobicContact CE2-CD1 3.91Å; Y345-I368 HydrophobicContact CE2-CG1 3.96Å
346	Q	88.4	Confident	91.4	Very high	60 Å²	60	53.1 Å²	53.1	28%	0.28	26%	0.258	S	S	.	.	H	α-helix	trans	-62.4	-41	177.7	-169	60.7	46.5	0	0	111.5	L342 A343 R344 F348 R349 D350	L342-Q346 WeakPolarHBondContact O-CB 3.23Å; L342-Q346 PolarHBondContact O-N 3.07Å; A343-Q346 PolarHBondContact O-N 3.08Å; R344-Q346 VanDerWaalsContact C-N 3.35Å; Q346-F348 VanDerWaalsContact C-N 3.3Å; Q346-F348 PolarHBondContact O-N 3.41Å; Q346-R349 PolarHBondContact O-N 3.47Å; Q346-D350 WeakPolarHBondContact CG-OD2 3.49Å; Q346-D350 PolarHBondContact NE2-OD1 2.85Å; Q346-D350 PolarHBondContact NE2-OD2 3.11Å; Q346-D350 WeakPolarHBondContact O-CB 3.24Å; Q346-D350 VanDerWaalsContact O-CG 3.23Å; Q346-D350 PolarHBondContact O-N 3.27Å
347	Q	93.1	Very high	91.6	Very high	65 Å²	65	52.3 Å²	52.3	30%	0.304	25%	0.254	S	S	.	.	H	α-helix	trans	-59.4	-39.8	173.6	-68.9	173.6	35.9	0	0	112.7	I330 A343 R344 Y345 Q352 K353	I330-Q347 HydrophobicContact CD1-CB 4.18Å; A343-Q347 WeakPolarHBondContact O-CG 3.3Å; A343-Q347 PolarHBondContact O-N 3.37Å; R344-Q347 PolarHBondContact O-N 2.87Å; Y345-Q347 VanDerWaalsContact C-N 3.34Å; Y345-Q347 PolarHBondContact O-N 3.38Å; Q347-Q352 HydrophobicContact CB-CB 4.35Å; Q347-Q352 VanDerWaalsContact O-CB 3.3Å; Q347-Q352 WeakPolarHBondContact O-CB 3.29Å; Q347-Q352 PolarHBondContact O-N 3.15Å; Q347-K353 PolarHBondContact O-N 2.7Å
348	F	91.4	Very high	91.7	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-68.1	-46.8	174.4	-174.8	-111.8	0	0	0	110.9	Q304 V306 I330 R344 Y345 Q346 D350 F351 K353 L356 I368 V371	Q304-F348 HydrophobicContact CB-CE2 4.07Å; Q304-F348 HydrophobicContact CB-CZ 3.8Å; Q304-F348 HydrophobicContact CG-CE2 4.49Å; Q304-F348 HydrophobicContact CG-CZ 4.5Å; Q304-F348 PolarHBondContact NE2-O 3.29Å; V306-F348 HydrophobicContact CG2-CE1 4.08Å; V306-F348 HydrophobicContact CG2-CZ 4.03Å; I330-F348 HydrophobicContact CG2-CB 4.27Å; I330-F348 HydrophobicContact CG2-CD2 4.36Å; R344-F348 PolarHBondContact O-N 3.05Å; Y345-F348 WeakPolarHBondContact O-CB 3.43Å; Y345-F348 PolarHBondContact O-N 3.44Å; Y345-F348 VanDerWaalsContact O-N 3.15Å; Q346-F348 VanDerWaalsContact C-N 3.3Å; Q346-F348 PolarHBondContact O-N 3.41Å; F348-D350 VanDerWaalsContact C-N 3.3Å; F348-D350 PolarHBondContact O-N 2.91Å; F348-F351 PolarHBondContact O-N 2.91Å; F348-K353 HydrophobicContact CD2-CB 4.4Å; F348-K353 VanDerWaalsContact CD2-O 3.25Å; F348-K353 WeakPolarHBondContact CD2-O 3.25Å; F348-L356 HydrophobicContact CD1-CB 4.05Å; F348-L356 HydrophobicContact CD1-CD2 3.89Å; F348-L356 HydrophobicContact CD2-CB 3.73Å; F348-L356 HydrophobicContact CE1-CB 3.82Å; F348-L356 HydrophobicContact CE1-CD2 3.92Å; F348-L356 HydrophobicContact CE2-CB 3.52Å; F348-L356 HydrophobicContact CG-CB 3.99Å; F348-L356 HydrophobicContact CG-CD2 4.41Å; F348-L356 HydrophobicContact CZ-CB 3.55Å; F348-L356 HydrophobicContact CZ-CD2 4.5Å; F348-I368 HydrophobicContact CD1-CD1 3.76Å; F348-I368 HydrophobicContact CD1-CG2 4.11Å; F348-I368 HydrophobicContact CE1-CD1 3.54Å; F348-I368 HydrophobicContact CE1-CG2 3.78Å; F348-V371 HydrophobicContact CE1-CG2 3.92Å; F348-V371 HydrophobicContact CZ-CG2 4.01Å
349	R	85.8	Confident	91.8	Very high	87 Å²	87	49.4 Å²	49.4	33%	0.328	23%	0.23	S	C	.	.	H	α-helix	trans	-58.3	-40.7	177.7	-172.9	-176.8	179.9	-172	4.8	112.5	Y345 Q346 F351	Y345-R349 PolarHBondContact O-N 3.01Å; Q346-R349 PolarHBondContact O-N 3.47Å; R349-F351 PolarHBondContact O-N 3.33Å
350	D	88.6	Confident	91.1	Very high	84 Å²	84	44.5 Å²	44.5	45%	0.449	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.7	12.7	179.5	-64.3	-19.9	0	0	0	113.1	Q346 F348 Q352	Q346-D350 WeakPolarHBondContact CG-OD2 3.49Å; Q346-D350 PolarHBondContact NE2-OD1 2.85Å; Q346-D350 PolarHBondContact NE2-OD2 3.11Å; Q346-D350 WeakPolarHBondContact O-CB 3.24Å; Q346-D350 VanDerWaalsContact O-CG 3.23Å; Q346-D350 PolarHBondContact O-N 3.27Å; F348-D350 VanDerWaalsContact C-N 3.3Å; F348-D350 PolarHBondContact O-N 2.91Å; D350-Q352 HydrophobicContact CB-CG 4.2Å; D350-Q352 PolarHBondContact O-N 3.17Å; D350-Q352 VanDerWaalsContact O-N 3.08Å
351	F	89.4	Confident	89.9	Confident	78 Å²	78	43.3 Å²	43.3	34%	0.342	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	15.1	176.8	-151.4	-99.7	0	0	0	114.8	N303 Q304 F348 R349 K353 R354	N303-F351 HydrophobicContact CB-CE2 4.42Å; Q304-F351 HydrophobicContact CG-CD2 3.68Å; Q304-F351 HydrophobicContact CG-CE2 3.51Å; F348-F351 PolarHBondContact O-N 2.91Å; R349-F351 PolarHBondContact O-N 3.33Å; F351-K353 PolarHBondContact O-N 3.02Å; F351-R354 HydrophobicContact CE1-CG 4.16Å; F351-R354 HydrophobicContact CZ-CG 4.08Å
352	Q	93.6	Very high	88.7	Confident	120 Å²	120	43.1 Å²	43.1	56%	0.561	20%	0.204	S	C	*	.	S	Bend	trans	-69.3	-23.7	174.7	-53.7	-179.7	14.5	0	0	111.5	Q347 D350	Q347-Q352 HydrophobicContact CB-CB 4.35Å; Q347-Q352 VanDerWaalsContact O-CB 3.3Å; Q347-Q352 WeakPolarHBondContact O-CB 3.29Å; Q347-Q352 PolarHBondContact O-N 3.15Å; D350-Q352 HydrophobicContact CB-CG 4.2Å; D350-Q352 PolarHBondContact O-N 3.17Å; D350-Q352 VanDerWaalsContact O-N 3.08Å
353	K	94	Very high	87.2	Confident	67 Å²	67	42 Å²	42	29%	0.291	20%	0.198	S	C	.	.			trans	-130.6	137.5	174.9	-60.9	-69.9	-178.7	-178.3	0	108.8	Q304 P328 I330 Q347 F348 F351	Q304-K353 PolarHBondContact NE2-O 3.05Å; P328-K353 HydrophobicContact CB-CD 4.47Å; I330-K353 HydrophobicContact CB-CB 4.11Å; I330-K353 HydrophobicContact CB-CD 4.45Å; I330-K353 HydrophobicContact CB-CG 3.91Å; I330-K353 HydrophobicContact CD1-CG 4.15Å; I330-K353 HydrophobicContact CG2-CB 3.82Å; I330-K353 HydrophobicContact CG2-CG 4.13Å; Q347-K353 PolarHBondContact O-N 2.7Å; F348-K353 HydrophobicContact CD2-CB 4.4Å; F348-K353 VanDerWaalsContact CD2-O 3.25Å; F348-K353 WeakPolarHBondContact CD2-O 3.25Å; F351-K353 PolarHBondContact O-N 3.02Å
354	R	94	Very high	86.1	Confident	94 Å²	94	40.8 Å²	40.8	36%	0.355	18%	0.183	S	C	.	.	S	Bend	trans	-100.6	-17.9	-178	-63	176.9	65.4	-174.2	7.7	112.8	F302 N303 Q304 V305 P328 F351	F302-R354 HydrophobicContact CE2-CB 4.26Å; F302-R354 PolarHBondContact O-NH2 2.78Å; N303-R354 PolarHBondContact O-NE 2.98Å; Q304-R354 CarbonylContact C-O 3.56Å; Q304-R354 WeakPolarHBondContact CA-O 3.28Å; V305-R354 PolarHBondContact N-O 3.26Å; P328-R354 HydrophobicContact CG-CB 4.01Å; P328-R354 HydrophobicContact CG-CG 4.26Å; P328-R354 PolarHBondContact O-N 3.08Å; F351-R354 HydrophobicContact CE1-CG 4.16Å; F351-R354 HydrophobicContact CZ-CG 4.08Å
355	I	96.2	Very high	84.5	Confident	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	125.7	178.1	-52.8	-174.2	0	0	0	109.6	L297 F302 V305 I307 L322 F327 P328 S329 I330	L297-I355 HydrophobicContact CD1-CD1 3.91Å; L297-I355 HydrophobicContact CD2-CD1 3.95Å; F302-I355 HydrophobicContact CE2-CD1 4.36Å; F302-I355 HydrophobicContact CE2-CG1 4.1Å; F302-I355 HydrophobicContact CZ-CD1 4.01Å; F302-I355 HydrophobicContact CZ-CG1 4.26Å; V305-I355 HydrophobicContact CB-CG1 4.33Å; V305-I355 HydrophobicContact CB-CG2 4.41Å; V305-I355 WeakPolarHBondContact O-CA 3.12Å; I307-I355 HydrophobicContact CD1-CG2 3.52Å; I307-I355 HydrophobicContact CG1-CG2 4.03Å; L322-I355 HydrophobicContact CD1-CG2 4.07Å; F327-I355 HydrophobicContact CB-CD1 3.93Å; F327-I355 HydrophobicContact CD1-CD1 3.73Å; F327-I355 HydrophobicContact CG-CD1 4.04Å; P328-I355 PolarHBondContact O-N 3.45Å; S329-I355 CarbonylContact C-O 3.4Å; S329-I355 VanDerWaalsContact CA-O 3.29Å; S329-I355 WeakPolarHBondContact CA-O 3.42Å; I330-I355 PolarHBondContact N-O 3.14Å
356	L	95.3	Very high	83.5	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.005	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	116.8	172.4	170.9	60.8	0	0	0	109.4	V305 V306 I307 I330 I332 F348 A358 F362 I368	V305-L356 PolarHBondContact O-N 2.9Å; V306-L356 CarbonylContact C-O 3.44Å; V306-L356 WeakPolarHBondContact CA-O 3.46Å; V306-L356 HydrophobicContact CG1-CD2 4.44Å; V306-L356 HydrophobicContact CG2-CB 4.4Å; V306-L356 HydrophobicContact CG2-CD2 4.36Å; I307-L356 PolarHBondContact N-O 3.35Å; I330-L356 HydrophobicContact CG2-CD1 4.07Å; I330-L356 CarbonylContact O-C 3.6Å; I330-L356 WeakPolarHBondContact O-CA 3.49Å; I332-L356 HydrophobicContact CB-CD1 4.21Å; I332-L356 HydrophobicContact CD1-CD1 3.58Å; I332-L356 HydrophobicContact CG1-CD1 3.58Å; F348-L356 HydrophobicContact CD1-CB 4.05Å; F348-L356 HydrophobicContact CD1-CD2 3.89Å; F348-L356 HydrophobicContact CD2-CB 3.73Å; F348-L356 HydrophobicContact CE1-CB 3.82Å; F348-L356 HydrophobicContact CE1-CD2 3.92Å; F348-L356 HydrophobicContact CE2-CB 3.52Å; F348-L356 HydrophobicContact CG-CB 3.99Å; F348-L356 HydrophobicContact CG-CD2 4.41Å; F348-L356 HydrophobicContact CZ-CB 3.55Å; F348-L356 HydrophobicContact CZ-CD2 4.5Å; L356-A358 HydrophobicContact CD1-CB 4.46Å; L356-A358 HydrophobicContact CG-CB 4.26Å; L356-F362 HydrophobicContact CD2-CD1 4.05Å; L356-F362 HydrophobicContact CD2-CE1 4.43Å; L356-I368 HydrophobicContact CD2-CD1 4.24Å
357	V	96.5	Very high	82.3	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	124.8	168.6	-172	0	0	0	0	108.7	I307 V309 C315 L318 N319 L322 I330 A331 I332	I307-V357 HydrophobicContact CB-CG2 4.45Å; I307-V357 HydrophobicContact CD1-CG2 4.44Å; I307-V357 WeakPolarHBondContact O-CA 3.35Å; V309-V357 HydrophobicContact CG1-CG1 4.3Å; V309-V357 HydrophobicContact CG2-CG1 4.24Å; C315-V357 HydrophobicContact CB-CG1 4.41Å; C315-V357 PolarHBondContact SG-O 2.84Å; C315-V357 VanDerWaalsContact SG-O 3.39Å; L318-V357 HydrophobicContact CB-CG1 4.36Å; L318-V357 HydrophobicContact CD2-CG1 4.01Å; L318-V357 HydrophobicContact CG-CG1 4.38Å; N319-V357 HydrophobicContact CB-CB 4.29Å; N319-V357 HydrophobicContact CB-CG2 4.14Å; L322-V357 HydrophobicContact CD1-CG2 3.61Å; I330-V357 PolarHBondContact O-N 2.83Å; A331-V357 CarbonylContact C-O 3.58Å; A331-V357 VanDerWaalsContact CA-O 3.27Å; A331-V357 WeakPolarHBondContact CA-O 3.1Å; I332-V357 PolarHBondContact N-O 2.92Å
358	A	93.4	Very high	81.2	Confident	0 Å²	0	34 Å²	34	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.7	148.1	-173.4	0	0	0	0	0	114.2	I307 F308 V309 I332 L356 F362	I307-A358 PolarHBondContact O-N 2.8Å; F308-A358 WeakPolarHBondContact CA-O 3.34Å; F308-A358 HydrophobicContact CD1-CB 4.49Å; V309-A358 PolarHBondContact N-O 2.77Å; I332-A358 WeakPolarHBondContact O-CA 3.4Å; L356-A358 HydrophobicContact CD1-CB 4.46Å; L356-A358 HydrophobicContact CG-CB 4.26Å; A358-F362 HydrophobicContact CB-CB 3.58Å; A358-F362 HydrophobicContact CB-CD1 4.27Å; A358-F362 HydrophobicContact CB-CD2 3.6Å; A358-F362 HydrophobicContact CB-CG 3.52Å
359	T	90.4	Very high	80.1	Confident	9 Å²	9	38.5 Å²	38.5	6%	0.055	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	171.5	166.4	57.7	0	0	0	0	111.6	V309 V312 C315 I332 H333 L361 F362	V309-T359 HydrophobicContact CG2-CG2 4.4Å; V309-T359 WeakPolarHBondContact O-CA 3.48Å; V312-T359 HydrophobicContact CG2-CG2 4.4Å; C315-T359 HydrophobicContact CB-CG2 4.11Å; I332-T359 PolarHBondContact O-N 3.39Å; H333-T359 HydrophobicContact CB-CG2 4.06Å; T359-L361 PolarHBondContact O-N 3Å; T359-F362 PolarHBondContact O-N 3.45Å
360	N	77.2	Confident	79.6	Confident	42 Å²	42	41 Å²	41	23%	0.225	19%	0.187	C	C	.	.	G	3₁₀ helix	trans	-47.9	-22	177.3	-68.1	2.9	0	0	0	115.9	F362 G363 E381 R389	N360-F362 PolarHBondContact O-N 3.16Å; N360-G363 PolarHBondContact O-N 3.09Å; N360-E381 PolarHBondContact ND2-OE1 2.86Å; N360-E381 PolarHBondContact ND2-OE2 2.84Å; N360-R389 PolarHBondContact OD1-NH2 2.87Å
361	L	66.8	Low	79.4	Confident	53 Å²	53	37.1 Å²	37.1	28%	0.277	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-48.4	-27.3	171.3	-163.4	66.7	0	0	0	113.2	R334 T359	R334-L361 HydrophobicContact CB-CD2 3.83Å; T359-L361 PolarHBondContact O-N 3Å
362	F	65.3	Low	79.3	Confident	5 Å²	5	33.9 Å²	33.9	2%	0.022	15%	0.152	C	C	.	.	G	3₁₀ helix	trans	-99.2	-4.1	179.2	-76.7	-100.4	0	0	0	114.3	F308 I332 L356 A358 T359 N360 R364 M366	F308-F362 HydrophobicContact CE1-CB 3.8Å; I332-F362 HydrophobicContact CB-CD2 4.31Å; I332-F362 HydrophobicContact CB-CE1 4Å; I332-F362 HydrophobicContact CB-CE2 3.41Å; I332-F362 VanDerWaalsContact CB-CE2 3.41Å; I332-F362 HydrophobicContact CB-CZ 3.28Å; I332-F362 HydrophobicContact CD1-CE1 3.52Å; I332-F362 HydrophobicContact CD1-CZ 3.56Å; I332-F362 HydrophobicContact CG1-CE1 4.33Å; I332-F362 HydrophobicContact CG1-CZ 4Å; I332-F362 HydrophobicContact CG2-CE1 4.19Å; I332-F362 HydrophobicContact CG2-CE2 3.33Å; I332-F362 HydrophobicContact CG2-CZ 3.12Å; L356-F362 HydrophobicContact CD2-CD1 4.05Å; L356-F362 HydrophobicContact CD2-CE1 4.43Å; A358-F362 HydrophobicContact CB-CB 3.58Å; A358-F362 HydrophobicContact CB-CD1 4.27Å; A358-F362 HydrophobicContact CB-CD2 3.6Å; A358-F362 HydrophobicContact CB-CG 3.52Å; T359-F362 PolarHBondContact O-N 3.45Å; N360-F362 PolarHBondContact O-N 3.16Å; F362-R364 PolarHBondContact O-N 3.21Å; F362-M366 HydrophobicContact CD1-CE 3.64Å; F362-M366 HydrophobicContact CD1-SD 3.12Å; F362-M366 WeakPolarHBondContact CD1-SD 3.46Å; F362-M366 HydrophobicContact CE1-CE 3.36Å; F362-M366 HydrophobicContact CE1-SD 3.13Å; F362-M366 WeakPolarHBondContact CE1-SD 3.38Å; F362-M366 HydrophobicContact CG-SD 3.99Å; F362-M366 HydrophobicContact CZ-CE 4.43Å; F362-M366 HydrophobicContact CZ-SD 3.96Å
363	G	57.7	Low	79.2	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.01	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-31.4	-178.6	0	0	0	0	0	112	N360 H388	N360-G363 PolarHBondContact O-N 3.09Å; G363-H388 CarbonylContact O-C 3.55Å; G363-H388 VanDerWaalsContact O-C 3.3Å; G363-H388 VanDerWaalsContact O-CB 3.31Å; G363-H388 WeakPolarHBondContact O-CB 3.49Å
364	R	68.7	Low	79.2	Confident	21 Å²	21	25 Å²	25	8%	0.079	11%	0.112	C	C	.	.	S	Bend	trans	-119.4	150.8	-175.9	-72.7	-173.6	176.7	-124.4	2.9	112	E201 D203 K204 F362 M366 H388	E201-R364 WeakPolarHBondContact OE2-CB 3.33Å; E201-R364 IonicContact OE2-NH1 3.87Å; D203-R364 IonicContact OD1-NH1 3.13Å; D203-R364 IonicContact OD2-CZ 3.58Å; D203-R364 IonicContact OD2-NH1 3.54Å; D203-R364 PolarHBondContact OD2-NH1 2.65Å; D203-R364 IonicContact OD2-NH2 3.37Å; K204-R364 VanDerWaalsContact CE-NE 3.27Å; K204-R364 VanDerWaalsContact CE-NH1 3.27Å; F362-R364 PolarHBondContact O-N 3.21Å; R364-M366 PolarHBondContact O-N 3.45Å; R364-H388 HydrophobicContact CG-CB 3.89Å; R364-H388 PolarHBondContact NE-CD2 3.26Å; R364-H388 VanDerWaalsContact NE-CD2 3.25Å; R364-H388 PolarHBondContact NE-NE2 2.85Å; R364-H388 PolarHBondContact NH1-NE2 2.87Å; R364-H388 PolarHBondContact NH2-CD2 2.85Å; R364-H388 PolarHBondContact NH2-NE2 3.09Å
365	G	59.7	Low	79.3	Confident	2 Å²	2	20.5 Å²	20.5	2%	0.021	10%	0.095	C	C	.	.	S	Bend	trans	72.7	11.3	168.4	0	0	0	0	0	118.4	L129 Q132 E201	L129-G365 VanDerWaalsContact CA-O 3.24Å; L129-G365 WeakPolarHBondContact CA-O 3.37Å; L129-G365 WeakPolarHBondContact CB-O 3.32Å; L129-G365 WeakPolarHBondContact CD1-O 3.39Å; L129-G365 PolarHBondContact N-O 2.89Å; Q132-G365 PolarHBondContact OE1-O 2.92Å; E201-G365 VanDerWaalsContact OE1-CA 3.31Å; E201-G365 WeakPolarHBondContact OE1-CA 3.38Å; E201-G365 PolarHBondContact OE1-N 2.92Å
366	M	67	Low	79.3	Confident	2 Å²	2	20.5 Å²	20.5	1%	0.01	10%	0.095	C	C	.	.			trans	-125.5	114.7	178.7	-67.1	-170.1	60.5	0	0	112.8	E128 Y345 F362 R364 R392	E128-M366 HydrophobicContact CB-CG 3.7Å; E128-M366 HydrophobicContact CB-SD 3.63Å; E128-M366 HydrophobicContact CG-CG 4.44Å; E128-M366 HydrophobicContact CG-SD 3.7Å; Y345-M366 HydrophobicContact CD1-CE 4.01Å; Y345-M366 HydrophobicContact CD2-CE 2.97Å; Y345-M366 HydrophobicContact CE1-CE 4.05Å; Y345-M366 HydrophobicContact CE2-CE 3.02Å; Y345-M366 HydrophobicContact CG-CE 3.47Å; Y345-M366 VanDerWaalsContact CG-CE 3.47Å; F362-M366 HydrophobicContact CD1-CE 3.64Å; F362-M366 HydrophobicContact CD1-SD 3.12Å; F362-M366 WeakPolarHBondContact CD1-SD 3.46Å; F362-M366 HydrophobicContact CE1-CE 3.36Å; F362-M366 HydrophobicContact CE1-SD 3.13Å; F362-M366 WeakPolarHBondContact CE1-SD 3.38Å; F362-M366 HydrophobicContact CG-SD 3.99Å; F362-M366 HydrophobicContact CZ-CE 4.43Å; F362-M366 HydrophobicContact CZ-SD 3.96Å; R364-M366 PolarHBondContact O-N 3.45Å; M366-R392 VanDerWaalsContact O-CD 3.22Å; M366-R392 WeakPolarHBondContact O-CD 3.33Å; M366-R392 PolarHBondContact O-NH1 3.43Å
367	D	64.3	Low	79.4	Confident	37 Å²	37	20.9 Å²	20.9	20%	0.198	10%	0.096	C	C	.	.			trans	-92.4	118.2	177.2	-162.5	-13.8	0	0	0	111.1	Q132 Y345 R395	Q132-D367 VanDerWaalsContact CD-CB 3.48Å; Y345-D367 PolarHBondContact OH-O 3.46Å; D367-R395 IonicContact OD1-CZ 3.91Å; D367-R395 IonicContact OD1-NE 3.64Å; D367-R395 IonicContact OD1-NH1 2.8Å; D367-R395 PolarHBondContact OD1-NH1 3.07Å; D367-R395 IonicContact OD2-NH1 2.68Å; D367-R395 PolarHBondContact OD2-NH1 3.23Å
368	I	70.7	Confident	79.3	Confident	10 Å²	10	21.1 Å²	21.1	5%	0.051	10%	0.098	C	C	.	.			trans	-131.7	93.2	178.6	-41.5	-179.1	0	0	0	107.1	Y345 F348 L356 R370 V371	Y345-I368 HydrophobicContact CE2-CD1 3.91Å; Y345-I368 HydrophobicContact CE2-CG1 3.96Å; F348-I368 HydrophobicContact CD1-CD1 3.76Å; F348-I368 HydrophobicContact CD1-CG2 4.11Å; F348-I368 HydrophobicContact CE1-CD1 3.54Å; F348-I368 HydrophobicContact CE1-CG2 3.78Å; L356-I368 HydrophobicContact CD2-CD1 4.24Å; I368-R370 PolarHBondContact O-N 3.37Å; I368-R370 VanDerWaalsContact O-N 3.1Å; I368-V371 HydrophobicContact CB-CG2 3.74Å; I368-V371 HydrophobicContact CG2-CG2 3.62Å; I368-V371 PolarHBondContact O-N 3.31Å
369	E	67	Low	79.4	Confident	96 Å²	96	21.1 Å²	21.1	45%	0.449	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-29.2	-171.2	-63.5	172	176.1	0	0	113.4	R139 F396	R139-E369 IonicContact NH1-OE1 3.86Å; E369-F396 HydrophobicContact CG-CE2 4.19Å
370	R	75.1	Confident	79.4	Confident	138 Å²	138	20.7 Å²	20.7	52%	0.521	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	-97.5	5.2	-171.1	-61	179.5	-175.8	-150.3	-0.8	114.8	Q304 I368 N372	Q304-R370 HydrophobicContact CG-CB 4.49Å; I368-R370 PolarHBondContact O-N 3.37Å; I368-R370 VanDerWaalsContact O-N 3.1Å; R370-N372 PolarHBondContact O-N 2.96Å
371	V	85.5	Confident	80	Confident	4 Å²	4	23 Å²	23	2%	0.024	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	112.8	176.3	173.8	0	0	0	0	108.7	Q304 V306 F348 I368 I373 V374 A393	Q304-V371 HydrophobicContact CB-CG2 4.17Å; V306-V371 HydrophobicContact CB-CG1 4.45Å; V306-V371 HydrophobicContact CG2-CB 4.4Å; V306-V371 HydrophobicContact CG2-CG1 3.84Å; V306-V371 HydrophobicContact CG2-CG2 3.65Å; F348-V371 HydrophobicContact CE1-CG2 3.92Å; F348-V371 HydrophobicContact CZ-CG2 4.01Å; I368-V371 HydrophobicContact CB-CG2 3.74Å; I368-V371 HydrophobicContact CG2-CG2 3.62Å; I368-V371 PolarHBondContact O-N 3.31Å; V371-I373 WeakPolarHBondContact CG1-O 3.29Å; V371-V374 HydrophobicContact CG1-CG2 4.06Å; V371-A393 WeakPolarHBondContact O-CA 3.46Å
372	N	87.2	Confident	80.9	Confident	9 Å²	9	23 Å²	23	5%	0.048	11%	0.105	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	-16.1	174.5	70.9	-45.7	0	0	0	112.6	N303 Q304 R370 G400 L401 Y438	N303-N372 PolarHBondContact N-OD1 2.87Å; Q304-N372 PolarHBondContact O-N 3.42Å; Q304-N372 PolarHBondContact O-OD1 3.39Å; R370-N372 PolarHBondContact O-N 2.96Å; N372-G400 CarbonylContact O-C 3.5Å; N372-G400 WeakPolarHBondContact O-CA 3.41Å; N372-L401 PolarHBondContact O-N 3.47Å; N372-Y438 PolarHBondContact ND2-O 2.86Å
373	I	92.1	Very high	81.8	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	133.8	176.8	-47.6	-169.7	0	0	0	112.3	L300 F302 V305 V306 V371 F375 L401 Y438	L300-I373 HydrophobicContact CB-CD1 3.9Å; L300-I373 HydrophobicContact CD1-CD1 4.17Å; F302-I373 HydrophobicContact CB-CD1 3.61Å; F302-I373 HydrophobicContact CB-CG1 3.91Å; V305-I373 WeakPolarHBondContact CA-O 3.5Å; V305-I373 HydrophobicContact CG2-CB 4.24Å; V306-I373 PolarHBondContact N-O 3.17Å; V371-I373 WeakPolarHBondContact CG1-O 3.29Å; I373-F375 HydrophobicContact CG2-CD2 4.06Å; I373-F375 HydrophobicContact CG2-CE2 3.62Å; I373-F375 HydrophobicContact CG2-CZ 4.09Å; I373-L401 CarbonylContact C-O 3.57Å; I373-L401 VanDerWaalsContact CA-O 3.25Å; I373-L401 WeakPolarHBondContact CA-O 3.22Å; I373-L401 HydrophobicContact CD1-CD2 4.25Å; I373-L401 HydrophobicContact CG1-CB 4.27Å; I373-L401 HydrophobicContact CG2-CB 4.42Å; I373-L401 HydrophobicContact CG2-CG 4.45Å; I373-Y438 HydrophobicContact CD1-CD2 4.04Å; I373-Y438 HydrophobicContact CD1-CE2 3.73Å; I373-Y438 HydrophobicContact CG1-CD2 4.21Å; I373-Y438 HydrophobicContact CG1-CE2 4.39Å
374	V	93	Very high	82.9	Confident	0 Å²	0	25 Å²	25	0%	0	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	128.3	170.6	172.9	0	0	0	0	109.9	V306 F308 V371 R392 A393 L401 A402 I403	V306-V374 CarbonylContact O-C 3.55Å; V306-V374 WeakPolarHBondContact O-CA 3.43Å; F308-V374 HydrophobicContact CD2-CG1 3.72Å; F308-V374 HydrophobicContact CE2-CG1 3.69Å; V371-V374 HydrophobicContact CG1-CG2 4.06Å; V374-R392 HydrophobicContact CG2-CB 3.87Å; V374-A393 HydrophobicContact CG2-CB 3.84Å; V374-L401 PolarHBondContact N-O 2.94Å; V374-A402 CarbonylContact O-C 3.53Å; V374-A402 VanDerWaalsContact O-CA 3.29Å; V374-A402 WeakPolarHBondContact O-CA 3.45Å; V374-I403 PolarHBondContact O-N 3.41Å
375	F	96	Very high	83.7	Confident	1 Å²	1	24.6 Å²	24.6	0%	0.004	12%	0.117	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	121.2	167.2	-71	-84.8	0	0	0	110.5	L293 L296 L297 L300 V305 V306 I307 F308 I373 Y377 I403 F405	L293-F375 HydrophobicContact CD1-CB 4.43Å; L293-F375 HydrophobicContact CD1-CD1 3.93Å; L293-F375 HydrophobicContact CD1-CD2 4.05Å; L293-F375 HydrophobicContact CD1-CE1 4.14Å; L293-F375 HydrophobicContact CD1-CE2 4.26Å; L293-F375 HydrophobicContact CD1-CG 3.88Å; L293-F375 HydrophobicContact CD1-CZ 4.3Å; L296-F375 HydrophobicContact CB-CE1 4.05Å; L296-F375 HydrophobicContact CB-CZ 4Å; L296-F375 HydrophobicContact CD1-CE1 3.83Å; L297-F375 HydrophobicContact CD2-CE2 3.92Å; L300-F375 HydrophobicContact CD1-CZ 3.97Å; V305-F375 HydrophobicContact CG1-CD2 3.42Å; V305-F375 VanDerWaalsContact CG1-CD2 3.42Å; V305-F375 HydrophobicContact CG1-CE2 3.69Å; V306-F375 PolarHBondContact O-N 3.43Å; I307-F375 CarbonylContact C-O 3.54Å; I307-F375 WeakPolarHBondContact CA-O 3.43Å; I307-F375 HydrophobicContact CB-CB 4.41Å; I307-F375 HydrophobicContact CG1-CB 4.2Å; I307-F375 HydrophobicContact CG1-CD2 4.2Å; I307-F375 HydrophobicContact CG2-CB 4.1Å; F308-F375 PolarHBondContact N-O 2.84Å; I373-F375 HydrophobicContact CG2-CD2 4.06Å; I373-F375 HydrophobicContact CG2-CE2 3.62Å; I373-F375 HydrophobicContact CG2-CZ 4.09Å; F375-Y377 PolarHBondContact O-N 2.89Å; F375-I403 CarbonylContact C-O 3.53Å; F375-I403 WeakPolarHBondContact CA-O 3.5Å; F375-I403 HydrophobicContact CD1-CB 3.77Å; F375-I403 HydrophobicContact CD1-CG2 4.13Å; F375-I403 HydrophobicContact CE1-CB 3.79Å; F375-I403 HydrophobicContact CE1-CD1 3.71Å; F375-I403 HydrophobicContact CE1-CG1 4.25Å; F375-I403 HydrophobicContact CE1-CG2 4.1Å; F375-I403 HydrophobicContact CZ-CD1 4.14Å; F375-F405 HydrophobicContact CD1-CZ 4.47Å
376	N	96.2	Very high	85	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	86.5	158.4	-71.1	-49.3	0	0	0	107.7	D378 R389 V390 I403 T404 F405	N376-D378 VanDerWaalsContact C-N 3.27Å; N376-R389 WeakPolarHBondContact OD1-CD 3.21Å; N376-R389 PolarHBondContact OD1-NH1 2.84Å; N376-V390 WeakPolarHBondContact ND2-CG1 3.3Å; N376-I403 PolarHBondContact N-O 3.17Å; N376-T404 HydrophobicContact CB-CG2 3.79Å; N376-T404 PolarHBondContact ND2-OG1 3.34Å; N376-T404 VanDerWaalsContact ND2-OG1 3.09Å; N376-F405 PolarHBondContact O-N 3.13Å
377	Y	97.2	Very high	85.7	Confident	8 Å²	8	25.1 Å²	25.1	3%	0.031	12%	0.119	C	C	.	.	S	Bend	trans	-65.2	-36.8	176.6	-175.6	-87.2	0	0	0	111.2	K289 N290 L293 I307 F308 V309 R314 L318 F375 F405	K289-Y377 HydrophobicContact CB-CE1 4.27Å; K289-Y377 HydrophobicContact CB-CE2 3.69Å; K289-Y377 VanDerWaalsContact CB-CZ 3.47Å; K289-Y377 WeakPolarHBondContact CB-OH 3.32Å; K289-Y377 HydrophobicContact CD-CD1 4.44Å; K289-Y377 HydrophobicContact CD-CE1 4.06Å; K289-Y377 WeakPolarHBondContact CE-O 3.27Å; K289-Y377 PolarHBondContact NZ-O 3.21Å; N290-Y377 PolarHBondContact N-OH 3.45Å; N290-Y377 PolarHBondContact OD1-OH 2.75Å; L293-Y377 HydrophobicContact CB-CD2 4.47Å; L293-Y377 HydrophobicContact CB-CE2 4.34Å; L293-Y377 HydrophobicContact CD2-CD2 3.86Å; L293-Y377 HydrophobicContact CD2-CE2 4.01Å; I307-Y377 HydrophobicContact CG2-CG 4.46Å; F308-Y377 WeakPolarHBondContact O-CB 3.45Å; F308-Y377 PolarHBondContact O-N 3.07Å; V309-Y377 HydrophobicContact CG1-CD1 3.82Å; V309-Y377 HydrophobicContact CG1-CG 4.11Å; R314-Y377 VanDerWaalsContact NH2-CE1 3.26Å; L318-Y377 HydrophobicContact CD1-CE2 4.28Å; L318-Y377 HydrophobicContact CD2-CD1 4.43Å; L318-Y377 HydrophobicContact CD2-CD2 4.05Å; L318-Y377 HydrophobicContact CD2-CE2 4.3Å; L318-Y377 HydrophobicContact CD2-CG 4.13Å; F375-Y377 PolarHBondContact O-N 2.89Å; Y377-F405 AromaticContact CD2-CD2 3.97Å; Y377-F405 HydrophobicContact CD2-CD2 3.97Å; Y377-F405 AromaticContact CD2-CE2 3.9Å; Y377-F405 HydrophobicContact CD2-CE2 3.9Å; Y377-F405 HydrophobicContact CE2-CD2 4.38Å; Y377-F405 HydrophobicContact CE2-CE2 4.22Å; Y377-F405 HydrophobicContact CG-CD2 4.46Å
378	D	95.6	Very high	86.4	Confident	5 Å²	5	23.4 Å²	23.4	3%	0.027	11%	0.11	C	C	.	.	S	Bend	trans	-115.4	136.2	166.5	-62	-38.1	0	0	0	109.8	K289 F308 V309 R310 R314 N376 R389	K289-D378 IonicContact NZ-OD1 3.68Å; F308-D378 PolarHBondContact O-N 3.26Å; V309-D378 WeakPolarHBondContact CA-OD2 3.42Å; R310-D378 HydrophobicContact CB-CB 3.96Å; R310-D378 PolarHBondContact N-OD2 2.74Å; R314-D378 IonicContact CZ-OD1 3.75Å; R314-D378 IonicContact CZ-OD2 3.71Å; R314-D378 IonicContact NE-OD1 3.26Å; R314-D378 PolarHBondContact NE-OD1 2.53Å; R314-D378 IonicContact NE-OD2 2.78Å; R314-D378 PolarHBondContact NE-OD2 3.19Å; R314-D378 IonicContact NH2-OD1 3.78Å; R314-D378 PolarHBondContact NH2-OD1 3.32Å; R314-D378 IonicContact NH2-OD2 2.91Å; N376-D378 VanDerWaalsContact C-N 3.27Å; D378-R389 PolarHBondContact O-NH1 3.3Å
379	M	94.5	Very high	87.2	Confident	0 Å²	0	23 Å²	23	0%	0	11%	0.107	C	C	.	.			trans	-58.8	134.3	177.1	-167.9	68.3	-169.8	0	0	110.2	R310 Y386 T404 E411 I414 L415 V418	R310-M379 PolarHBondContact NH2-O 3.46Å; M379-Y386 HydrophobicContact CE-CD2 4.03Å; M379-Y386 HydrophobicContact CE-CE2 4.45Å; M379-T404 HydrophobicContact SD-CG2 3.44Å; M379-T404 WeakPolarHBondContact SD-CG2 3.41Å; M379-E411 HydrophobicContact CB-CB 3.8Å; M379-E411 HydrophobicContact CB-CG 3.61Å; M379-E411 HydrophobicContact CG-CB 4.01Å; M379-E411 HydrophobicContact CG-CG 4.28Å; M379-E411 PolarHBondContact N-OE1 3.15Å; M379-I414 HydrophobicContact CE-CB 3.82Å; M379-I414 HydrophobicContact CE-CG2 3.51Å; M379-I414 HydrophobicContact CG-CB 4.16Å; M379-I414 HydrophobicContact CG-CD1 4.35Å; M379-I414 HydrophobicContact CG-CG2 4.22Å; M379-L415 HydrophobicContact CE-CB 4Å; M379-L415 HydrophobicContact CE-CD1 4.4Å; M379-V418 HydrophobicContact CE-CG2 4.49Å
380	P	91.2	Very high	88.1	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	9%	0.086	C	C	.	.			trans	-59.6	160.3	172.1	25.4	-34.6	0	0	0	112.2	D382 T385 Y386 I414	P380-D382 VanDerWaalsContact C-N 3.31Å; P380-D382 PolarHBondContact O-N 3.44Å; P380-T385 HydrophobicContact CB-CG2 3.76Å; P380-Y386 HydrophobicContact CG-CD2 3.76Å; P380-Y386 HydrophobicContact CG-CG 4.15Å; P380-I414 WeakPolarHBondContact O-CD1 3.42Å
381	E	88.8	Confident	88.2	Confident	91 Å²	91	12 Å²	12	43%	0.425	6%	0.063	S	C	.	.	S	Bend	trans	-66.3	-28.4	176	50.6	-93.8	-154.6	0	0	114.4	N360	N360-E381 PolarHBondContact ND2-OE1 2.86Å; N360-E381 PolarHBondContact ND2-OE2 2.84Å
382	D	86.6	Confident	87.8	Confident	54 Å²	54	12.2 Å²	12.2	29%	0.289	6%	0.063	S	C	.	.	S	Bend	trans	-151.4	168.8	-175.1	58.9	43.4	0	0	0	112.1	P380 D384 T385 Y386	P380-D382 VanDerWaalsContact C-N 3.31Å; P380-D382 PolarHBondContact O-N 3.44Å; D382-D384 VanDerWaalsContact C-N 3.33Å; D382-D384 PolarHBondContact O-N 2.98Å; D382-D384 PolarHBondContact OD1-N 3.28Å; D382-T385 PolarHBondContact O-N 3.01Å; D382-T385 WeakPolarHBondContact OD1-CB 3.31Å; D382-T385 PolarHBondContact OD1-N 2.98Å; D382-T385 PolarHBondContact OD1-OG1 2.83Å; D382-Y386 PolarHBondContact O-N 3.3Å; D382-Y386 VanDerWaalsContact O-N 3.11Å
383	S	84.4	Confident	87.2	Confident	15 Å²	15	11.8 Å²	11.8	11%	0.105	6%	0.061	C	C	.	.	H	α-helix	trans	-67.9	-30.1	-178.5	49.9	0	0	0	0	113.4	Y386 L387 R421 F422	S383-Y386 WeakPolarHBondContact O-CB 3.03Å; S383-Y386 PolarHBondContact O-N 2.83Å; S383-L387 PolarHBondContact O-N 3.31Å; S383-L387 VanDerWaalsContact O-N 3.12Å; S383-R421 VanDerWaalsContact OG-CD 3.25Å; S383-R421 WeakPolarHBondContact OG-CD 3.44Å; S383-R421 PolarHBondContact OG-NH1 3.17Å; S383-F422 VanDerWaalsContact O-CE2 3.28Å; S383-F422 WeakPolarHBondContact O-CE2 3.24Å
384	D	80.2	Confident	86	Confident	33 Å²	33	12.6 Å²	12.6	18%	0.176	7%	0.069	C	C	.	.	H	α-helix	trans	-64.8	-50.4	174.9	-70.9	-55.5	0	0	0	110.8	D382 Y386 L387 H388 R421	D382-D384 VanDerWaalsContact C-N 3.33Å; D382-D384 PolarHBondContact O-N 2.98Å; D382-D384 PolarHBondContact OD1-N 3.28Å; D384-Y386 PolarHBondContact O-N 2.95Å; D384-L387 WeakPolarHBondContact O-CB 2.95Å; D384-L387 PolarHBondContact O-N 3.07Å; D384-L387 VanDerWaalsContact O-N 3.1Å; D384-H388 PolarHBondContact O-CD2 3.39Å; D384-H388 PolarHBondContact O-N 2.99Å; D384-R421 IonicContact OD1-CZ 3.24Å; D384-R421 IonicContact OD1-NH1 2.67Å; D384-R421 PolarHBondContact OD1-NH1 3.47Å; D384-R421 IonicContact OD1-NH2 3.92Å; D384-R421 PolarHBondContact OD1-NH2 2.86Å; D384-R421 IonicContact OD2-CZ 3.38Å; D384-R421 IonicContact OD2-NH1 3.95Å; D384-R421 PolarHBondContact OD2-NH1 3.41Å; D384-R421 IonicContact OD2-NH2 2.85Å; D384-R421 PolarHBondContact OD2-NH2 3.45Å
385	T	84.8	Confident	84.7	Confident	12 Å²	12	13.2 Å²	13.2	7%	0.074	7%	0.072	C	C	.	.	H	α-helix	trans	-60.7	-38.4	179.5	-57.6	0	0	0	0	110.7	P380 D382 H388 R389	P380-T385 HydrophobicContact CB-CG2 3.76Å; D382-T385 PolarHBondContact O-N 3.01Å; D382-T385 WeakPolarHBondContact OD1-CB 3.31Å; D382-T385 PolarHBondContact OD1-N 2.98Å; D382-T385 PolarHBondContact OD1-OG1 2.83Å; T385-H388 PolarHBondContact O-N 2.66Å; T385-R389 HydrophobicContact CG2-CG 4.46Å; T385-R389 WeakPolarHBondContact O-CB 3.32Å; T385-R389 VanDerWaalsContact O-CG 3.3Å; T385-R389 WeakPolarHBondContact O-CG 3.38Å; T385-R389 PolarHBondContact O-N 2.87Å; T385-R389 VanDerWaalsContact O-N 3.07Å
386	Y	87.7	Confident	83	Confident	2 Å²	2	18 Å²	18	1%	0.008	9%	0.093	C	C	.	.	H	α-helix	trans	-54	-56	170.7	-175	-85.2	0	0	0	111.8	Q279 M379 P380 D382 S383 D384 H388 R389 V390 T404 V418 I426	Q279-Y386 VanDerWaalsContact OE1-CE1 3.3Å; Q279-Y386 PolarHBondContact OE1-OH 2.87Å; M379-Y386 HydrophobicContact CE-CD2 4.03Å; M379-Y386 HydrophobicContact CE-CE2 4.45Å; P380-Y386 HydrophobicContact CG-CD2 3.76Å; P380-Y386 HydrophobicContact CG-CG 4.15Å; D382-Y386 PolarHBondContact O-N 3.3Å; D382-Y386 VanDerWaalsContact O-N 3.11Å; S383-Y386 WeakPolarHBondContact O-CB 3.03Å; S383-Y386 PolarHBondContact O-N 2.83Å; D384-Y386 PolarHBondContact O-N 2.95Å; Y386-H388 VanDerWaalsContact C-N 3.29Å; Y386-H388 PolarHBondContact O-N 2.77Å; Y386-R389 PolarHBondContact O-N 3.07Å; Y386-V390 HydrophobicContact CD1-CG1 4.12Å; Y386-V390 HydrophobicContact CD1-CG2 4.13Å; Y386-V390 HydrophobicContact CE1-CB 4.41Å; Y386-V390 HydrophobicContact CE1-CG1 3.69Å; Y386-V390 HydrophobicContact CE1-CG2 3.88Å; Y386-V390 HydrophobicContact CE2-CG1 4.16Å; Y386-V390 WeakPolarHBondContact O-CG2 3.27Å; Y386-V390 PolarHBondContact O-N 3.16Å; Y386-T404 HydrophobicContact CE2-CG2 4.15Å; Y386-T404 WeakPolarHBondContact CE2-OG1 3.16Å; Y386-V418 HydrophobicContact CD1-CB 4.44Å; Y386-V418 HydrophobicContact CD1-CG1 3.46Å; Y386-V418 VanDerWaalsContact CD1-CG1 3.46Å; Y386-V418 HydrophobicContact CD1-CG2 4.04Å; Y386-V418 HydrophobicContact CD2-CG2 4.19Å; Y386-V418 HydrophobicContact CE1-CG1 3.63Å; Y386-V418 HydrophobicContact CG-CG1 3.99Å; Y386-V418 HydrophobicContact CG-CG2 3.73Å; Y386-I426 HydrophobicContact CE1-CD1 4.13Å; Y386-I426 WeakPolarHBondContact OH-CD1 3.13Å
387	L	81.6	Confident	81.3	Confident	12 Å²	12	20.3 Å²	20.3	6%	0.063	12%	0.116	C	C	.	.	H	α-helix	trans	-55.8	-44.6	-178.4	179.9	63.8	0	0	0	111.6	T234 L272 L274 S383 D384 R389 A391 F422	T234-L387 HydrophobicContact CG2-CD2 4.25Å; L272-L387 HydrophobicContact CD1-CD2 4.34Å; L272-L387 HydrophobicContact CD2-CD2 4.4Å; L274-L387 HydrophobicContact CD1-CD1 3.52Å; L274-L387 HydrophobicContact CD2-CD1 4.37Å; L274-L387 HydrophobicContact CG-CD1 4.17Å; S383-L387 PolarHBondContact O-N 3.31Å; S383-L387 VanDerWaalsContact O-N 3.12Å; D384-L387 WeakPolarHBondContact O-CB 2.95Å; D384-L387 PolarHBondContact O-N 3.07Å; D384-L387 VanDerWaalsContact O-N 3.1Å; L387-R389 PolarHBondContact O-N 2.99Å; L387-A391 WeakPolarHBondContact O-CB 3.29Å; L387-A391 PolarHBondContact O-N 2.86Å; L387-F422 HydrophobicContact CB-CE1 4.5Å; L387-F422 HydrophobicContact CB-CE2 4.06Å; L387-F422 HydrophobicContact CB-CZ 3.84Å; L387-F422 HydrophobicContact CD2-CD1 4.39Å; L387-F422 HydrophobicContact CD2-CE1 3.68Å; L387-F422 HydrophobicContact CD2-CZ 3.84Å; L387-F422 HydrophobicContact CG-CZ 4.35Å
388	H	79.6	Confident	79.8	Confident	2 Å²	2	21 Å²	21	1%	0.009	12%	0.122	C	C	.	.	H	α-helix	trans	-66.4	-39	-178.8	-71.3	-72.5	0	0	0	113.7	G363 R364 D384 T385 Y386 R392	G363-H388 CarbonylContact O-C 3.55Å; G363-H388 VanDerWaalsContact O-C 3.3Å; G363-H388 VanDerWaalsContact O-CB 3.31Å; G363-H388 WeakPolarHBondContact O-CB 3.49Å; R364-H388 HydrophobicContact CG-CB 3.89Å; R364-H388 PolarHBondContact NE-CD2 3.26Å; R364-H388 VanDerWaalsContact NE-CD2 3.25Å; R364-H388 PolarHBondContact NE-NE2 2.85Å; R364-H388 PolarHBondContact NH1-NE2 2.87Å; R364-H388 PolarHBondContact NH2-CD2 2.85Å; R364-H388 PolarHBondContact NH2-NE2 3.09Å; D384-H388 PolarHBondContact O-CD2 3.39Å; D384-H388 PolarHBondContact O-N 2.99Å; T385-H388 PolarHBondContact O-N 2.66Å; Y386-H388 VanDerWaalsContact C-N 3.29Å; Y386-H388 PolarHBondContact O-N 2.77Å; H388-R392 PolarHBondContact O-NE 2.85Å; H388-R392 PolarHBondContact O-NH2 2.86Å; H388-R392 VanDerWaalsContact O-NH2 3.12Å
389	R	86.9	Confident	79	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-65.6	-51.4	176.5	-74.3	-177.6	-175.5	-175.5	7.6	111.4	F308 N360 N376 D378 T385 Y386 L387 A391 R392	F308-R389 HydrophobicContact CD1-CG 4.1Å; F308-R389 HydrophobicContact CD2-CB 3.7Å; F308-R389 HydrophobicContact CD2-CG 3.72Å; F308-R389 HydrophobicContact CE1-CG 4.17Å; F308-R389 HydrophobicContact CE2-CB 3.58Å; F308-R389 HydrophobicContact CE2-CG 3.8Å; F308-R389 HydrophobicContact CG-CB 4.36Å; F308-R389 HydrophobicContact CG-CG 3.87Å; F308-R389 HydrophobicContact CZ-CB 4.17Å; F308-R389 HydrophobicContact CZ-CG 4.02Å; N360-R389 PolarHBondContact OD1-NH2 2.87Å; N376-R389 WeakPolarHBondContact OD1-CD 3.21Å; N376-R389 PolarHBondContact OD1-NH1 2.84Å; D378-R389 PolarHBondContact O-NH1 3.3Å; T385-R389 HydrophobicContact CG2-CG 4.46Å; T385-R389 WeakPolarHBondContact O-CB 3.32Å; T385-R389 VanDerWaalsContact O-CG 3.3Å; T385-R389 WeakPolarHBondContact O-CG 3.38Å; T385-R389 PolarHBondContact O-N 2.87Å; T385-R389 VanDerWaalsContact O-N 3.07Å; Y386-R389 PolarHBondContact O-N 3.07Å; L387-R389 PolarHBondContact O-N 2.99Å; R389-A391 VanDerWaalsContact C-N 3.32Å; R389-A391 PolarHBondContact O-N 3.21Å; R389-R392 WeakPolarHBondContact O-CB 3.26Å; R389-R392 WeakPolarHBondContact O-CG 3.37Å; R389-R392 PolarHBondContact O-N 2.83Å
390	V	85.6	Confident	78.6	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-71	-30.2	-175.4	-55.8	0	0	0	0	112.1	L274 L277 N376 Y386 R392 A393 A402	L274-V390 HydrophobicContact CD1-CG2 3.85Å; L277-V390 HydrophobicContact CD2-CB 3.9Å; L277-V390 HydrophobicContact CD2-CG2 3.83Å; L277-V390 WeakPolarHBondContact CD2-O 3.41Å; N376-V390 WeakPolarHBondContact ND2-CG1 3.3Å; Y386-V390 HydrophobicContact CD1-CG1 4.12Å; Y386-V390 HydrophobicContact CD1-CG2 4.13Å; Y386-V390 HydrophobicContact CE1-CB 4.41Å; Y386-V390 HydrophobicContact CE1-CG1 3.69Å; Y386-V390 HydrophobicContact CE1-CG2 3.88Å; Y386-V390 HydrophobicContact CE2-CG1 4.16Å; Y386-V390 WeakPolarHBondContact O-CG2 3.27Å; Y386-V390 PolarHBondContact O-N 3.16Å; V390-R392 PolarHBondContact O-N 3.13Å; V390-A393 PolarHBondContact O-N 3.16Å; V390-A402 HydrophobicContact CB-CB 3.77Å; V390-A402 HydrophobicContact CG1-CB 3.69Å
391	A	78.3	Confident	78.6	Confident	4 Å²	4	24.7 Å²	24.7	3%	0.033	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	9	173	0	0	0	0	0	114.4	L274 L387 R389 R395	L274-A391 HydrophobicContact CD2-CB 3.76Å; L387-A391 WeakPolarHBondContact O-CB 3.29Å; L387-A391 PolarHBondContact O-N 2.86Å; R389-A391 VanDerWaalsContact C-N 3.32Å; R389-A391 PolarHBondContact O-N 3.21Å; A391-R395 PolarHBondContact O-NE 3.23Å; A391-R395 PolarHBondContact O-NH2 3.5Å
392	R	75.9	Confident	78.7	Confident	8 Å²	8	20.4 Å²	20.4	3%	0.03	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-26.6	162.3	-61.1	-48.7	101.3	172.5	5.4	111.7	S95 F308 M366 V374 H388 R389 V390	S95-R392 PolarHBondContact OG-NH2 3.25Å; F308-R392 HydrophobicContact CE2-CG 4.47Å; F308-R392 HydrophobicContact CZ-CG 4.16Å; M366-R392 VanDerWaalsContact O-CD 3.22Å; M366-R392 WeakPolarHBondContact O-CD 3.33Å; M366-R392 PolarHBondContact O-NH1 3.43Å; V374-R392 HydrophobicContact CG2-CB 3.87Å; H388-R392 PolarHBondContact O-NE 2.85Å; H388-R392 PolarHBondContact O-NH2 2.86Å; H388-R392 VanDerWaalsContact O-NH2 3.12Å; R389-R392 WeakPolarHBondContact O-CB 3.26Å; R389-R392 WeakPolarHBondContact O-CG 3.37Å; R389-R392 PolarHBondContact O-N 2.83Å; V390-R392 PolarHBondContact O-N 3.13Å
393	A	75.4	Confident	79.2	Confident	1 Å²	1	17.8 Å²	17.8	1%	0.008	10%	0.103	C	C	.	.	S	Bend	trans	-94.3	153.9	171.7	0	0	0	0	0	111.7	L277 V371 V374 V390	L277-A393 HydrophobicContact CD1-CB 3.78Å; V371-A393 WeakPolarHBondContact O-CA 3.46Å; V374-A393 HydrophobicContact CG2-CB 3.84Å; V390-A393 PolarHBondContact O-N 3.16Å
394	G	65.8	Low	79.8	Confident	17 Å²	17	17.1 Å²	17.1	18%	0.175	10%	0.098	C	C	.	.	S	Bend	trans	69.5	52.8	172.9	0	0	0	0	0	114.2	T398	G394-T398 CarbonylContact C-O 3.56Å; G394-T398 WeakPolarHBondContact CA-O 3.04Å
395	R	67	Low	80.6	Confident	12 Å²	12	15.5 Å²	15.5	5%	0.045	9%	0.09	C	C	.	.			trans	-96.5	156.5	-179.3	-66.4	-172.7	167.8	-143	-10.8	112.1	D367 A391 G397 T398	D367-R395 IonicContact OD1-CZ 3.91Å; D367-R395 IonicContact OD1-NE 3.64Å; D367-R395 IonicContact OD1-NH1 2.8Å; D367-R395 PolarHBondContact OD1-NH1 3.07Å; D367-R395 IonicContact OD2-NH1 2.68Å; D367-R395 PolarHBondContact OD2-NH1 3.23Å; A391-R395 PolarHBondContact O-NE 3.23Å; A391-R395 PolarHBondContact O-NH2 3.5Å; R395-G397 PolarHBondContact O-N 3.3Å; R395-G397 VanDerWaalsContact O-N 3.15Å; R395-T398 PolarHBondContact N-OG1 3.13Å; R395-T398 VanDerWaalsContact N-OG1 3.1Å; R395-T398 VanDerWaalsContact O-CB 3.27Å; R395-T398 WeakPolarHBondContact O-CB 3.41Å; R395-T398 WeakPolarHBondContact O-CG2 3.22Å; R395-T398 PolarHBondContact O-N 3.4Å; R395-T398 PolarHBondContact O-OG1 3.23Å
396	F	60.6	Low	81.2	Confident	103 Å²	103	15.2 Å²	15.2	45%	0.452	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	35.6	174.4	-54.2	-73.6	0	0	0	114.4	G96 E369 T398	G96-F396 WeakPolarHBondContact O-CE1 3.4Å; E369-F396 HydrophobicContact CG-CE2 4.19Å; F396-T398 PolarHBondContact O-N 2.67Å
397	G	59	Low	81.5	Confident	48 Å²	48	16.7 Å²	16.7	50%	0.495	10%	0.099	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.1	-4.2	-178.1	0	0	0	0	0	114.8	R395	R395-G397 PolarHBondContact O-N 3.3Å; R395-G397 VanDerWaalsContact O-N 3.15Å
398	T	67.4	Low	82.1	Confident	23 Å²	23	19.9 Å²	19.9	14%	0.141	12%	0.116	C	C	.	.			trans	-68.2	152.5	172.8	65.8	0	0	0	0	110.8	G394 R395 F396 I441	G394-T398 CarbonylContact C-O 3.56Å; G394-T398 WeakPolarHBondContact CA-O 3.04Å; R395-T398 PolarHBondContact N-OG1 3.13Å; R395-T398 VanDerWaalsContact N-OG1 3.1Å; R395-T398 VanDerWaalsContact O-CB 3.27Å; R395-T398 WeakPolarHBondContact O-CB 3.41Å; R395-T398 WeakPolarHBondContact O-CG2 3.22Å; R395-T398 PolarHBondContact O-N 3.4Å; R395-T398 PolarHBondContact O-OG1 3.23Å; F396-T398 PolarHBondContact O-N 2.67Å; T398-I441 HydrophobicContact CG2-CG2 4.17Å
399	K	77.7	Confident	82.7	Confident	82 Å²	82	28.2 Å²	28.2	36%	0.357	15%	0.154	S	C	.	.			trans	-80.4	148.1	173.3	-56.6	-171.5	-167.8	175.6	0	110.4	G276 D436 S437	G276-K399 CarbonylContact O-C 3.57Å; G276-K399 VanDerWaalsContact O-CA 3.27Å; G276-K399 WeakPolarHBondContact O-CA 3.49Å; K399-D436 WeakPolarHBondContact CD-O 3.47Å; K399-D436 PolarHBondContact NZ-O 3.04Å; K399-S437 WeakPolarHBondContact CB-O 3.48Å; K399-S437 WeakPolarHBondContact CD-O 3.31Å
400	G	85.9	Confident	83	Confident	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	161.4	178.1	0	0	0	0	0	111.9	G276 L277 H278 N372	G276-G400 PolarHBondContact O-N 3.35Å; L277-G400 WeakPolarHBondContact CA-O 3.12Å; L277-G400 VanDerWaalsContact CD1-C 3.5Å; H278-G400 PolarHBondContact N-O 2.95Å; N372-G400 CarbonylContact O-C 3.5Å; N372-G400 WeakPolarHBondContact O-CA 3.41Å
401	L	90.6	Very high	83.4	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.6	176.8	178.4	60.9	0	0	0	110	H278 L300 N372 I373 V374 I403 I433 Y438	H278-L401 HydrophobicContact CB-CD1 4.12Å; H278-L401 CarbonylContact O-C 3.6Å; H278-L401 WeakPolarHBondContact O-CA 3.42Å; L300-L401 HydrophobicContact CD1-CD2 4.03Å; L300-L401 HydrophobicContact CD2-CD2 4.13Å; N372-L401 PolarHBondContact O-N 3.47Å; I373-L401 CarbonylContact C-O 3.57Å; I373-L401 VanDerWaalsContact CA-O 3.25Å; I373-L401 WeakPolarHBondContact CA-O 3.22Å; I373-L401 HydrophobicContact CD1-CD2 4.25Å; I373-L401 HydrophobicContact CG1-CB 4.27Å; I373-L401 HydrophobicContact CG2-CB 4.42Å; I373-L401 HydrophobicContact CG2-CG 4.45Å; V374-L401 PolarHBondContact N-O 2.94Å; L401-I403 HydrophobicContact CD1-CG1 4.13Å; L401-I403 HydrophobicContact CD2-CD1 3.96Å; L401-I403 HydrophobicContact CD2-CG1 4.32Å; L401-I403 HydrophobicContact CG-CD1 4.21Å; L401-I403 HydrophobicContact CG-CG1 4.01Å; L401-I433 HydrophobicContact CD2-CD1 4.2Å; L401-Y438 HydrophobicContact CB-CD2 4.25Å; L401-Y438 HydrophobicContact CB-CG 3.96Å; L401-Y438 HydrophobicContact CD2-CD1 4.06Å; L401-Y438 HydrophobicContact CD2-CD2 4.3Å; L401-Y438 HydrophobicContact CD2-CE1 4.22Å; L401-Y438 HydrophobicContact CD2-CE2 4.43Å; L401-Y438 HydrophobicContact CD2-CG 4.13Å
402	A	92.5	Very high	84.1	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.1	169.9	0	0	0	0	0	110.1	L277 H278 Q279 H280 V374 V390	L277-A402 HydrophobicContact CD1-CB 4.08Å; H278-A402 PolarHBondContact O-N 3.22Å; Q279-A402 WeakPolarHBondContact CA-O 3.33Å; Q279-A402 HydrophobicContact CG-CB 4.27Å; H280-A402 PolarHBondContact N-O 3.27Å; V374-A402 CarbonylContact O-C 3.53Å; V374-A402 VanDerWaalsContact O-CA 3.29Å; V374-A402 WeakPolarHBondContact O-CA 3.45Å; V390-A402 HydrophobicContact CB-CB 3.77Å; V390-A402 HydrophobicContact CG1-CB 3.69Å
403	I	95.7	Very high	85	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	126	176.5	-60	175.1	0	0	0	108.9	H280 V282 L296 L300 V374 F375 N376 L401 F405 L429 I433	H280-I403 CarbonylContact O-C 3.46Å; H280-I403 WeakPolarHBondContact O-CA 3.3Å; V282-I403 HydrophobicContact CG2-CG2 3.86Å; L296-I403 HydrophobicContact CD1-CD1 4.22Å; L296-I403 HydrophobicContact CD1-CG2 4.23Å; L300-I403 HydrophobicContact CD1-CD1 3.74Å; V374-I403 PolarHBondContact O-N 3.41Å; F375-I403 CarbonylContact C-O 3.53Å; F375-I403 WeakPolarHBondContact CA-O 3.5Å; F375-I403 HydrophobicContact CD1-CB 3.77Å; F375-I403 HydrophobicContact CD1-CG2 4.13Å; F375-I403 HydrophobicContact CE1-CB 3.79Å; F375-I403 HydrophobicContact CE1-CD1 3.71Å; F375-I403 HydrophobicContact CE1-CG1 4.25Å; F375-I403 HydrophobicContact CE1-CG2 4.1Å; F375-I403 HydrophobicContact CZ-CD1 4.14Å; N376-I403 PolarHBondContact N-O 3.17Å; L401-I403 HydrophobicContact CD1-CG1 4.13Å; L401-I403 HydrophobicContact CD2-CD1 3.96Å; L401-I403 HydrophobicContact CD2-CG1 4.32Å; L401-I403 HydrophobicContact CG-CD1 4.21Å; L401-I403 HydrophobicContact CG-CG1 4.01Å; I403-F405 HydrophobicContact CG2-CD1 4.23Å; I403-F405 HydrophobicContact CG2-CE1 3.91Å; I403-L429 HydrophobicContact CD1-CD1 3.77Å; I403-L429 HydrophobicContact CG1-CD1 3.96Å; I403-L429 HydrophobicContact CG2-CD1 4.43Å; I403-I433 HydrophobicContact CD1-CD1 4.44Å
404	T	96.8	Very high	85.8	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	125.2	-178.1	-58.8	0	0	0	0	111.4	H280 Y281 V282 N376 M379 Y386 I406	H280-T404 PolarHBondContact O-N 3.27Å; Y281-T404 CarbonylContact C-O 3.58Å; Y281-T404 WeakPolarHBondContact CA-O 3.44Å; V282-T404 PolarHBondContact N-O 3.44Å; N376-T404 HydrophobicContact CB-CG2 3.79Å; N376-T404 PolarHBondContact ND2-OG1 3.34Å; N376-T404 VanDerWaalsContact ND2-OG1 3.09Å; M379-T404 HydrophobicContact SD-CG2 3.44Å; M379-T404 WeakPolarHBondContact SD-CG2 3.41Å; Y386-T404 HydrophobicContact CE2-CG2 4.15Å; Y386-T404 WeakPolarHBondContact CE2-OG1 3.16Å; T404-I406 HydrophobicContact CG2-CG1 4.49Å
405	F	98.1	Very high	87.1	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	138.2	174.8	-64.4	-13.1	0	0	0	110.8	V282 L284 K289 K292 L293 L296 F375 N376 Y377 I403	V282-F405 HydrophobicContact CB-CD1 3.94Å; V282-F405 HydrophobicContact CB-CE1 4.23Å; V282-F405 HydrophobicContact CG2-CD1 4.11Å; V282-F405 HydrophobicContact CG2-CE1 4.03Å; V282-F405 WeakPolarHBondContact O-CA 3.47Å; L284-F405 HydrophobicContact CD2-CB 4.16Å; L284-F405 HydrophobicContact CD2-CD1 3.86Å; L284-F405 HydrophobicContact CD2-CE1 4.38Å; L284-F405 HydrophobicContact CD2-CG 3.96Å; K289-F405 HydrophobicContact CB-CD2 4.19Å; K289-F405 HydrophobicContact CB-CE2 4.48Å; K289-F405 HydrophobicContact CD-CB 4.47Å; K289-F405 HydrophobicContact CD-CD2 4.31Å; K289-F405 HydrophobicContact CG-CD2 3.96Å; K292-F405 HydrophobicContact CB-CZ 4.32Å; K292-F405 HydrophobicContact CG-CE1 4.28Å; K292-F405 HydrophobicContact CG-CZ 4.15Å; L293-F405 HydrophobicContact CB-CE2 4.06Å; L293-F405 HydrophobicContact CB-CZ 4.26Å; L296-F405 HydrophobicContact CD1-CE1 3.87Å; L296-F405 HydrophobicContact CD1-CZ 4.02Å; F375-F405 HydrophobicContact CD1-CZ 4.47Å; N376-F405 PolarHBondContact O-N 3.13Å; Y377-F405 AromaticContact CD2-CD2 3.97Å; Y377-F405 HydrophobicContact CD2-CD2 3.97Å; Y377-F405 AromaticContact CD2-CE2 3.9Å; Y377-F405 HydrophobicContact CD2-CE2 3.9Å; Y377-F405 HydrophobicContact CE2-CD2 4.38Å; Y377-F405 HydrophobicContact CE2-CE2 4.22Å; Y377-F405 HydrophobicContact CG-CD2 4.46Å; I403-F405 HydrophobicContact CG2-CD1 4.23Å; I403-F405 HydrophobicContact CG2-CE1 3.91Å
406	I	96.9	Very high	88.2	Confident	5 Å²	5	44.1 Å²	44.1	3%	0.026	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	120.2	-179.9	-61.1	177.7	0	0	0	107.9	Y281 V282 K283 L284 T404 E411 A412 L415	Y281-I406 HydrophobicContact CD2-CD1 4.18Å; Y281-I406 HydrophobicContact CG-CD1 4.11Å; V282-I406 PolarHBondContact O-N 2.97Å; K283-I406 WeakPolarHBondContact CA-O 3.35Å; K283-I406 HydrophobicContact CG-CB 4.35Å; K283-I406 HydrophobicContact CG-CG2 4.48Å; L284-I406 PolarHBondContact N-O 3.45Å; T404-I406 HydrophobicContact CG2-CG1 4.49Å; I406-E411 WeakPolarHBondContact CA-OE2 3.45Å; I406-E411 HydrophobicContact CG2-CB 3.97Å; I406-A412 HydrophobicContact CG2-CB 3.97Å; I406-L415 HydrophobicContact CD1-CB 3.83Å; I406-L415 HydrophobicContact CD1-CD1 4.38Å; I406-L415 HydrophobicContact CD1-CD2 3.37Å; I406-L415 HydrophobicContact CD1-CG 4.01Å
407	S	94.6	Very high	89.6	Confident	34 Å²	34	42.8 Å²	42.8	24%	0.238	23%	0.234	C	C	.	.			trans	-111.7	-18.2	-178.3	60.1	0	0	0	0	115.5	L284 E286 E411	L284-S407 WeakPolarHBondContact O-CA 3.36Å; L284-S407 WeakPolarHBondContact O-CB 3.1Å; E286-S407 VanDerWaalsContact OE1-CB 3.24Å; E286-S407 WeakPolarHBondContact OE1-CB 3.47Å; E286-S407 PolarHBondContact OE1-OG 3.42Å; S407-E411 PolarHBondContact N-OE2 2.88Å; S407-E411 PolarHBondContact OG-OE2 3.27Å; S407-E411 VanDerWaalsContact OG-OE2 3.12Å
408	D	93.8	Very high	91	Very high	78 Å²	78	40.5 Å²	40.5	42%	0.417	21%	0.21	S	C	.	.	S	Bend	trans	-142.5	174.8	179	68.3	47.9	0	0	0	113.5	T410 E411 A412	D408-T410 VanDerWaalsContact C-N 3.29Å; D408-T410 PolarHBondContact O-N 3.22Å; D408-T410 WeakPolarHBondContact OD1-CA 3.34Å; D408-T410 VanDerWaalsContact OD1-CB 3.23Å; D408-T410 WeakPolarHBondContact OD1-CB 3.4Å; D408-T410 PolarHBondContact OD1-N 2.85Å; D408-E411 PolarHBondContact O-N 3.48Å; D408-E411 PolarHBondContact OD1-N 2.86Å; D408-A412 PolarHBondContact O-N 3.04Å
409	E	93	Very high	91.9	Very high	177 Å²	177	41 Å²	41	83%	0.827	21%	0.211	S	C	*	.	H	α-helix	trans	-68	-27.1	-179.3	-67.6	-177.4	176.6	0	0	113.3	A412 K413	E409-A412 PolarHBondContact O-N 2.98Å; E409-K413 PolarHBondContact O-N 3.09Å
410	T	92.9	Very high	92.3	Very high	99 Å²	99	43.4 Å²	43.4	61%	0.607	23%	0.228	S	C	*	.	H	α-helix	trans	-70	-46.2	177.5	-53.2	0	0	0	0	109.6	D408 A412 K413 I414	D408-T410 VanDerWaalsContact C-N 3.29Å; D408-T410 PolarHBondContact O-N 3.22Å; D408-T410 WeakPolarHBondContact OD1-CA 3.34Å; D408-T410 VanDerWaalsContact OD1-CB 3.23Å; D408-T410 WeakPolarHBondContact OD1-CB 3.4Å; D408-T410 PolarHBondContact OD1-N 2.85Å; T410-A412 VanDerWaalsContact C-N 3.3Å; T410-A412 PolarHBondContact O-N 3.42Å; T410-K413 WeakPolarHBondContact O-CB 3.49Å; T410-K413 PolarHBondContact O-N 3.28Å; T410-I414 WeakPolarHBondContact O-CG1 3.44Å; T410-I414 PolarHBondContact O-N 3.3Å; T410-I414 VanDerWaalsContact O-N 3.15Å
411	E	94	Very high	92	Very high	11 Å²	11	48.7 Å²	48.7	5%	0.051	25%	0.248	C	C	.	.	H	α-helix	trans	-62	-38.5	173.9	-63.9	-166.6	147.5	0	0	111.5	K289 R310 M379 I406 S407 D408 K413 I414 L415	K289-E411 IonicContact NZ-OE2 3.5Å; R310-E411 IonicContact NH2-OE1 2.91Å; M379-E411 HydrophobicContact CB-CB 3.8Å; M379-E411 HydrophobicContact CB-CG 3.61Å; M379-E411 HydrophobicContact CG-CB 4.01Å; M379-E411 HydrophobicContact CG-CG 4.28Å; M379-E411 PolarHBondContact N-OE1 3.15Å; I406-E411 WeakPolarHBondContact CA-OE2 3.45Å; I406-E411 HydrophobicContact CG2-CB 3.97Å; S407-E411 PolarHBondContact N-OE2 2.88Å; S407-E411 PolarHBondContact OG-OE2 3.27Å; S407-E411 VanDerWaalsContact OG-OE2 3.12Å; D408-E411 PolarHBondContact O-N 3.48Å; D408-E411 PolarHBondContact OD1-N 2.86Å; E411-K413 VanDerWaalsContact C-N 3.32Å; E411-K413 PolarHBondContact O-N 2.62Å; E411-I414 PolarHBondContact O-N 3.1Å; E411-L415 PolarHBondContact O-N 3.41Å; E411-L415 VanDerWaalsContact O-N 3.08Å
412	A	93.4	Very high	91.3	Very high	23 Å²	23	49 Å²	49	19%	0.19	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-36.5	175.1	0	0	0	0	0	112.7	I406 D408 E409 T410 L415 N416	I406-A412 HydrophobicContact CG2-CB 3.97Å; D408-A412 PolarHBondContact O-N 3.04Å; E409-A412 PolarHBondContact O-N 2.98Å; T410-A412 VanDerWaalsContact C-N 3.3Å; T410-A412 PolarHBondContact O-N 3.42Å; A412-L415 PolarHBondContact O-N 3.23Å; A412-N416 PolarHBondContact O-N 3.13Å; A412-N416 VanDerWaalsContact O-N 3.1Å; A412-N416 PolarHBondContact O-ND2 2.97Å
413	K	93.3	Very high	90.5	Very high	135 Å²	135	55 Å²	55	59%	0.587	28%	0.281	S	S	*	.	H	α-helix	trans	-64.5	-45.2	175	-172.9	-177.9	177.1	-175.6	0	111.6	E409 T410 E411 L415 N416 D417	E409-K413 PolarHBondContact O-N 3.09Å; T410-K413 WeakPolarHBondContact O-CB 3.49Å; T410-K413 PolarHBondContact O-N 3.28Å; E411-K413 VanDerWaalsContact C-N 3.32Å; E411-K413 PolarHBondContact O-N 2.62Å; K413-L415 PolarHBondContact O-N 3.23Å; K413-N416 WeakPolarHBondContact O-CB 3.49Å; K413-N416 PolarHBondContact O-N 3Å; K413-D417 PolarHBondContact O-N 3.06Å
414	I	92.3	Very high	89.7	Confident	24 Å²	24	56 Å²	56	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-61.3	-37	177.4	-58.6	168.3	0	0	0	110.3	M379 P380 T410 E411 D417 V418	M379-I414 HydrophobicContact CE-CB 3.82Å; M379-I414 HydrophobicContact CE-CG2 3.51Å; M379-I414 HydrophobicContact CG-CB 4.16Å; M379-I414 HydrophobicContact CG-CD1 4.35Å; M379-I414 HydrophobicContact CG-CG2 4.22Å; P380-I414 WeakPolarHBondContact O-CD1 3.42Å; T410-I414 WeakPolarHBondContact O-CG1 3.44Å; T410-I414 PolarHBondContact O-N 3.3Å; T410-I414 VanDerWaalsContact O-N 3.15Å; E411-I414 PolarHBondContact O-N 3.1Å; I414-D417 PolarHBondContact O-N 2.96Å; I414-V418 WeakPolarHBondContact O-CG2 3.39Å; I414-V418 PolarHBondContact O-N 3.44Å
415	L	93	Very high	89	Confident	5 Å²	5	62.5 Å²	62.5	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-62.3	-44.6	174.8	-177.1	75.4	0	0	0	110.8	Y281 M379 I406 E411 A412 K413 D417 V418 Q419 I426	Y281-L415 HydrophobicContact CD1-CD2 3.47Å; Y281-L415 VanDerWaalsContact CD1-CD2 3.47Å; Y281-L415 HydrophobicContact CE1-CD2 4.06Å; Y281-L415 HydrophobicContact CG-CD2 3.75Å; M379-L415 HydrophobicContact CE-CB 4Å; M379-L415 HydrophobicContact CE-CD1 4.4Å; I406-L415 HydrophobicContact CD1-CB 3.83Å; I406-L415 HydrophobicContact CD1-CD1 4.38Å; I406-L415 HydrophobicContact CD1-CD2 3.37Å; I406-L415 HydrophobicContact CD1-CG 4.01Å; E411-L415 PolarHBondContact O-N 3.41Å; E411-L415 VanDerWaalsContact O-N 3.08Å; A412-L415 PolarHBondContact O-N 3.23Å; K413-L415 PolarHBondContact O-N 3.23Å; L415-D417 VanDerWaalsContact C-N 3.33Å; L415-D417 PolarHBondContact O-N 3.35Å; L415-V418 WeakPolarHBondContact O-CB 3.41Å; L415-V418 PolarHBondContact O-N 3.17Å; L415-Q419 WeakPolarHBondContact O-CG 3.48Å; L415-Q419 PolarHBondContact O-N 2.67Å; L415-I426 HydrophobicContact CD1-CB 4.33Å; L415-I426 HydrophobicContact CD1-CD1 3.61Å; L415-I426 HydrophobicContact CD1-CG2 4.2Å
416	N	91.6	Very high	88.6	Confident	79 Å²	79	62.6 Å²	62.6	42%	0.422	32%	0.323	S	S	.	.	H	α-helix	trans	-61.9	-42.8	176.7	-66.4	-25	0	0	0	111.5	A412 K413 V418 Q419 D420	A412-N416 PolarHBondContact O-N 3.13Å; A412-N416 VanDerWaalsContact O-N 3.1Å; A412-N416 PolarHBondContact O-ND2 2.97Å; K413-N416 WeakPolarHBondContact O-CB 3.49Å; K413-N416 PolarHBondContact O-N 3Å; N416-V418 PolarHBondContact O-N 3.3Å; N416-Q419 PolarHBondContact O-N 2.93Å; N416-Q419 VanDerWaalsContact O-N 3.09Å; N416-Q419 PolarHBondContact OD1-NE2 2.76Å; N416-D420 WeakPolarHBondContact O-CB 3.29Å; N416-D420 PolarHBondContact O-N 3.3Å
417	D	89.4	Confident	88.3	Confident	75 Å²	75	65.3 Å²	65.3	40%	0.401	34%	0.339	S	S	.	.	H	α-helix	trans	-60.1	-35.1	175.8	-62.6	-20.2	0	0	0	112	K413 I414 L415 R421	K413-D417 PolarHBondContact O-N 3.06Å; I414-D417 PolarHBondContact O-N 2.96Å; L415-D417 VanDerWaalsContact C-N 3.33Å; L415-D417 PolarHBondContact O-N 3.35Å; D417-R421 WeakPolarHBondContact O-CB 3.38Å; D417-R421 PolarHBondContact O-N 2.79Å
418	V	87.3	Confident	88.2	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-65.1	-49	172.6	168	0	0	0	0	110.9	M379 Y386 I414 L415 N416 R421 F422 V424 I426	M379-V418 HydrophobicContact CE-CG2 4.49Å; Y386-V418 HydrophobicContact CD1-CB 4.44Å; Y386-V418 HydrophobicContact CD1-CG1 3.46Å; Y386-V418 VanDerWaalsContact CD1-CG1 3.46Å; Y386-V418 HydrophobicContact CD1-CG2 4.04Å; Y386-V418 HydrophobicContact CD2-CG2 4.19Å; Y386-V418 HydrophobicContact CE1-CG1 3.63Å; Y386-V418 HydrophobicContact CG-CG1 3.99Å; Y386-V418 HydrophobicContact CG-CG2 3.73Å; I414-V418 WeakPolarHBondContact O-CG2 3.39Å; I414-V418 PolarHBondContact O-N 3.44Å; L415-V418 WeakPolarHBondContact O-CB 3.41Å; L415-V418 PolarHBondContact O-N 3.17Å; N416-V418 PolarHBondContact O-N 3.3Å; V418-R421 PolarHBondContact O-N 3.09Å; V418-F422 HydrophobicContact CG1-CD2 3.9Å; V418-F422 HydrophobicContact CG1-CE2 4.29Å; V418-F422 VanDerWaalsContact O-CD2 3.22Å; V418-F422 WeakPolarHBondContact O-CD2 3.41Å; V418-F422 PolarHBondContact O-N 3.37Å; V418-V424 HydrophobicContact CG1-CG2 4.48Å; V418-I426 HydrophobicContact CG1-CD1 3.77Å
419	Q	88.2	Confident	88.1	Confident	35 Å²	35	64.5 Å²	64.5	16%	0.164	34%	0.338	C	S	.	.	H	α-helix	trans	-61.3	-46.8	-178.6	-67.8	-175.7	127.8	0	0	111.6	L415 N416 D423 V424 I426	L415-Q419 WeakPolarHBondContact O-CG 3.48Å; L415-Q419 PolarHBondContact O-N 2.67Å; N416-Q419 PolarHBondContact O-N 2.93Å; N416-Q419 VanDerWaalsContact O-N 3.09Å; N416-Q419 PolarHBondContact OD1-NE2 2.76Å; Q419-D423 WeakPolarHBondContact O-CA 3.41Å; Q419-D423 PolarHBondContact O-N 3.02Å; Q419-V424 WeakPolarHBondContact CA-O 3.39Å; Q419-V424 WeakPolarHBondContact CB-O 3.37Å; Q419-V424 VanDerWaalsContact CG-O 3.27Å; Q419-V424 WeakPolarHBondContact CG-O 3.42Å; Q419-V424 PolarHBondContact O-N 3.49Å; Q419-V424 VanDerWaalsContact O-N 3.14Å; Q419-I426 HydrophobicContact CG-CB 4.21Å; Q419-I426 HydrophobicContact CG-CD1 3.98Å; Q419-I426 HydrophobicContact CG-CG1 4.04Å; Q419-I426 PolarHBondContact OE1-O 3.26Å; Q419-I426 VanDerWaalsContact OE1-O 3.12Å
420	D	85.9	Confident	87.8	Confident	132 Å²	132	58.8 Å²	58.8	71%	0.706	32%	0.316	S	S	*	.	H	α-helix	trans	-66	-41.7	-179.8	-68	-15	0	0	0	111.4	N416	N416-D420 WeakPolarHBondContact O-CB 3.29Å; N416-D420 PolarHBondContact O-N 3.3Å
421	R	79.7	Confident	87.3	Confident	110 Å²	110	66.2 Å²	66.2	42%	0.415	33%	0.333	S	S	.	.	H	α-helix	trans	-70.5	-39.2	-176.7	-177.8	176.1	179.5	-176.6	-5.2	113.2	S383 D384 D417 V418	S383-R421 VanDerWaalsContact OG-CD 3.25Å; S383-R421 WeakPolarHBondContact OG-CD 3.44Å; S383-R421 PolarHBondContact OG-NH1 3.17Å; D384-R421 IonicContact OD1-CZ 3.24Å; D384-R421 IonicContact OD1-NH1 2.67Å; D384-R421 PolarHBondContact OD1-NH1 3.47Å; D384-R421 IonicContact OD1-NH2 3.92Å; D384-R421 PolarHBondContact OD1-NH2 2.86Å; D384-R421 IonicContact OD2-CZ 3.38Å; D384-R421 IonicContact OD2-NH1 3.95Å; D384-R421 PolarHBondContact OD2-NH1 3.41Å; D384-R421 IonicContact OD2-NH2 2.85Å; D384-R421 PolarHBondContact OD2-NH2 3.45Å; D417-R421 WeakPolarHBondContact O-CB 3.38Å; D417-R421 PolarHBondContact O-N 2.79Å; V418-R421 PolarHBondContact O-N 3.09Å
422	F	74.6	Confident	86.5	Confident	7 Å²	7	74 Å²	74	3%	0.031	37%	0.369	C	S	.	.	H	α-helix	trans	-103.4	4	-174.4	-57.3	-61.1	0	0	0	113.6	L272 S383 L387 V418 V424	L272-F422 HydrophobicContact CB-CD1 3.91Å; L272-F422 HydrophobicContact CD1-CD1 3.65Å; L272-F422 HydrophobicContact CD1-CE1 3.73Å; L272-F422 HydrophobicContact CG-CD1 4.44Å; S383-F422 VanDerWaalsContact O-CE2 3.28Å; S383-F422 WeakPolarHBondContact O-CE2 3.24Å; L387-F422 HydrophobicContact CB-CE1 4.5Å; L387-F422 HydrophobicContact CB-CE2 4.06Å; L387-F422 HydrophobicContact CB-CZ 3.84Å; L387-F422 HydrophobicContact CD2-CD1 4.39Å; L387-F422 HydrophobicContact CD2-CE1 3.68Å; L387-F422 HydrophobicContact CD2-CZ 3.84Å; L387-F422 HydrophobicContact CG-CZ 4.35Å; V418-F422 HydrophobicContact CG1-CD2 3.9Å; V418-F422 HydrophobicContact CG1-CE2 4.29Å; V418-F422 VanDerWaalsContact O-CD2 3.22Å; V418-F422 WeakPolarHBondContact O-CD2 3.41Å; V418-F422 PolarHBondContact O-N 3.37Å; F422-V424 VanDerWaalsContact C-N 3.27Å; F422-V424 HydrophobicContact CB-CG1 4.18Å; F422-V424 HydrophobicContact CB-CG2 4.06Å; F422-V424 PolarHBondContact O-N 3.39Å
423	D	76.4	Confident	85.9	Confident	125 Å²	125	74.5 Å²	74.5	67%	0.668	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	48.7	-175.6	-163.9	26.1	0	0	0	111.6	Q419	Q419-D423 WeakPolarHBondContact O-CA 3.41Å; Q419-D423 PolarHBondContact O-N 3.02Å
424	V	78	Confident	85.1	Confident	21 Å²	21	73 Å²	73	13%	0.127	37%	0.367	C	S	.	.			trans	-117.5	133.7	-179.1	-67.9	0	0	0	0	110.7	T273 V418 Q419 F422 I426	T273-V424 HydrophobicContact CG2-CG1 4.5Å; V418-V424 HydrophobicContact CG1-CG2 4.48Å; Q419-V424 WeakPolarHBondContact CA-O 3.39Å; Q419-V424 WeakPolarHBondContact CB-O 3.37Å; Q419-V424 VanDerWaalsContact CG-O 3.27Å; Q419-V424 WeakPolarHBondContact CG-O 3.42Å; Q419-V424 PolarHBondContact O-N 3.49Å; Q419-V424 VanDerWaalsContact O-N 3.14Å; F422-V424 VanDerWaalsContact C-N 3.27Å; F422-V424 HydrophobicContact CB-CG1 4.18Å; F422-V424 HydrophobicContact CB-CG2 4.06Å; F422-V424 PolarHBondContact O-N 3.39Å; V424-I426 HydrophobicContact CG2-CD1 4.16Å; V424-I426 HydrophobicContact CG2-CG1 4.04Å; V424-I426 PolarHBondContact O-N 3.47Å
425	N	83.5	Confident	84.3	Confident	138 Å²	138	74.2 Å²	74.2	74%	0.738	38%	0.375	S	S	*	.			trans	-94.5	94.9	172.6	-175.2	6.7	0	0	0	109.8	T427	N425-T427 PolarHBondContact O-N 2.96Å
426	I	89	Confident	83.3	Confident	2 Å²	2	77.4 Å²	77.4	1%	0.01	39%	0.392	C	S	.	.			trans	-83.6	108.4	178.2	-57.2	169.6	0	0	0	107.1	Q279 Y281 Y386 L415 V418 Q419 V424	Q279-I426 HydrophobicContact CB-CG1 4.14Å; Q279-I426 HydrophobicContact CB-CG2 4.17Å; Y281-I426 HydrophobicContact CD1-CG2 4.06Å; Y281-I426 VanDerWaalsContact CD1-O 3.27Å; Y281-I426 WeakPolarHBondContact CD1-O 3.43Å; Y281-I426 WeakPolarHBondContact CE1-O 3.43Å; Y386-I426 HydrophobicContact CE1-CD1 4.13Å; Y386-I426 WeakPolarHBondContact OH-CD1 3.13Å; L415-I426 HydrophobicContact CD1-CB 4.33Å; L415-I426 HydrophobicContact CD1-CD1 3.61Å; L415-I426 HydrophobicContact CD1-CG2 4.2Å; V418-I426 HydrophobicContact CG1-CD1 3.77Å; Q419-I426 HydrophobicContact CG-CB 4.21Å; Q419-I426 HydrophobicContact CG-CD1 3.98Å; Q419-I426 HydrophobicContact CG-CG1 4.04Å; Q419-I426 PolarHBondContact OE1-O 3.26Å; Q419-I426 VanDerWaalsContact OE1-O 3.12Å; V424-I426 HydrophobicContact CG2-CD1 4.16Å; V424-I426 HydrophobicContact CG2-CG1 4.04Å; V424-I426 PolarHBondContact O-N 3.47Å
427	T	90.4	Very high	82.2	Confident	61 Å²	61	74.6 Å²	74.6	37%	0.374	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	157.2	-174.4	55.8	0	0	0	0	111.8	H280 Y281 N425 L429	H280-T427 CarbonylContact C-O 3.56Å; H280-T427 WeakPolarHBondContact CA-O 3.2Å; H280-T427 PolarHBondContact CE1-OG1 2.87Å; H280-T427 PolarHBondContact ND1-OG1 3.12Å; Y281-T427 WeakPolarHBondContact CD1-O 3.48Å; Y281-T427 PolarHBondContact N-O 2.97Å; N425-T427 PolarHBondContact O-N 2.96Å; T427-L429 PolarHBondContact O-N 3.25Å
428	S	92.8	Very high	81.3	Confident	69 Å²	69	71.1 Å²	71.1	48%	0.483	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.8	141	166.6	-177	0	0	0	0	109.5	Y281 P430	Y281-S428 CarbonylContact O-C 3.57Å; Y281-S428 WeakPolarHBondContact O-CA 3.42Å; S428-P430 WeakPolarHBondContact O-CD 3.39Å
429	L	91.5	Very high	79.9	Confident	26 Å²	26	72.4 Å²	72.4	14%	0.136	37%	0.374	C	S	.	.	P	Polyproline II helix	trans	-54.7	122.4	177.8	-167.8	76.7	0	0	0	110	H280 Y281 V282 L296 I403 T427 I433	H280-L429 HydrophobicContact CB-CB 4.22Å; H280-L429 HydrophobicContact CB-CD1 3.57Å; Y281-L429 PolarHBondContact O-N 2.99Å; V282-L429 HydrophobicContact CG2-CB 3.66Å; V282-L429 HydrophobicContact CG2-CD2 3.62Å; V282-L429 HydrophobicContact CG2-CG 4.18Å; L296-L429 HydrophobicContact CD1-CD2 4.1Å; L296-L429 HydrophobicContact CD2-CD2 3.62Å; I403-L429 HydrophobicContact CD1-CD1 3.77Å; I403-L429 HydrophobicContact CG1-CD1 3.96Å; I403-L429 HydrophobicContact CG2-CD1 4.43Å; T427-L429 PolarHBondContact O-N 3.25Å; L429-I433 HydrophobicContact CD1-CD1 3.47Å; L429-I433 VanDerWaalsContact CD1-CD1 3.47Å; L429-I433 HydrophobicContact CD1-CG1 4.42Å; L429-I433 HydrophobicContact CG-CD1 4.19Å
430	P	87	Confident	78.2	Confident	57 Å²	57	78.4 Å²	78.4	37%	0.37	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-68.8	163.2	176.4	29.6	-34	0	0	0	110.4	S428 E432 I433	S428-P430 WeakPolarHBondContact O-CD 3.39Å; P430-E432 VanDerWaalsContact C-N 3.26Å; P430-E432 WeakPolarHBondContact CB-O 3.49Å; P430-E432 WeakPolarHBondContact CG-O 3.36Å; P430-E432 PolarHBondContact O-N 3.47Å; P430-I433 HydrophobicContact CG-CG1 4.1Å
431	R	81.4	Confident	76.4	Confident	256 Å²	256	79.4 Å²	79.4	97%	0.966	40%	0.398	S	S	*	.	S	Bend	trans	-66.5	-31.8	178	-70.7	-175.1	179	171	0.4	112.6
432	E	77.8	Confident	76.2	Confident	173 Å²	173	77.9 Å²	77.9	81%	0.808	40%	0.398	S	S	*	.	S	Bend	trans	-126.5	134.3	178.4	-67.4	174.1	-169.6	0	0	107.5	P430	P430-E432 VanDerWaalsContact C-N 3.26Å; P430-E432 WeakPolarHBondContact CB-O 3.49Å; P430-E432 WeakPolarHBondContact CG-O 3.36Å; P430-E432 PolarHBondContact O-N 3.47Å
433	I	80.4	Confident	76.3	Confident	34 Å²	34	81.6 Å²	81.6	17%	0.174	42%	0.417	C	S	.	.			trans	-114.6	123.5	174.3	-51.5	-177.9	0	0	0	106.4	L300 L401 I403 L429 P430 V435 Y438	L300-I433 HydrophobicContact CD2-CB 4.29Å; L300-I433 HydrophobicContact CD2-CD1 3.78Å; L300-I433 HydrophobicContact CD2-CG1 4.46Å; L401-I433 HydrophobicContact CD2-CD1 4.2Å; I403-I433 HydrophobicContact CD1-CD1 4.44Å; L429-I433 HydrophobicContact CD1-CD1 3.47Å; L429-I433 VanDerWaalsContact CD1-CD1 3.47Å; L429-I433 HydrophobicContact CD1-CG1 4.42Å; L429-I433 HydrophobicContact CG-CD1 4.19Å; P430-I433 HydrophobicContact CG-CG1 4.1Å; I433-V435 PolarHBondContact O-N 2.92Å; I433-Y438 HydrophobicContact CB-CE1 4.37Å; I433-Y438 HydrophobicContact CG2-CD1 3.84Å; I433-Y438 HydrophobicContact CG2-CE1 3.59Å
434	D	76.6	Confident	76.3	Confident	105 Å²	105	79.2 Å²	79.2	56%	0.561	40%	0.403	S	S	*	.			trans	-66.7	120.6	174	179.9	6	0	0	0	109.7	D436 S437 Y438	D434-D436 PolarHBondContact O-N 3.35Å; D434-D436 PolarHBondContact OD1-N 3.32Å; D434-S437 VanDerWaalsContact O-CB 3.25Å; D434-S437 WeakPolarHBondContact O-CB 3.41Å; D434-S437 PolarHBondContact O-N 3.46Å; D434-S437 PolarHBondContact O-OG 3.5Å; D434-Y438 WeakPolarHBondContact O-CD1 3.41Å; D434-Y438 WeakPolarHBondContact O-CE1 3.5Å
435	V	75.7	Confident	76.2	Confident	49 Å²	49	82.6 Å²	82.6	30%	0.297	42%	0.419	S	S	.	.	G	3₁₀ helix	trans	-59.7	-34.9	178.8	-177.9	0	0	0	0	111.1	E301 I433 S437 Y438 G439	E301-V435 HydrophobicContact CB-CG1 4.06Å; E301-V435 HydrophobicContact CG-CG1 4.44Å; I433-V435 PolarHBondContact O-N 2.92Å; V435-S437 PolarHBondContact O-N 3.21Å; V435-S437 VanDerWaalsContact O-N 3.1Å; V435-Y438 PolarHBondContact O-N 2.93Å; V435-G439 WeakPolarHBondContact O-CA 3.41Å; V435-G439 PolarHBondContact O-N 2.73Å
436	D	71.2	Confident	75.7	Confident	72 Å²	72	79.2 Å²	79.2	39%	0.385	40%	0.399	S	S	.	.	G	3₁₀ helix	trans	-66.1	-14.8	178.1	-89.4	-34.1	0	0	0	112.4	K399 D434 Y438 R440	K399-D436 WeakPolarHBondContact CD-O 3.47Å; K399-D436 PolarHBondContact NZ-O 3.04Å; D434-D436 PolarHBondContact O-N 3.35Å; D434-D436 PolarHBondContact OD1-N 3.32Å; D436-Y438 VanDerWaalsContact C-N 3.31Å; D436-R440 IonicContact OD1-CZ 2.66Å; D436-R440 IonicContact OD1-NE 3.42Å; D436-R440 PolarHBondContact OD1-NE 3.28Å; D436-R440 IonicContact OD1-NH2 3.43Å; D436-R440 PolarHBondContact OD1-NH2 3.43Å; D436-R440 VanDerWaalsContact OD1-NH2 3.08Å; D436-R440 IonicContact OD2-NH2 3.19Å; D436-R440 PolarHBondContact OD2-NH2 3.46Å
437	S	68.9	Low	74.8	Confident	19 Å²	19	84.3 Å²	84.3	13%	0.133	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-75.5	-16.9	174.7	76.2	0	0	0	0	113.3	H278 K399 D434 V435	H278-S437 PolarHBondContact CD2-O 3.31Å; H278-S437 PolarHBondContact NE2-O 3.39Å; K399-S437 WeakPolarHBondContact CB-O 3.48Å; K399-S437 WeakPolarHBondContact CD-O 3.31Å; D434-S437 VanDerWaalsContact O-CB 3.25Å; D434-S437 WeakPolarHBondContact O-CB 3.41Å; D434-S437 PolarHBondContact O-N 3.46Å; D434-S437 PolarHBondContact O-OG 3.5Å; V435-S437 PolarHBondContact O-N 3.21Å; V435-S437 VanDerWaalsContact O-N 3.1Å
438	Y	69.8	Low	73.7	Confident	2 Å²	2	86 Å²	86	1%	0.008	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.6	-2.2	-177.5	68.1	-89.4	0	0	0	115.8	L300 E301 N372 I373 L401 I433 D434 V435 D436	L300-Y438 HydrophobicContact CD2-CE1 4.24Å; L300-Y438 WeakPolarHBondContact CD2-OH 3.32Å; E301-Y438 PolarHBondContact N-OH 3.47Å; E301-Y438 WeakPolarHBondContact O-CE2 3.45Å; N372-Y438 PolarHBondContact ND2-O 2.86Å; I373-Y438 HydrophobicContact CD1-CD2 4.04Å; I373-Y438 HydrophobicContact CD1-CE2 3.73Å; I373-Y438 HydrophobicContact CG1-CD2 4.21Å; I373-Y438 HydrophobicContact CG1-CE2 4.39Å; L401-Y438 HydrophobicContact CB-CD2 4.25Å; L401-Y438 HydrophobicContact CB-CG 3.96Å; L401-Y438 HydrophobicContact CD2-CD1 4.06Å; L401-Y438 HydrophobicContact CD2-CD2 4.3Å; L401-Y438 HydrophobicContact CD2-CE1 4.22Å; L401-Y438 HydrophobicContact CD2-CE2 4.43Å; L401-Y438 HydrophobicContact CD2-CG 4.13Å; I433-Y438 HydrophobicContact CB-CE1 4.37Å; I433-Y438 HydrophobicContact CG2-CD1 3.84Å; I433-Y438 HydrophobicContact CG2-CE1 3.59Å; D434-Y438 WeakPolarHBondContact O-CD1 3.41Å; D434-Y438 WeakPolarHBondContact O-CE1 3.5Å; V435-Y438 PolarHBondContact O-N 2.93Å; D436-Y438 VanDerWaalsContact C-N 3.31Å
439	G	58.8	Low	72.3	Confident	28 Å²	28	87.3 Å²	87.3	29%	0.289	43%	0.425	S	S	.	.			trans	-97.2	-21	-170.7	0	0	0	0	0	116.8	V435 I441	V435-G439 WeakPolarHBondContact O-CA 3.41Å; V435-G439 PolarHBondContact O-N 2.73Å; G439-I441 PolarHBondContact O-N 2.85Å
440	R	52.9	Low	70.6	Confident	161 Å²	161	92.4 Å²	92.4	61%	0.608	45%	0.449	S	S	*	.			trans	-82.9	111.7	179.4	-66.3	-171.7	-165	-171.7	2.5	110.6	D436	D436-R440 IonicContact OD1-CZ 2.66Å; D436-R440 IonicContact OD1-NE 3.42Å; D436-R440 PolarHBondContact OD1-NE 3.28Å; D436-R440 IonicContact OD1-NH2 3.43Å; D436-R440 PolarHBondContact OD1-NH2 3.43Å; D436-R440 VanDerWaalsContact OD1-NH2 3.08Å; D436-R440 IonicContact OD2-NH2 3.19Å; D436-R440 PolarHBondContact OD2-NH2 3.46Å
441	I	47.2	Very low	69.2	Low	153 Å²	153	95.6 Å²	95.6	79%	0.785	46%	0.456	S	S	*	.			trans	-73.2	0	159	-65.5	-179.7	0	0	0	107.8	N303 T398 G439	N303-I441 WeakPolarHBondContact ND2-CD1 3.34Å; T398-I441 HydrophobicContact CG2-CG2 4.17Å; G439-I441 PolarHBondContact O-N 2.85Å

Retrieved 441 of 441 residues in 117.6 ms (Link to these results)

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