G4VGN6_SCHMA Loading...

Phosphatidylinositol 4-kinase type 2

AlphaFold DB , UniProt , Accession G4VGN6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 581 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.2	Very low	33.4	Very low	238 Å²	238	150 Å²	150	100%	1.172	81%	0.808	S	S	*	*				0	125.7	0	-81.3	-84.5	173.6	0	0	108.4
2	P	39.4	Very low	33.1	Very low	108 Å²	108	150.8 Å²	150.8	70%	0.701	81%	0.811	S	S	*	*			cis	-128.2	139.5	-40.7	38	-23	0	0	0	111.7
3	S	31.6	Very low	33.2	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	81%	0.811	S	S	*	*				76.3	125.6	99.8	84	0	0	0	0	117.6
4	L	38.1	Very low	33	Very low	180 Å²	180	148.6 Å²	148.6	94%	0.942	81%	0.813	S	S	*	*			trans	171.2	115.6	145.3	-91.6	156.8	0	0	0	105.7
5	G	30.9	Very low	33	Very low	67 Å²	67	154.9 Å²	154.9	69%	0.691	82%	0.82	S	S	*	*			cis	105.3	89.4	13.2	0	0	0	0	0	111.1
6	I	38.4	Very low	32.8	Very low	177 Å²	177	153.9 Å²	153.9	91%	0.908	82%	0.816	S	S	*	*			trans	-145	127.5	154	-62.4	-170.4	0	0	0	110.4
7	I	29.3	Very low	32.9	Very low	151 Å²	151	155.8 Å²	155.8	77%	0.774	82%	0.818	S	S	*	*			trans	-109.4	150.4	178.8	-73.8	166.4	0	0	0	108.8	V9	I7-V9 HydrophobicContact CG2-CG2 4.01Å
8	S	33	Very low	32.7	Very low	109 Å²	109	152.3 Å²	152.3	76%	0.762	82%	0.816	S	S	*	*			trans	168.4	108.3	139	-162.2	0	0	0	0	107.4
9	V	30.1	Very low	32.7	Very low	97 Å²	97	153.4 Å²	153.4	59%	0.588	82%	0.82	S	S	*	*				49.8	109.1	63.6	-152.6	0	0	0	0	114.2	I7	I7-V9 HydrophobicContact CG2-CG2 4.01Å
10	Y	31.1	Very low	32.5	Very low	195 Å²	195	155.4 Å²	155.4	77%	0.765	82%	0.821	S	S	*	*				158.5	129.4	113.1	-107	-74.3	0	0	0	115
11	R	32.1	Very low	32.4	Very low	222 Å²	222	153.7 Å²	153.7	84%	0.838	82%	0.817	S	S	*	*			trans	93	123.5	130.1	-121.5	169.5	-161.2	169.8	4	123.1
12	D	29.4	Very low	32.3	Very low	159 Å²	159	149.4 Å²	149.4	85%	0.85	80%	0.799	S	S	*	*			trans	-47.6	154.1	161	-66	-58.3	0	0	0	116.4
13	G	34.7	Very low	31.8	Very low	78 Å²	78	150.4 Å²	150.4	80%	0.804	80%	0.802	S	S	*	*			trans	-170	85.9	165.4	0	0	0	0	0	112.9
14	F	30.2	Very low	31.8	Very low	193 Å²	193	152.9 Å²	152.9	85%	0.846	81%	0.808	S	S	*	*			trans	-46.3	135.9	162.1	-94.7	-101.5	0	0	0	112.1
15	R	33	Very low	31.5	Very low	243 Å²	243	147.8 Å²	147.8	92%	0.917	80%	0.798	S	S	*	*			trans	-164.3	119.5	135.9	-112.5	170.1	-179.1	-177.3	-0.4	113.1
16	N	30.3	Very low	31.4	Very low	140 Å²	140	154.7 Å²	154.7	75%	0.749	81%	0.81	S	S	*	*			trans	-52.1	134.4	165.1	-68.8	-41.7	0	0	0	111.6
17	H	34.4	Very low	31.2	Very low	185 Å²	185	150.8 Å²	150.8	86%	0.856	80%	0.798	S	S	*	*			trans	-136.8	107.8	145.8	-102.5	-70.8	0	0	0	109.1
18	A	29.1	Very low	31.2	Very low	94 Å²	94	151.8 Å²	151.8	78%	0.777	80%	0.804	S	S	*	*			trans	-67.5	127.9	165.4	0	0	0	0	0	109.2
19	L	33.6	Very low	31.1	Very low	173 Å²	173	154.2 Å²	154.2	91%	0.906	80%	0.804	S	S	*	*			trans	-125.2	111.2	155.5	-79.2	172.3	0	0	0	107.8
20	K	27.3	Very low	31.2	Very low	192 Å²	192	157.4 Å²	157.4	84%	0.835	82%	0.817	S	S	*	*			trans	-75.2	169.3	165.7	-128.9	176.2	-179	-178.7	0	108.1
21	V	30.6	Very low	31.3	Very low	120 Å²	120	157.1 Å²	157.1	73%	0.727	83%	0.828	S	S	*	*			trans	87.5	124.3	167	-164.5	0	0	0	0	112.2
22	D	31	Very low	31.2	Very low	149 Å²	149	151.6 Å²	151.6	80%	0.797	82%	0.824	S	S	*	*			cis	-152	157.1	8.2	-114.7	-21.6	0	0	0	110.5
23	V	29.6	Very low	31.3	Very low	128 Å²	128	153 Å²	153	78%	0.776	83%	0.827	S	S	*	*			trans	-81	124.6	168.9	171.8	0	0	0	0	107.4
24	D	32.3	Very low	31.2	Very low	159 Å²	159	154 Å²	154	85%	0.85	83%	0.828	S	S	*	*			trans	-160.8	147	151.8	-94.6	-30.6	0	0	0	112.1
25	G	30.1	Very low	31.2	Very low	73 Å²	73	149.7 Å²	149.7	75%	0.753	83%	0.828	S	S	*	*			trans	-71.4	149.7	-154.8	0	0	0	0	0	116.7
26	F	30.4	Very low	31.3	Very low	211 Å²	211	146.9 Å²	146.9	93%	0.925	83%	0.826	S	S	*	*			trans	-106.5	105.5	160.6	-103	-91	0	0	0	108.8
27	S	32.6	Very low	31.4	Very low	96 Å²	96	147.5 Å²	147.5	67%	0.671	83%	0.829	S	S	*	*			trans	-67.5	142.1	164.4	-170.6	0	0	0	0	109.6	E29	S27-E29 PolarHBondContact O-N 3.45Å
28	L	29.6	Very low	31.4	Very low	171 Å²	171	146.7 Å²	146.7	90%	0.895	83%	0.831	S	S	*	*	S	Bend	trans	-98.6	70.1	-173.5	-168.8	101.5	0	0	0	109.8
29	E	32.3	Very low	31.6	Very low	161 Å²	161	150.6 Å²	150.6	75%	0.752	83%	0.833	S	S	*	*			trans	-157.3	89	179	-95.4	150.2	-158.6	0	0	107.3	S27	S27-E29 PolarHBondContact O-N 3.45Å
30	D	32.3	Very low	31.8	Very low	164 Å²	164	150.5 Å²	150.5	88%	0.877	83%	0.833	S	S	*	*			trans	174.1	66.1	160.3	-91.2	-20.2	0	0	0	111
31	L	33	Very low	32.8	Very low	189 Å²	189	145.3 Å²	145.3	99%	0.99	83%	0.826	S	S	*	*			trans	-145.1	67.6	161.8	-90.1	172.2	0	0	0	109.6
32	S	29.3	Very low	33.4	Very low	106 Å²	106	145.6 Å²	145.6	74%	0.741	83%	0.831	S	S	*	*			trans	-136.9	143.4	157.6	83	0	0	0	0	108
33	M	31	Very low	33.6	Very low	187 Å²	187	147 Å²	147	92%	0.921	84%	0.837	S	S	*	*			trans	102.1	96	-179.3	-57.7	-92.9	170.2	0	0	115
34	A	33.7	Very low	34.3	Very low	100 Å²	100	147.9 Å²	147.9	83%	0.826	84%	0.837	S	S	*	*				167.6	99	112.3	0	0	0	0	0	110.2
35	A	30.3	Very low	34.3	Very low	103 Å²	103	143.4 Å²	143.4	85%	0.851	83%	0.828	S	S	*	*			trans	-81.9	119.3	161	0	0	0	0	0	108.6
36	Q	34.9	Very low	34.4	Very low	184 Å²	184	147.6 Å²	147.6	86%	0.86	83%	0.833	S	S	*	*			trans	-146	114.9	160.1	-76.1	-162.9	-31.4	0	0	110.3
37	N	31.5	Very low	34.9	Very low	153 Å²	153	143 Å²	143	82%	0.818	82%	0.822	S	S	*	*			trans	30.6	107.3	147.9	-66.8	-4.5	0	0	0	119.5
38	D	35.7	Very low	35.2	Very low	168 Å²	168	142.3 Å²	142.3	90%	0.898	82%	0.817	S	S	*	*			trans	-148.7	83.2	142.3	-119.9	-17.6	0	0	0	109.3	N40	D38-N40 PolarHBondContact O-N 3.37Å
39	E	32.2	Very low	35.6	Very low	175 Å²	175	140.2 Å²	140.2	82%	0.818	81%	0.807	S	S	*	*			trans	-76.8	102	168.1	-68.1	-170.7	156.8	0	0	108.1
40	N	38.4	Very low	35.6	Very low	172 Å²	172	140.1 Å²	140.1	92%	0.92	81%	0.811	S	S	*	*			trans	174.6	34.8	154.1	-85.8	-33.9	0	0	0	113.9	D38	D38-N40 PolarHBondContact O-N 3.37Å
41	A	48.5	Very low	35.6	Very low	83 Å²	83	140.2 Å²	140.2	69%	0.686	81%	0.805	S	S	*	*	S	Bend	trans	-110.2	134.4	169.7	0	0	0	0	0	110	L43	A41-L43 PolarHBondContact O-N 2.98Å
42	P	43.2	Very low	35.6	Very low	126 Å²	126	134.9 Å²	134.9	82%	0.818	78%	0.783	S	S	*	*			trans	-63.6	124.7	179.5	26.7	-31	0	0	0	109	L44	P42-L44 PolarHBondContact O-N 2.88Å
43	L	34.5	Very low	35.8	Very low	177 Å²	177	134.9 Å²	134.9	93%	0.927	78%	0.78	S	S	*	*			trans	-44.2	99.7	-177.7	-72.6	153.9	0	0	0	112	A41 G45	A41-L43 PolarHBondContact O-N 2.98Å; L43-G45 PolarHBondContact O-N 3.13Å
44	L	44	Very low	36.1	Very low	148 Å²	148	131.7 Å²	131.7	78%	0.775	77%	0.767	S	S	*	*			trans	-74.5	112	156.3	-99.6	147.1	0	0	0	106	P42 D46	P42-L44 PolarHBondContact O-N 2.88Å; L44-D46 PolarHBondContact O-N 3.43Å; L44-D46 VanDerWaalsContact O-N 3.13Å
45	G	33	Very low	36.9	Very low	64 Å²	64	132.9 Å²	132.9	66%	0.66	76%	0.764	S	S	*	*			trans	-52.6	118.7	172.5	0	0	0	0	0	109.8	L43 V47	L43-G45 PolarHBondContact O-N 3.13Å; G45-V47 PolarHBondContact O-N 3.2Å
46	D	32.4	Very low	38.3	Very low	161 Å²	161	132.4 Å²	132.4	86%	0.861	74%	0.741	S	S	*	*			trans	-68.7	88.3	166.1	-161.4	15.7	0	0	0	106.7	L44	L44-D46 PolarHBondContact O-N 3.43Å; L44-D46 VanDerWaalsContact O-N 3.13Å
47	V	40.3	Very low	40	Very low	115 Å²	115	126.1 Å²	126.1	70%	0.697	72%	0.718	S	S	*	*			trans	-104.6	90.5	167.6	-170	0	0	0	0	105.6	G45 D49	G45-V47 PolarHBondContact O-N 3.2Å; V47-D49 PolarHBondContact O-N 2.95Å; V47-D49 VanDerWaalsContact O-N 3.08Å
48	S	39.2	Very low	41.8	Very low	81 Å²	81	119.9 Å²	119.9	57%	0.566	69%	0.685	S	S	*	*			trans	-45	113.6	149.1	53.2	0	0	0	0	107.4	N50	S48-N50 PolarHBondContact O-N 3.37Å
49	D	38.3	Very low	43.7	Very low	128 Å²	128	112.9 Å²	112.9	68%	0.684	65%	0.648	S	S	*	*			trans	-54.9	92.2	167.6	-83	-35.9	0	0	0	108.3	V47 F51	V47-D49 PolarHBondContact O-N 2.95Å; V47-D49 VanDerWaalsContact O-N 3.08Å; D49-F51 HydrophobicContact CB-CB 4.38Å; D49-F51 HydrophobicContact CB-CD2 4.01Å; D49-F51 PolarHBondContact O-N 2.91Å
50	N	31.3	Very low	45.7	Very low	158 Å²	158	105.9 Å²	105.9	85%	0.845	62%	0.617	S	S	*	*			trans	-72.7	51.6	156.4	-83.9	-14.1	0	0	0	108.6	S48 S52	S48-N50 PolarHBondContact O-N 3.37Å; N50-S52 PolarHBondContact O-N 3.46Å
51	F	33.3	Very low	46.9	Very low	167 Å²	167	100.8 Å²	100.8	73%	0.732	59%	0.589	S	S	*	*			trans	-74.4	114.5	168.3	-104.7	-90.5	0	0	0	107.4	D49	D49-F51 HydrophobicContact CB-CB 4.38Å; D49-F51 HydrophobicContact CB-CD2 4.01Å; D49-F51 PolarHBondContact O-N 2.91Å
52	S	31.9	Very low	47.3	Very low	77 Å²	77	101.3 Å²	101.3	54%	0.538	58%	0.581	S	S	.	*			trans	-50.2	133.4	160.5	-163.3	0	0	0	0	108.1	N50 D54	N50-S52 PolarHBondContact O-N 3.46Å; S52-D54 WeakPolarHBondContact CB-OD2 3.35Å; S52-D54 PolarHBondContact O-N 3.46Å; S52-D54 PolarHBondContact OG-OD2 3.17Å
53	P	34.7	Very low	47.9	Very low	105 Å²	105	100 Å²	100	68%	0.682	57%	0.566	S	S	*	*			trans	-76.5	40.5	-172.5	32.6	-35.1	0	0	0	113.1
54	D	37.8	Very low	48.9	Very low	120 Å²	120	98.7 Å²	98.7	64%	0.642	56%	0.555	S	S	*	*			trans	-98.8	106.1	-173.1	-61.4	-45	0	0	0	110.8	S52	S52-D54 WeakPolarHBondContact CB-OD2 3.35Å; S52-D54 PolarHBondContact O-N 3.46Å; S52-D54 PolarHBondContact OG-OD2 3.17Å
55	T	48.8	Very low	50	Low	126 Å²	126	99 Å²	99	77%	0.773	56%	0.557	S	S	*	*			trans	60.9	106.6	160.3	-46.1	0	0	0	0	116.5	S57	T55-S57 PolarHBondContact O-N 2.82Å
56	Y	59.4	Low	52.3	Low	93 Å²	93	97.8 Å²	97.8	37%	0.365	54%	0.535	S	S	.	.			trans	-57.4	101.9	162	171.4	-104	0	0	0	108.8	P58 R174 P214	Y56-P58 HydrophobicContact CD1-CG 4.16Å; Y56-P58 HydrophobicContact CE1-CB 4.28Å; Y56-P58 HydrophobicContact CE1-CG 3.66Å; Y56-P58 WeakPolarHBondContact O-CD 3.29Å; Y56-R174 HydrophobicContact CE2-CB 4.04Å; Y56-R174 PolarHBondContact OH-O 2.95Å; Y56-P214 HydrophobicContact CD2-CB 4.45Å; Y56-P214 HydrophobicContact CD2-CG 4.43Å; Y56-P214 HydrophobicContact CE2-CB 3.73Å; Y56-P214 HydrophobicContact CE2-CG 4.19Å
57	S	71.1	Confident	54.9	Low	52 Å²	52	93.7 Å²	93.7	36%	0.364	52%	0.52	S	S	.	.			trans	-94.4	114.4	166.8	-172.3	0	0	0	0	108.6	T55 L59 R174	T55-S57 PolarHBondContact O-N 2.82Å; S57-L59 WeakPolarHBondContact CB-O 3.34Å; S57-L59 PolarHBondContact O-N 2.76Å; S57-L59 PolarHBondContact OG-O 3.32Å; S57-R174 PolarHBondContact O-NE 2.92Å; S57-R174 PolarHBondContact O-NH2 2.8Å
58	P	70	Confident	57.3	Low	21 Å²	21	93.9 Å²	93.9	14%	0.136	52%	0.517	C	S	.	.	S	Bend	trans	-56.9	-33.8	173.2	-20.2	28.9	0	0	0	111.8	Y56 L73 L77 V173 R174	Y56-P58 HydrophobicContact CD1-CG 4.16Å; Y56-P58 HydrophobicContact CE1-CB 4.28Å; Y56-P58 HydrophobicContact CE1-CG 3.66Å; Y56-P58 WeakPolarHBondContact O-CD 3.29Å; P58-L73 HydrophobicContact CB-CD2 4.18Å; P58-L77 HydrophobicContact CB-CD1 3.92Å; P58-L77 HydrophobicContact CG-CD1 3.61Å; P58-V173 CarbonylContact O-C 3.55Å; P58-V173 VanDerWaalsContact O-CA 3.23Å; P58-V173 WeakPolarHBondContact O-CA 3.49Å; P58-V173 WeakPolarHBondContact O-CB 3.48Å; P58-R174 PolarHBondContact O-N 3.47Å
59	L	75.3	Confident	59.9	Low	21 Å²	21	90.1 Å²	90.1	11%	0.11	49%	0.49	C	S	.	.	B	Isolated β-bridge	trans	-90.8	127.7	176.4	-168.3	65.3	0	0	0	109.7	S57 N61 F69 L73 R171 V173	S57-L59 WeakPolarHBondContact CB-O 3.34Å; S57-L59 PolarHBondContact O-N 2.76Å; S57-L59 PolarHBondContact OG-O 3.32Å; L59-N61 WeakPolarHBondContact CD2-O 3.41Å; L59-N61 WeakPolarHBondContact CG-O 3.34Å; L59-F69 HydrophobicContact CD1-CE1 4.1Å; L59-L73 HydrophobicContact CB-CD2 4.48Å; L59-R171 HydrophobicContact CD1-CB 4.4Å; L59-V173 HydrophobicContact CD1-CG1 4.24Å
60	V	73.4	Confident	62.5	Low	28 Å²	28	86.3 Å²	86.3	17%	0.17	47%	0.47	C	S	.	.	S	Bend	trans	-79	-33.5	-175.3	-173.6	0	0	0	0	112	V172 R174 I216 I369	V60-V172 HydrophobicContact CB-CG1 4.19Å; V60-V172 HydrophobicContact CG2-CB 4.5Å; V60-V172 HydrophobicContact CG2-CG1 3.81Å; V60-V172 PolarHBondContact N-O 3.16Å; V60-R174 HydrophobicContact CG2-CG 4.11Å; V60-I216 HydrophobicContact CG2-CD1 4.24Å; V60-I216 HydrophobicContact CG2-CG1 4.42Å; V60-I369 HydrophobicContact CG1-CD1 4.31Å; V60-I369 HydrophobicContact CG1-CG2 3.57Å
61	N	65.4	Low	65.4	Low	65 Å²	65	83.5 Å²	83.5	35%	0.348	46%	0.455	S	S	.	.	S	Bend	trans	-129.8	116.7	176.1	-70.7	2.5	0	0	0	109.2	L59 I63 I369	L59-N61 WeakPolarHBondContact CD2-O 3.41Å; L59-N61 WeakPolarHBondContact CG-O 3.34Å; N61-I63 VanDerWaalsContact C-N 3.31Å; N61-I63 PolarHBondContact O-N 3.08Å; N61-I369 WeakPolarHBondContact ND2-CD1 3.49Å
62	D	56.3	Low	68.4	Low	94 Å²	94	77.4 Å²	77.4	50%	0.503	43%	0.431	S	S	.	.			trans	-73.8	85.3	173.2	-159.7	-9.9	0	0	0	109.3	H64	D62-H64 VanDerWaalsContact C-N 3.27Å; D62-H64 PolarHBondContact O-N 3.03Å; D62-H64 WeakPolarHBondContact OD1-CA 3.36Å; D62-H64 IonicContact OD1-CE1 2.79Å; D62-H64 IonicContact OD1-CG 2.74Å; D62-H64 IonicContact OD1-ND1 3.58Å; D62-H64 PolarHBondContact OD1-ND1 3.23Å; D62-H64 VanDerWaalsContact OD1-ND1 3.17Å; D62-H64 IonicContact OD2-CE1 2.78Å; D62-H64 PolarHBondContact OD2-CE1 3.05Å; D62-H64 IonicContact OD2-ND1 2.68Å; D62-H64 PolarHBondContact OD2-ND1 2.83Å; D62-H64 VanDerWaalsContact OD2-ND1 3.12Å; D62-H64 IonicContact OD2-NE2 2.76Å
63	I	56.1	Low	71.4	Confident	100 Å²	100	73.9 Å²	73.9	51%	0.513	41%	0.406	S	S	.	.			trans	-82	90.7	161.1	-55.5	174.8	0	0	0	104.1	N61 N65	N61-I63 VanDerWaalsContact C-N 3.31Å; N61-I63 PolarHBondContact O-N 3.08Å; I63-N65 PolarHBondContact O-N 3.15Å
64	H	54.4	Low	74.2	Confident	149 Å²	149	74.3 Å²	74.3	69%	0.69	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	11	-168.2	-80.1	-66.1	0	0	0	118.5	D62	D62-H64 VanDerWaalsContact C-N 3.27Å; D62-H64 PolarHBondContact O-N 3.03Å; D62-H64 WeakPolarHBondContact OD1-CA 3.36Å; D62-H64 IonicContact OD1-CE1 2.79Å; D62-H64 IonicContact OD1-CG 2.74Å; D62-H64 IonicContact OD1-ND1 3.58Å; D62-H64 PolarHBondContact OD1-ND1 3.23Å; D62-H64 VanDerWaalsContact OD1-ND1 3.17Å; D62-H64 IonicContact OD2-CE1 2.78Å; D62-H64 PolarHBondContact OD2-CE1 3.05Å; D62-H64 IonicContact OD2-ND1 2.68Å; D62-H64 PolarHBondContact OD2-ND1 2.83Å; D62-H64 VanDerWaalsContact OD2-ND1 3.12Å; D62-H64 IonicContact OD2-NE2 2.76Å
65	N	66.8	Low	77	Confident	153 Å²	153	70.2 Å²	70.2	82%	0.818	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	6	-164.9	-77.2	-3.1	0	0	0	116.6	I63	I63-N65 PolarHBondContact O-N 3.15Å
66	D	81.9	Confident	79.2	Confident	39 Å²	39	64.2 Å²	64.2	21%	0.209	34%	0.343	C	S	.	.			trans	-112.6	78.2	179.9	-159	-26.3	0	0	0	112.2	D68 F69 N70 R171	D66-D68 VanDerWaalsContact C-N 3.27Å; D66-D68 PolarHBondContact O-N 2.97Å; D66-F69 HydrophobicContact CB-CB 3.99Å; D66-F69 PolarHBondContact O-N 3.09Å; D66-F69 WeakPolarHBondContact OD1-CB 3.48Å; D66-F69 PolarHBondContact OD1-N 3.4Å; D66-N70 WeakPolarHBondContact O-CB 3.27Å; D66-N70 VanDerWaalsContact O-CG 3.32Å; D66-N70 PolarHBondContact O-N 2.88Å; D66-N70 VanDerWaalsContact O-N 3.08Å; D66-N70 PolarHBondContact O-ND2 2.9Å; D66-R171 IonicContact OD2-NH2 3.65Å
67	S	87.1	Confident	80.9	Confident	76 Å²	76	60.9 Å²	60.9	53%	0.531	33%	0.332	S	S	.	.	H	α-helix	trans	-57.1	-40.3	177.9	176.6	0	0	0	0	111.8	N70 N71	S67-N70 PolarHBondContact O-N 3.02Å; S67-N71 WeakPolarHBondContact O-CB 3.26Å; S67-N71 PolarHBondContact O-N 3.41Å; S67-N71 PolarHBondContact O-ND2 3.25Å
68	D	90.6	Very high	82	Confident	119 Å²	119	63.9 Å²	63.9	64%	0.636	34%	0.34	S	S	*	.	H	α-helix	trans	-67.5	-45.6	-177.4	-67.8	-20.6	0	0	0	111.5	D66 N70 N71 V72	D66-D68 VanDerWaalsContact C-N 3.27Å; D66-D68 PolarHBondContact O-N 2.97Å; D68-N70 VanDerWaalsContact C-N 3.32Å; D68-N70 PolarHBondContact O-N 3.18Å; D68-N71 PolarHBondContact O-N 2.94Å; D68-V72 WeakPolarHBondContact O-CG2 3.35Å; D68-V72 PolarHBondContact O-N 2.81Å; D68-V72 VanDerWaalsContact O-N 3.09Å
69	F	93.8	Very high	83.2	Confident	2 Å²	2	62.9 Å²	62.9	1%	0.009	33%	0.333	C	S	.	.	H	α-helix	trans	-60.1	-43.8	174.3	-175.8	-88.7	0	0	0	111.7	L59 D66 N71 V72 L73 T169 R171 V173 F219 L221	L59-F69 HydrophobicContact CD1-CE1 4.1Å; D66-F69 HydrophobicContact CB-CB 3.99Å; D66-F69 PolarHBondContact O-N 3.09Å; D66-F69 WeakPolarHBondContact OD1-CB 3.48Å; D66-F69 PolarHBondContact OD1-N 3.4Å; F69-N71 PolarHBondContact O-N 3.39Å; F69-V72 PolarHBondContact O-N 3.32Å; F69-L73 HydrophobicContact CE1-CB 4.46Å; F69-L73 HydrophobicContact CE1-CD2 4.27Å; F69-L73 WeakPolarHBondContact O-CB 3.43Å; F69-L73 PolarHBondContact O-N 3.14Å; F69-T169 HydrophobicContact CB-CG2 4.5Å; F69-T169 HydrophobicContact CD2-CG2 3.71Å; F69-T169 HydrophobicContact CE2-CG2 4.38Å; F69-T169 HydrophobicContact CG-CG2 4.38Å; F69-R171 HydrophobicContact CD1-CG 4.11Å; F69-R171 HydrophobicContact CD2-CG 4.12Å; F69-R171 HydrophobicContact CE1-CB 3.82Å; F69-R171 HydrophobicContact CE1-CG 3.78Å; F69-R171 HydrophobicContact CE2-CB 4.04Å; F69-R171 HydrophobicContact CE2-CG 3.77Å; F69-R171 HydrophobicContact CG-CG 4.28Å; F69-R171 HydrophobicContact CZ-CB 3.49Å; F69-R171 VanDerWaalsContact CZ-CB 3.49Å; F69-R171 HydrophobicContact CZ-CG 3.61Å; F69-V173 HydrophobicContact CE1-CG1 4.16Å; F69-V173 HydrophobicContact CZ-CG1 4.08Å; F69-F219 AromaticContact CE2-CD1 3.7Å; F69-F219 HydrophobicContact CE2-CD1 3.7Å; F69-F219 HydrophobicContact CE2-CE1 4.3Å; F69-F219 HydrophobicContact CZ-CB 4.33Å; F69-F219 AromaticContact CZ-CD1 3.57Å; F69-F219 HydrophobicContact CZ-CD1 3.57Å; F69-F219 HydrophobicContact CZ-CE1 4.26Å; F69-F219 HydrophobicContact CZ-CG 4.3Å; F69-L221 HydrophobicContact CD2-CD1 4.46Å; F69-L221 HydrophobicContact CD2-CD2 3.92Å; F69-L221 HydrophobicContact CD2-CG 4.12Å; F69-L221 HydrophobicContact CE2-CD2 4.23Å
70	N	92.1	Very high	84.1	Confident	48 Å²	48	63 Å²	63	26%	0.257	33%	0.334	S	S	.	.	H	α-helix	trans	-62.5	-42.1	178.9	-74.9	-28.7	0	0	0	111.6	D66 S67 D68 V72 L73 Q74	D66-N70 WeakPolarHBondContact O-CB 3.27Å; D66-N70 VanDerWaalsContact O-CG 3.32Å; D66-N70 PolarHBondContact O-N 2.88Å; D66-N70 VanDerWaalsContact O-N 3.08Å; D66-N70 PolarHBondContact O-ND2 2.9Å; S67-N70 PolarHBondContact O-N 3.02Å; D68-N70 VanDerWaalsContact C-N 3.32Å; D68-N70 PolarHBondContact O-N 3.18Å; N70-V72 PolarHBondContact O-N 3.38Å; N70-L73 PolarHBondContact O-N 2.81Å; N70-Q74 VanDerWaalsContact O-CG 3.32Å; N70-Q74 WeakPolarHBondContact O-CG 3.29Å; N70-Q74 PolarHBondContact O-N 3.35Å
71	N	93.8	Very high	84.9	Confident	99 Å²	99	69.3 Å²	69.3	53%	0.529	36%	0.362	S	S	.	.	H	α-helix	trans	-60.8	-43.1	175.8	-71.3	-26.7	0	0	0	112	S67 D68 F69 Q74 S75	S67-N71 WeakPolarHBondContact O-CB 3.26Å; S67-N71 PolarHBondContact O-N 3.41Å; S67-N71 PolarHBondContact O-ND2 3.25Å; D68-N71 PolarHBondContact O-N 2.94Å; F69-N71 PolarHBondContact O-N 3.39Å; N71-Q74 PolarHBondContact O-N 3.04Å; N71-S75 WeakPolarHBondContact O-CB 3.44Å; N71-S75 PolarHBondContact O-N 3.33Å
72	V	95.8	Very high	86.2	Confident	39 Å²	39	69.7 Å²	69.7	24%	0.236	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-42	175.8	177	0	0	0	0	111.4	D68 F69 N70 S75 A76 I107 F219 L221	D68-V72 WeakPolarHBondContact O-CG2 3.35Å; D68-V72 PolarHBondContact O-N 2.81Å; D68-V72 VanDerWaalsContact O-N 3.09Å; F69-V72 PolarHBondContact O-N 3.32Å; N70-V72 PolarHBondContact O-N 3.38Å; V72-S75 WeakPolarHBondContact O-CB 3.22Å; V72-S75 PolarHBondContact O-N 2.88Å; V72-A76 PolarHBondContact O-N 2.84Å; V72-I107 HydrophobicContact CG1-CB 4Å; V72-I107 HydrophobicContact CG1-CD1 4.01Å; V72-I107 HydrophobicContact CG1-CG1 4.26Å; V72-F219 HydrophobicContact CG1-CE1 4.15Å; V72-F219 HydrophobicContact CG1-CZ 4.33Å; V72-L221 HydrophobicContact CB-CD2 3.9Å; V72-L221 HydrophobicContact CG1-CD2 3.69Å; V72-L221 HydrophobicContact CG2-CD2 4.1Å
73	L	94.9	Very high	87.9	Confident	2 Å²	2	73.4 Å²	73.4	1%	0.01	38%	0.384	C	S	.	.	H	α-helix	trans	-63.4	-42	177.2	-178.9	59.4	0	0	0	111.7	P58 L59 F69 N70 A76 L77 V173 L175 F219	P58-L73 HydrophobicContact CB-CD2 4.18Å; L59-L73 HydrophobicContact CB-CD2 4.48Å; F69-L73 HydrophobicContact CE1-CB 4.46Å; F69-L73 HydrophobicContact CE1-CD2 4.27Å; F69-L73 WeakPolarHBondContact O-CB 3.43Å; F69-L73 PolarHBondContact O-N 3.14Å; N70-L73 PolarHBondContact O-N 2.81Å; L73-A76 WeakPolarHBondContact O-CB 3.29Å; L73-A76 PolarHBondContact O-N 2.59Å; L73-L77 HydrophobicContact CG-CD1 4.47Å; L73-L77 WeakPolarHBondContact O-CG 3.48Å; L73-L77 PolarHBondContact O-N 3.38Å; L73-V173 HydrophobicContact CD1-CB 4.45Å; L73-V173 HydrophobicContact CD1-CG1 4.23Å; L73-V173 HydrophobicContact CD2-CG1 4.08Å; L73-L175 HydrophobicContact CD1-CD2 4.14Å; L73-F219 HydrophobicContact CD1-CD2 4.5Å; L73-F219 HydrophobicContact CD1-CE2 4.22Å; L73-F219 HydrophobicContact CD1-CZ 4.31Å
74	Q	93.9	Very high	89.7	Confident	114 Å²	114	71 Å²	71	53%	0.533	37%	0.371	S	S	.	.	H	α-helix	trans	-63.6	-42.5	174.9	-68.8	-56.6	-30.1	0	0	111.7	N70 N71 A76 L77 Q78	N70-Q74 VanDerWaalsContact O-CG 3.32Å; N70-Q74 WeakPolarHBondContact O-CG 3.29Å; N70-Q74 PolarHBondContact O-N 3.35Å; N71-Q74 PolarHBondContact O-N 3.04Å; Q74-A76 VanDerWaalsContact C-N 3.29Å; Q74-A76 PolarHBondContact O-N 3.4Å; Q74-L77 PolarHBondContact O-N 3.37Å; Q74-Q78 PolarHBondContact O-N 3.29Å
75	S	95.8	Very high	91.7	Very high	35 Å²	35	66.9 Å²	66.9	25%	0.245	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-40.1	174.8	-168.9	0	0	0	0	112.3	N71 V72 A79 N101	N71-S75 WeakPolarHBondContact O-CB 3.44Å; N71-S75 PolarHBondContact O-N 3.33Å; V72-S75 WeakPolarHBondContact O-CB 3.22Å; V72-S75 PolarHBondContact O-N 2.88Å; S75-A79 WeakPolarHBondContact O-CB 3.28Å; S75-A79 PolarHBondContact O-N 3.36Å; S75-N101 WeakPolarHBondContact OG-CB 3.26Å
76	A	96.3	Very high	93.1	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-63.6	-43.2	174.5	0	0	0	0	0	112.9	V72 L73 Q74 A79 I80 V99 I107 F219	V72-A76 PolarHBondContact O-N 2.84Å; L73-A76 WeakPolarHBondContact O-CB 3.29Å; L73-A76 PolarHBondContact O-N 2.59Å; Q74-A76 VanDerWaalsContact C-N 3.29Å; Q74-A76 PolarHBondContact O-N 3.4Å; A76-A79 PolarHBondContact O-N 2.82Å; A76-I80 VanDerWaalsContact O-CG1 3.29Å; A76-I80 WeakPolarHBondContact O-CG1 3.45Å; A76-I80 PolarHBondContact O-N 2.92Å; A76-I80 VanDerWaalsContact O-N 3.08Å; A76-V99 HydrophobicContact CB-CG1 3.46Å; A76-V99 VanDerWaalsContact CB-CG1 3.46Å; A76-I107 HydrophobicContact CB-CD1 3.84Å; A76-F219 HydrophobicContact CB-CE2 4.14Å; A76-F219 HydrophobicContact CB-CZ 4.04Å
77	L	94.3	Very high	93.7	Very high	23 Å²	23	62.1 Å²	62.1	12%	0.12	33%	0.326	C	S	.	.	H	α-helix	trans	-64	-46.4	178.4	-68.3	169.4	0	0	0	111.2	P58 L73 Q74 A79 I80 E81 L175	P58-L77 HydrophobicContact CB-CD1 3.92Å; P58-L77 HydrophobicContact CG-CD1 3.61Å; L73-L77 HydrophobicContact CG-CD1 4.47Å; L73-L77 WeakPolarHBondContact O-CG 3.48Å; L73-L77 PolarHBondContact O-N 3.38Å; Q74-L77 PolarHBondContact O-N 3.37Å; L77-A79 VanDerWaalsContact C-N 3.32Å; L77-A79 PolarHBondContact O-N 2.93Å; L77-I80 PolarHBondContact O-N 3.38Å; L77-E81 WeakPolarHBondContact O-CG 3.47Å; L77-E81 PolarHBondContact O-N 2.97Å; L77-L175 HydrophobicContact CD2-CD2 3.71Å
78	Q	93.7	Very high	93.9	Very high	114 Å²	114	61.3 Å²	61.3	53%	0.533	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-39.9	177.1	-173	-177.9	12.5	0	0	112.3	Q74 E81 S82	Q74-Q78 PolarHBondContact O-N 3.29Å; Q78-E81 PolarHBondContact O-N 3.41Å; Q78-S82 WeakPolarHBondContact O-CB 3.01Å; Q78-S82 PolarHBondContact O-N 3.44Å; Q78-S82 PolarHBondContact O-OG 2.88Å
79	A	96.1	Very high	93.9	Very high	0 Å²	0	57 Å²	57	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-63.1	-44.9	176.7	0	0	0	0	0	111.6	S75 A76 L77 E81 S82 E83 I84 K100 N101	S75-A79 WeakPolarHBondContact O-CB 3.28Å; S75-A79 PolarHBondContact O-N 3.36Å; A76-A79 PolarHBondContact O-N 2.82Å; L77-A79 VanDerWaalsContact C-N 3.32Å; L77-A79 PolarHBondContact O-N 2.93Å; A79-E81 PolarHBondContact O-N 3.19Å; A79-S82 CarbonylContact O-C 3.49Å; A79-S82 PolarHBondContact O-N 2.87Å; A79-S82 VanDerWaalsContact O-N 3.16Å; A79-E83 PolarHBondContact O-N 3.23Å; A79-I84 CarbonylContact C-O 3.51Å; A79-I84 HydrophobicContact CB-CB 4.22Å; A79-I84 WeakPolarHBondContact O-CA 3.36Å; A79-I84 WeakPolarHBondContact O-CB 3.36Å; A79-I84 PolarHBondContact O-N 3.22Å; A79-K100 WeakPolarHBondContact CB-O 3.37Å; A79-N101 VanDerWaalsContact CB-C 3.46Å
80	I	94.1	Very high	93.4	Very high	24 Å²	24	65.9 Å²	65.9	12%	0.123	32%	0.323	C	S	.	.	H	α-helix	trans	-61.8	-43.1	176.8	-70.9	169.5	0	0	0	111.4	A76 L77 S82 E83 P86 L175 V176	A76-I80 VanDerWaalsContact O-CG1 3.29Å; A76-I80 WeakPolarHBondContact O-CG1 3.45Å; A76-I80 PolarHBondContact O-N 2.92Å; A76-I80 VanDerWaalsContact O-N 3.08Å; L77-I80 PolarHBondContact O-N 3.38Å; I80-S82 PolarHBondContact O-N 2.64Å; I80-E83 PolarHBondContact O-N 3.02Å; I80-E83 VanDerWaalsContact O-N 3.14Å; I80-P86 HydrophobicContact CD1-CG 4.09Å; I80-P86 HydrophobicContact CG1-CG 4.21Å; I80-L175 HydrophobicContact CD1-CD2 4.46Å; I80-V176 VanDerWaalsContact CG2-O 3.23Å; I80-V176 WeakPolarHBondContact CG2-O 3.5Å
81	E	90.3	Very high	92.6	Very high	161 Å²	161	71.4 Å²	71.4	75%	0.752	35%	0.347	S	S	*	.	H	α-helix	trans	-63.9	-31.3	176.1	-73.1	176.1	-178.5	0	0	112.4	L77 Q78 A79 E83	L77-E81 WeakPolarHBondContact O-CG 3.47Å; L77-E81 PolarHBondContact O-N 2.97Å; Q78-E81 PolarHBondContact O-N 3.41Å; A79-E81 PolarHBondContact O-N 3.19Å; E81-E83 PolarHBondContact O-N 3.42Å
82	S	92.1	Very high	91.3	Very high	72 Å²	72	69.8 Å²	69.8	50%	0.503	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	19.8	175	-51.6	0	0	0	0	113.2	Q78 A79 I80 I84	Q78-S82 WeakPolarHBondContact O-CB 3.01Å; Q78-S82 PolarHBondContact O-N 3.44Å; Q78-S82 PolarHBondContact O-OG 2.88Å; A79-S82 CarbonylContact O-C 3.49Å; A79-S82 PolarHBondContact O-N 2.87Å; A79-S82 VanDerWaalsContact O-N 3.16Å; I80-S82 PolarHBondContact O-N 2.64Å; S82-I84 PolarHBondContact O-N 2.85Å; S82-I84 VanDerWaalsContact O-N 3.16Å
83	E	92.4	Very high	89.7	Confident	173 Å²	173	70.4 Å²	70.4	81%	0.808	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	14.6	179.9	-56	-175.2	166.5	0	0	115.5	A79 I80 E81 L85	A79-E83 PolarHBondContact O-N 3.23Å; I80-E83 PolarHBondContact O-N 3.02Å; I80-E83 VanDerWaalsContact O-N 3.14Å; E81-E83 PolarHBondContact O-N 3.42Å; E83-L85 PolarHBondContact O-N 3.25Å; E83-L85 VanDerWaalsContact O-N 3.16Å
84	I	94.5	Very high	88.6	Confident	50 Å²	50	71.1 Å²	71.1	26%	0.256	36%	0.364	S	S	.	.			trans	-86.6	87.1	171	-55	-179.7	0	0	0	108.2	A79 S82 K100 A102	A79-I84 CarbonylContact C-O 3.51Å; A79-I84 HydrophobicContact CB-CB 4.22Å; A79-I84 WeakPolarHBondContact O-CA 3.36Å; A79-I84 WeakPolarHBondContact O-CB 3.36Å; A79-I84 PolarHBondContact O-N 3.22Å; S82-I84 PolarHBondContact O-N 2.85Å; S82-I84 VanDerWaalsContact O-N 3.16Å; I84-K100 HydrophobicContact CG2-CB 4Å; I84-K100 HydrophobicContact CG2-CD 4.34Å; I84-A102 WeakPolarHBondContact CD1-O 3.43Å
85	L	94.9	Very high	88.1	Confident	62 Å²	62	65.8 Å²	65.8	33%	0.325	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-79.5	149.5	-171	-52.2	-178.2	0	0	0	112.9	E83 E178	E83-L85 PolarHBondContact O-N 3.25Å; E83-L85 VanDerWaalsContact O-N 3.16Å; L85-E178 HydrophobicContact CD1-CB 4.23Å
86	P	96.1	Very high	88	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.019	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-59.7	139.2	170.6	-22.7	35.6	0	0	0	111.6	I80 F98 V99 S177 S179 F180	I80-P86 HydrophobicContact CD1-CG 4.09Å; I80-P86 HydrophobicContact CG1-CG 4.21Å; P86-F98 CarbonylContact C-O 3.46Å; P86-F98 WeakPolarHBondContact CA-O 3.31Å; P86-V99 HydrophobicContact CB-CG2 4.29Å; P86-V99 HydrophobicContact CG-CG2 4.35Å; P86-S177 WeakPolarHBondContact CD-OG 3.24Å; P86-S179 VanDerWaalsContact O-CB 3.29Å; P86-S179 WeakPolarHBondContact O-CB 3.33Å; P86-S179 PolarHBondContact O-OG 2.8Å; P86-F180 HydrophobicContact CB-CE1 4.02Å; P86-F180 HydrophobicContact CG-CE1 3.99Å; P86-F180 HydrophobicContact CG-CZ 4.19Å
87	E	94.9	Very high	88	Confident	89 Å²	89	64.6 Å²	64.6	42%	0.416	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	130.3	-175.7	-176.1	-175.5	155.2	0	0	110.9	I89 Y97 F98 K100	E87-I89 PolarHBondContact O-N 2.94Å; E87-Y97 CarbonylContact O-C 3.47Å; E87-Y97 VanDerWaalsContact O-CA 3.24Å; E87-Y97 WeakPolarHBondContact O-CA 3.29Å; E87-F98 PolarHBondContact N-O 3.28Å; E87-F98 PolarHBondContact O-N 3.32Å; E87-K100 WeakPolarHBondContact OE2-CE 3.49Å; E87-K100 IonicContact OE2-NZ 3.3Å; E87-K100 PolarHBondContact OE2-NZ 3.49Å
88	R	92	Very high	88.2	Confident	58 Å²	58	65.4 Å²	65.4	22%	0.219	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	131.1	-179.2	-174.4	-177	-63	-86.4	-5.9	111.5	Y97 E115 P123 S179	R88-Y97 HydrophobicContact CB-CD1 4.16Å; R88-Y97 HydrophobicContact CB-CE1 4.02Å; R88-Y97 HydrophobicContact CG-CE1 4.33Å; R88-Y97 PolarHBondContact NH1-OH 3.03Å; R88-Y97 PolarHBondContact NH2-OH 3.47Å; R88-E115 IonicContact NH1-OE2 2.68Å; R88-P123 VanDerWaalsContact NH1-CB 3.32Å; R88-S179 PolarHBondContact NH2-O 3.35Å
89	I	91.2	Very high	88.3	Confident	28 Å²	28	60 Å²	60	14%	0.144	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.5	170.5	-51.3	179.3	0	0	0	108.2	E87 Q91 S96 F98 V109	E87-I89 PolarHBondContact O-N 2.94Å; I89-Q91 HydrophobicContact CG2-CB 4.3Å; I89-S96 PolarHBondContact N-O 3.02Å; I89-F98 HydrophobicContact CD1-CD1 3.79Å; I89-F98 HydrophobicContact CD1-CD2 4Å; I89-F98 HydrophobicContact CD1-CE1 3.61Å; I89-F98 HydrophobicContact CD1-CE2 3.84Å; I89-F98 HydrophobicContact CD1-CG 3.96Å; I89-F98 HydrophobicContact CD1-CZ 3.64Å; I89-F98 HydrophobicContact CG1-CD1 4.3Å; I89-F98 HydrophobicContact CG1-CD2 3.6Å; I89-F98 HydrophobicContact CG1-CE1 4.29Å; I89-F98 HydrophobicContact CG1-CE2 3.61Å; I89-F98 HydrophobicContact CG1-CG 3.96Å; I89-F98 HydrophobicContact CG1-CZ 3.96Å; I89-F98 HydrophobicContact CG2-CE2 4.47Å; I89-V109 HydrophobicContact CD1-CG1 4Å; I89-V109 HydrophobicContact CD1-CG2 4.45Å
90	Y	81.6	Confident	88.4	Confident	190 Å²	190	62 Å²	62	75%	0.745	32%	0.318	S	S	*	.			trans	-78.6	-26.9	-178.5	-68.2	-79.3	0	0	0	113.1	K124	Y90-K124 PolarHBondContact O-NZ 3.26Å
91	Q	75.1	Confident	88.5	Confident	164 Å²	164	61.7 Å²	61.7	77%	0.766	32%	0.316	S	S	*	.	S	Bend	trans	-68.4	165.9	173.4	-69.8	174.3	-30	0	0	111.7	I89 K124	I89-Q91 HydrophobicContact CG2-CB 4.3Å; Q91-K124 PolarHBondContact O-NZ 3.1Å
92	G	68.3	Low	88.7	Confident	64 Å²	64	56.2 Å²	56.2	66%	0.66	30%	0.299	S	S	*	.	S	Bend	trans	77.3	-158.9	-177.9	0	0	0	0	0	113.7	K124	G92-K124 VanDerWaalsContact C-NZ 3.26Å; G92-K124 PolarHBondContact O-NZ 3.45Å
93	S	62	Low	88.8	Confident	53 Å²	53	59.1 Å²	59.1	37%	0.371	31%	0.308	S	S	.	.	S	Bend	trans	-132.1	-9.4	-168.2	84.3	0	0	0	0	114.8	K127	S93-K127 VanDerWaalsContact O-CE 3.29Å; S93-K127 WeakPolarHBondContact O-CE 3.47Å; S93-K127 PolarHBondContact O-NZ 2.59Å; S93-K127 PolarHBondContact OG-NZ 3.07Å
94	S	72.2	Confident	88.9	Confident	16 Å²	16	52.4 Å²	52.4	11%	0.112	29%	0.286	C	S	.	.	S	Bend	trans	-103.7	170.4	173.3	53	0	0	0	0	111.4	S96 K124	S94-S96 PolarHBondContact O-N 3.48Å; S94-S96 PolarHBondContact OG-OG 3.27Å; S94-K124 WeakPolarHBondContact O-CE 3.48Å
95	G	83.4	Confident	89	Confident	2 Å²	2	55.4 Å²	55.4	2%	0.021	30%	0.299	C	S	.	.			trans	-72.8	113.2	157.3	0	0	0	0	0	109.6	E115	G95-E115 PolarHBondContact N-O 2.99Å
96	S	93.1	Very high	89.1	Confident	10 Å²	10	56.6 Å²	56.6	7%	0.07	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.9	176.9	-54.6	0	0	0	0	108.8	I89 S94 F110	I89-S96 PolarHBondContact N-O 3.02Å; S94-S96 PolarHBondContact O-N 3.48Å; S94-S96 PolarHBondContact OG-OG 3.27Å; S96-F110 WeakPolarHBondContact CA-O 3.18Å
97	Y	96.5	Very high	89.2	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	133.3	-173.9	-59.9	-95.2	0	0	0	111.3	E87 R88 V99 V109 F110 P112 E115 F180 N181	E87-Y97 CarbonylContact O-C 3.47Å; E87-Y97 VanDerWaalsContact O-CA 3.24Å; E87-Y97 WeakPolarHBondContact O-CA 3.29Å; R88-Y97 HydrophobicContact CB-CD1 4.16Å; R88-Y97 HydrophobicContact CB-CE1 4.02Å; R88-Y97 HydrophobicContact CG-CE1 4.33Å; R88-Y97 PolarHBondContact NH1-OH 3.03Å; R88-Y97 PolarHBondContact NH2-OH 3.47Å; Y97-V99 PolarHBondContact O-N 3.13Å; Y97-V109 CarbonylContact O-C 3.44Å; Y97-V109 WeakPolarHBondContact O-CA 3.06Å; Y97-F110 PolarHBondContact N-O 3.17Å; Y97-F110 PolarHBondContact O-N 3.46Å; Y97-P112 HydrophobicContact CD2-CG 4.33Å; Y97-P112 HydrophobicContact CE2-CG 3.9Å; Y97-E115 WeakPolarHBondContact CE2-OE2 3.1Å; Y97-E115 PolarHBondContact OH-OE1 3.13Å; Y97-E115 VanDerWaalsContact OH-OE1 3.09Å; Y97-E115 PolarHBondContact OH-OE2 3.37Å; Y97-F180 AromaticContact CD1-CD1 3.91Å; Y97-F180 HydrophobicContact CD1-CD1 3.91Å; Y97-F180 HydrophobicContact CD1-CE1 4.09Å; Y97-F180 AromaticContact CD2-CD1 3.94Å; Y97-F180 HydrophobicContact CD2-CD1 3.94Å; Y97-F180 AromaticContact CD2-CE1 3.97Å; Y97-F180 HydrophobicContact CD2-CE1 3.97Å; Y97-F180 AromaticContact CE1-CD1 3.79Å; Y97-F180 HydrophobicContact CE1-CD1 3.79Å; Y97-F180 HydrophobicContact CE1-CE1 4.44Å; Y97-F180 AromaticContact CE2-CD1 3.85Å; Y97-F180 HydrophobicContact CE2-CD1 3.85Å; Y97-F180 HydrophobicContact CE2-CE1 4.34Å; Y97-F180 AromaticContact CG-CD1 3.99Å; Y97-F180 HydrophobicContact CG-CD1 3.99Å; Y97-F180 AromaticContact CG-CE1 3.85Å; Y97-F180 HydrophobicContact CG-CE1 3.85Å; Y97-F180 AromaticContact CZ-CD1 3.76Å; Y97-F180 WeakPolarHBondContact OH-CA 3.18Å; Y97-N181 PolarHBondContact OH-N 3.45Å
98	F	97	Very high	89.3	Confident	40 Å²	40	53.5 Å²	53.5	18%	0.175	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	115.2	162.9	-71.3	-54.6	0	0	0	109	P86 E87 I89 K106 V109 F222	P86-F98 CarbonylContact C-O 3.46Å; P86-F98 WeakPolarHBondContact CA-O 3.31Å; E87-F98 PolarHBondContact N-O 3.28Å; E87-F98 PolarHBondContact O-N 3.32Å; I89-F98 HydrophobicContact CD1-CD1 3.79Å; I89-F98 HydrophobicContact CD1-CD2 4Å; I89-F98 HydrophobicContact CD1-CE1 3.61Å; I89-F98 HydrophobicContact CD1-CE2 3.84Å; I89-F98 HydrophobicContact CD1-CG 3.96Å; I89-F98 HydrophobicContact CD1-CZ 3.64Å; I89-F98 HydrophobicContact CG1-CD1 4.3Å; I89-F98 HydrophobicContact CG1-CD2 3.6Å; I89-F98 HydrophobicContact CG1-CE1 4.29Å; I89-F98 HydrophobicContact CG1-CE2 3.61Å; I89-F98 HydrophobicContact CG1-CG 3.96Å; I89-F98 HydrophobicContact CG1-CZ 3.96Å; I89-F98 HydrophobicContact CG2-CE2 4.47Å; F98-K106 HydrophobicContact CB-CD 4.21Å; F98-K106 HydrophobicContact CB-CG 4.21Å; F98-K106 HydrophobicContact CD1-CD 3.87Å; F98-K106 HydrophobicContact CD1-CG 4.5Å; F98-K106 HydrophobicContact CD2-CD 4.11Å; F98-K106 HydrophobicContact CE1-CD 4.26Å; F98-K106 HydrophobicContact CE2-CD 4.47Å; F98-K106 HydrophobicContact CG-CD 3.81Å; F98-K106 HydrophobicContact CG-CG 4.34Å; F98-V109 HydrophobicContact CD1-CG2 3.97Å; F98-V109 HydrophobicContact CE1-CG2 3.98Å; F98-F222 HydrophobicContact CD1-CD2 4.19Å; F98-F222 HydrophobicContact CD1-CE2 4.13Å; F98-F222 HydrophobicContact CE1-CD2 4.06Å; F98-F222 AromaticContact CE1-CE2 3.69Å; F98-F222 HydrophobicContact CE1-CE2 3.69Å
99	V	97.4	Very high	89.5	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	139.3	173.4	-174.9	0	0	0	0	108.8	A76 P86 Y97 I107 A108 F110 L175 F219	A76-V99 HydrophobicContact CB-CG1 3.46Å; A76-V99 VanDerWaalsContact CB-CG1 3.46Å; P86-V99 HydrophobicContact CB-CG2 4.29Å; P86-V99 HydrophobicContact CG-CG2 4.35Å; Y97-V99 PolarHBondContact O-N 3.13Å; V99-I107 HydrophobicContact CG1-CG1 4.43Å; V99-I107 WeakPolarHBondContact O-CG1 3.37Å; V99-I107 PolarHBondContact O-N 3.46Å; V99-A108 HydrophobicContact CB-CB 4.15Å; V99-A108 PolarHBondContact N-O 2.86Å; V99-A108 PolarHBondContact O-N 2.68Å; V99-F110 HydrophobicContact CG2-CB 3.64Å; V99-L175 HydrophobicContact CG2-CD1 4.38Å; V99-F219 HydrophobicContact CB-CE2 4.3Å; V99-F219 HydrophobicContact CG1-CE2 4.11Å; V99-F219 HydrophobicContact CG2-CE2 4.09Å
100	K	97.7	Very high	89.8	Confident	43 Å²	43	50.3 Å²	50.3	19%	0.187	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	155.9	-173.7	-62.5	175.2	-177.9	178.7	0	111.5	A79 I84 E87 E105	A79-K100 WeakPolarHBondContact CB-O 3.37Å; I84-K100 HydrophobicContact CG2-CB 4Å; I84-K100 HydrophobicContact CG2-CD 4.34Å; E87-K100 WeakPolarHBondContact OE2-CE 3.49Å; E87-K100 IonicContact OE2-NZ 3.3Å; E87-K100 PolarHBondContact OE2-NZ 3.49Å; K100-E105 CarbonylContact C-O 3.55Å; K100-E105 WeakPolarHBondContact CA-O 3.16Å
101	N	95.9	Very high	90.5	Very high	18 Å²	18	42.5 Å²	42.5	10%	0.096	25%	0.245	C	C	.	.			trans	-85.9	-177.9	166.4	67.6	8.4	0	0	0	111.3	S75 A79 N103 G104 E105 I107	S75-N101 WeakPolarHBondContact OG-CB 3.26Å; A79-N101 VanDerWaalsContact CB-C 3.46Å; N101-N103 PolarHBondContact O-N 3.34Å; N101-N103 VanDerWaalsContact O-N 3.16Å; N101-N103 WeakPolarHBondContact OD1-CA 3.49Å; N101-N103 WeakPolarHBondContact OD1-CB 3.37Å; N101-N103 PolarHBondContact OD1-N 3.34Å; N101-G104 PolarHBondContact O-N 3.19Å; N101-G104 PolarHBondContact OD1-N 3.39Å; N101-G104 VanDerWaalsContact OD1-N 3.12Å; N101-E105 PolarHBondContact N-O 3.16Å; N101-E105 PolarHBondContact ND2-OE2 2.97Å; N101-E105 WeakPolarHBondContact OD1-CB 3.49Å; N101-E105 PolarHBondContact OD1-N 3.19Å; N101-I107 HydrophobicContact CB-CD1 4.09Å; N101-I107 HydrophobicContact CB-CG2 3.83Å
102	A	94.6	Very high	91.4	Very high	46 Å²	46	34.7 Å²	34.7	38%	0.38	21%	0.209	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-21.5	177	0	0	0	0	0	114.3	I84	I84-A102 WeakPolarHBondContact CD1-O 3.43Å
103	N	95	Very high	92.6	Very high	132 Å²	132	33.1 Å²	33.1	71%	0.706	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88	-3.8	176.9	-57.9	-26.9	0	0	0	112.7	N101 E105	N101-N103 PolarHBondContact O-N 3.34Å; N101-N103 VanDerWaalsContact O-N 3.16Å; N101-N103 WeakPolarHBondContact OD1-CA 3.49Å; N101-N103 WeakPolarHBondContact OD1-CB 3.37Å; N101-N103 PolarHBondContact OD1-N 3.34Å; N103-E105 VanDerWaalsContact C-N 3.33Å; N103-E105 HydrophobicContact CB-CG 4.09Å
104	G	93.9	Very high	93.9	Very high	33 Å²	33	32.7 Å²	32.7	34%	0.34	18%	0.178	S	C	.	.	S	Bend	trans	81.8	6.7	-175.2	0	0	0	0	0	114.7	N101	N101-G104 PolarHBondContact O-N 3.19Å; N101-G104 PolarHBondContact OD1-N 3.39Å; N101-G104 VanDerWaalsContact OD1-N 3.12Å
105	E	96	Very high	94.7	Very high	113 Å²	113	31.9 Å²	31.9	53%	0.528	17%	0.172	S	C	.	.			trans	-78.9	142.3	178.6	-57.1	169.5	130.2	0	0	110.4	K100 N101 N103 I107	K100-E105 CarbonylContact C-O 3.55Å; K100-E105 WeakPolarHBondContact CA-O 3.16Å; N101-E105 PolarHBondContact N-O 3.16Å; N101-E105 PolarHBondContact ND2-OE2 2.97Å; N101-E105 WeakPolarHBondContact OD1-CB 3.49Å; N101-E105 PolarHBondContact OD1-N 3.19Å; N103-E105 VanDerWaalsContact C-N 3.33Å; N103-E105 HydrophobicContact CB-CG 4.09Å; E105-I107 PolarHBondContact O-N 2.93Å
106	K	97.1	Very high	94.6	Very high	86 Å²	86	32.4 Å²	32.4	37%	0.374	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	123	179.1	-61.2	177.2	-178.6	-178.8	0	109.7	F98 F222	F98-K106 HydrophobicContact CB-CD 4.21Å; F98-K106 HydrophobicContact CB-CG 4.21Å; F98-K106 HydrophobicContact CD1-CD 3.87Å; F98-K106 HydrophobicContact CD1-CG 4.5Å; F98-K106 HydrophobicContact CD2-CD 4.11Å; F98-K106 HydrophobicContact CE1-CD 4.26Å; F98-K106 HydrophobicContact CE2-CD 4.47Å; F98-K106 HydrophobicContact CG-CD 3.81Å; F98-K106 HydrophobicContact CG-CG 4.34Å; K106-F222 HydrophobicContact CB-CD1 3.92Å; K106-F222 HydrophobicContact CB-CD2 4.21Å; K106-F222 HydrophobicContact CB-CE1 4.01Å; K106-F222 HydrophobicContact CB-CE2 4.3Å; K106-F222 HydrophobicContact CB-CG 4.03Å; K106-F222 HydrophobicContact CB-CZ 4.21Å; K106-F222 HydrophobicContact CD-CE2 4.13Å; K106-F222 HydrophobicContact CD-CZ 4.06Å; K106-F222 VanDerWaalsContact O-CD1 3.3Å; K106-F222 WeakPolarHBondContact O-CD1 3.44Å
107	I	97.5	Very high	93.6	Very high	27 Å²	27	33.6 Å²	33.6	14%	0.138	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-21.7	-177	57	170	0	0	0	113.5	V72 A76 V99 N101 E105 F222	V72-I107 HydrophobicContact CG1-CB 4Å; V72-I107 HydrophobicContact CG1-CD1 4.01Å; V72-I107 HydrophobicContact CG1-CG1 4.26Å; A76-I107 HydrophobicContact CB-CD1 3.84Å; V99-I107 HydrophobicContact CG1-CG1 4.43Å; V99-I107 WeakPolarHBondContact O-CG1 3.37Å; V99-I107 PolarHBondContact O-N 3.46Å; N101-I107 HydrophobicContact CB-CD1 4.09Å; N101-I107 HydrophobicContact CB-CG2 3.83Å; E105-I107 PolarHBondContact O-N 2.93Å; I107-F222 WeakPolarHBondContact O-CB 3.16Å; I107-F222 PolarHBondContact O-N 2.67Å
108	A	97.7	Very high	92.2	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	165.5	177.3	0	0	0	0	0	113	V99 F219 Q220	V99-A108 HydrophobicContact CB-CB 4.15Å; V99-A108 PolarHBondContact N-O 2.86Å; V99-A108 PolarHBondContact O-N 2.68Å; A108-F219 HydrophobicContact CB-CD1 3.82Å; A108-F219 HydrophobicContact CB-CD2 4.12Å; A108-F219 HydrophobicContact CB-CE1 3.29Å; A108-F219 HydrophobicContact CB-CE2 3.63Å; A108-F219 HydrophobicContact CB-CG 4.22Å; A108-F219 HydrophobicContact CB-CZ 3.19Å; A108-Q220 CarbonylContact C-O 3.47Å; A108-Q220 WeakPolarHBondContact CA-O 3.47Å; A108-Q220 VanDerWaalsContact CB-O 3.25Å; A108-Q220 WeakPolarHBondContact CB-O 3.33Å
109	V	97.3	Very high	90.8	Very high	20 Å²	20	36.6 Å²	36.6	12%	0.121	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	123.1	166.5	-179.8	0	0	0	0	108.6	I89 Y97 F98 K111 Q220 F222	I89-V109 HydrophobicContact CD1-CG1 4Å; I89-V109 HydrophobicContact CD1-CG2 4.45Å; Y97-V109 CarbonylContact O-C 3.44Å; Y97-V109 WeakPolarHBondContact O-CA 3.06Å; F98-V109 HydrophobicContact CD1-CG2 3.97Å; F98-V109 HydrophobicContact CE1-CG2 3.98Å; V109-K111 HydrophobicContact CG1-CG 4.35Å; V109-Q220 PolarHBondContact N-O 2.67Å; V109-Q220 PolarHBondContact O-N 3.33Å; V109-F222 HydrophobicContact CG2-CD2 4.34Å
110	F	97.2	Very high	89.4	Confident	0 Å²	0	45.4 Å²	45.4	0%	0	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	129	176.6	-177	-114.3	0	0	0	111.1	S96 Y97 V99 P112 V173 L175 F180 K215 S218 F219	S96-F110 WeakPolarHBondContact CA-O 3.18Å; Y97-F110 PolarHBondContact N-O 3.17Å; Y97-F110 PolarHBondContact O-N 3.46Å; V99-F110 HydrophobicContact CG2-CB 3.64Å; F110-P112 HydrophobicContact CD1-CG 4.43Å; F110-P112 HydrophobicContact CE1-CB 3.76Å; F110-P112 HydrophobicContact CE1-CG 4.11Å; F110-P112 HydrophobicContact CZ-CB 4.17Å; F110-V173 HydrophobicContact CD2-CG2 3.95Å; F110-V173 HydrophobicContact CE2-CG2 3.61Å; F110-L175 HydrophobicContact CB-CD1 4.25Å; F110-L175 HydrophobicContact CD1-CD1 4.12Å; F110-L175 HydrophobicContact CD2-CD1 3.84Å; F110-L175 HydrophobicContact CD2-CG 4.42Å; F110-L175 HydrophobicContact CE1-CB 4.1Å; F110-L175 HydrophobicContact CE1-CD1 4.43Å; F110-L175 HydrophobicContact CE2-CB 4.42Å; F110-L175 HydrophobicContact CE2-CD1 4.18Å; F110-L175 HydrophobicContact CE2-CG 4.27Å; F110-L175 HydrophobicContact CG-CD1 3.81Å; F110-L175 HydrophobicContact CZ-CB 4.05Å; F110-L175 HydrophobicContact CZ-CD1 4.47Å; F110-L175 HydrophobicContact CZ-CG 4.4Å; F110-F180 AromaticContact CD1-CE1 3.94Å; F110-F180 HydrophobicContact CD1-CE1 3.94Å; F110-F180 HydrophobicContact CD1-CE2 4.11Å; F110-F180 AromaticContact CD1-CZ 3.51Å; F110-F180 HydrophobicContact CD1-CZ 3.51Å; F110-F180 HydrophobicContact CE1-CE1 4.34Å; F110-F180 AromaticContact CE1-CE2 3.76Å; F110-F180 HydrophobicContact CE1-CE2 3.76Å; F110-F180 AromaticContact CE1-CZ 3.66Å; F110-F180 HydrophobicContact CE1-CZ 3.66Å; F110-K215 WeakPolarHBondContact CZ-O 3.46Å; F110-S218 WeakPolarHBondContact CA-O 3.48Å; F110-S218 WeakPolarHBondContact CD2-O 3.42Å; F110-F219 HydrophobicContact CB-CD2 4.46Å; F110-F219 HydrophobicContact CD2-CB 4.26Å; F110-F219 HydrophobicContact CD2-CD2 4.24Å
111	K	95.4	Very high	88	Confident	25 Å²	25	45.4 Å²	45.4	11%	0.109	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	97.1	177.1	-52.9	-176.6	-177.2	174.9	0	109.4	V109 E152 G217 S218 D308	V109-K111 HydrophobicContact CG1-CG 4.35Å; K111-E152 IonicContact NZ-OE1 2.7Å; K111-E152 PolarHBondContact NZ-OE1 2.93Å; K111-G217 WeakPolarHBondContact O-CA 3.04Å; K111-S218 PolarHBondContact N-O 3.42Å; K111-S218 PolarHBondContact O-N 3.14Å; K111-S218 VanDerWaalsContact O-N 3.09Å; K111-D308 IonicContact NZ-OD1 3.56Å; K111-D308 PolarHBondContact NZ-OD1 3.14Å
112	P	94.7	Very high	86.7	Confident	1 Å²	1	46 Å²	46	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137	179.9	25.3	-30.9	0	0	0	111.8	Y97 F110 D114 E115 K215 I216	Y97-P112 HydrophobicContact CD2-CG 4.33Å; Y97-P112 HydrophobicContact CE2-CG 3.9Å; F110-P112 HydrophobicContact CD1-CG 4.43Å; F110-P112 HydrophobicContact CE1-CB 3.76Å; F110-P112 HydrophobicContact CE1-CG 4.11Å; F110-P112 HydrophobicContact CZ-CB 4.17Å; P112-D114 VanDerWaalsContact C-N 3.25Å; P112-D114 PolarHBondContact O-N 2.96Å; P112-E115 HydrophobicContact CB-CG 4.5Å; P112-E115 HydrophobicContact CG-CB 3.98Å; P112-E115 HydrophobicContact CG-CG 3.79Å; P112-E115 PolarHBondContact O-N 2.78Å; P112-E115 VanDerWaalsContact O-N 3.12Å; P112-K215 HydrophobicContact CB-CB 4.07Å; P112-K215 HydrophobicContact CB-CD 3.99Å; P112-K215 HydrophobicContact CG-CD 4.47Å; P112-I216 WeakPolarHBondContact CA-O 3.43Å
113	K	92.9	Very high	85	Confident	31 Å²	31	46 Å²	46	14%	0.135	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-51.2	-44.1	-179.3	176.8	-172.8	176	177.9	0	112	E115 E116 N146 Y149 I216 D370	K113-E115 VanDerWaalsContact C-N 3.26Å; K113-E115 PolarHBondContact O-N 3.49Å; K113-E116 VanDerWaalsContact O-CB 3.32Å; K113-E116 WeakPolarHBondContact O-CB 3.39Å; K113-E116 WeakPolarHBondContact O-CG 3.45Å; K113-E116 PolarHBondContact O-N 3.06Å; K113-N146 WeakPolarHBondContact CE-ND2 3.39Å; K113-N146 WeakPolarHBondContact CE-O 3.32Å; K113-N146 PolarHBondContact O-OD1 3.46Å; K113-Y149 HydrophobicContact CB-CD1 3.77Å; K113-Y149 HydrophobicContact CB-CE1 3.96Å; K113-Y149 HydrophobicContact CB-CG 4.33Å; K113-Y149 HydrophobicContact CD-CD1 4.22Å; K113-Y149 HydrophobicContact CD-CE1 3.54Å; K113-Y149 HydrophobicContact CG-CD1 3.8Å; K113-Y149 HydrophobicContact CG-CE1 3.64Å; K113-I216 HydrophobicContact CB-CG2 3.97Å; K113-I216 HydrophobicContact CD-CG2 4.07Å; K113-I216 PolarHBondContact N-O 2.83Å; K113-D370 WeakPolarHBondContact CE-OD2 3.47Å; K113-D370 IonicContact NZ-OD1 3.1Å; K113-D370 PolarHBondContact NZ-OD1 2.79Å; K113-D370 IonicContact NZ-OD2 3.17Å; K113-D370 PolarHBondContact NZ-OD2 2.96Å
114	D	89.3	Confident	83.3	Confident	43 Å²	43	42 Å²	42	23%	0.23	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-75.9	-9.5	-173.6	66.2	-9.8	0	0	0	114.6	P112 G119 K120 L121 K215	P112-D114 VanDerWaalsContact C-N 3.25Å; P112-D114 PolarHBondContact O-N 2.96Å; D114-G119 CarbonylContact O-C 3.49Å; D114-G119 WeakPolarHBondContact O-CA 3.38Å; D114-K120 PolarHBondContact O-N 3.22Å; D114-L121 CarbonylContact O-C 3.36Å; D114-L121 WeakPolarHBondContact O-CA 3.32Å; D114-L121 WeakPolarHBondContact O-CB 3.16Å; D114-L121 PolarHBondContact O-N 3.36Å; D114-K215 WeakPolarHBondContact OD1-CD 3.45Å; D114-K215 IonicContact OD1-NZ 3.07Å; D114-K215 PolarHBondContact OD1-NZ 3.41Å; D114-K215 WeakPolarHBondContact OD2-CE 3.42Å; D114-K215 IonicContact OD2-NZ 2.64Å; D114-K215 PolarHBondContact OD2-NZ 3.42Å
115	E	89	Confident	81.2	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-107.4	9.7	174.9	-51	-173.3	-151.3	0	0	113.3	R88 G95 Y97 P112 K113 N181 K215	R88-E115 IonicContact NH1-OE2 2.68Å; G95-E115 PolarHBondContact N-O 2.99Å; Y97-E115 WeakPolarHBondContact CE2-OE2 3.1Å; Y97-E115 PolarHBondContact OH-OE1 3.13Å; Y97-E115 VanDerWaalsContact OH-OE1 3.09Å; Y97-E115 PolarHBondContact OH-OE2 3.37Å; P112-E115 HydrophobicContact CB-CG 4.5Å; P112-E115 HydrophobicContact CG-CB 3.98Å; P112-E115 HydrophobicContact CG-CG 3.79Å; P112-E115 PolarHBondContact O-N 2.78Å; P112-E115 VanDerWaalsContact O-N 3.12Å; K113-E115 VanDerWaalsContact C-N 3.26Å; K113-E115 PolarHBondContact O-N 3.49Å; E115-N181 HydrophobicContact CG-CB 4.21Å; E115-N181 WeakPolarHBondContact OE1-CB 3.5Å; E115-N181 PolarHBondContact OE1-N 3.11Å; E115-K215 IonicContact OE1-NZ 3.57Å; E115-K215 PolarHBondContact OE1-NZ 3.18Å
116	E	80.8	Confident	79.3	Confident	13 Å²	13	46.8 Å²	46.8	6%	0.061	22%	0.222	C	C	.	.	S	Bend	trans	-60.4	165	171.9	-81.5	-172.2	-159.1	0	0	112.3	K113 Y118 G119 N122 N146 G148 Y149	K113-E116 VanDerWaalsContact O-CB 3.32Å; K113-E116 WeakPolarHBondContact O-CB 3.39Å; K113-E116 WeakPolarHBondContact O-CG 3.45Å; K113-E116 PolarHBondContact O-N 3.06Å; E116-Y118 PolarHBondContact O-N 3.15Å; E116-G119 PolarHBondContact O-N 3.16Å; E116-N122 VanDerWaalsContact C-ND2 3.33Å; E116-N122 WeakPolarHBondContact O-CB 3.49Å; E116-N122 PolarHBondContact O-ND2 3.41Å; E116-N146 WeakPolarHBondContact OE2-CA 3.43Å; E116-G148 WeakPolarHBondContact OE1-CA 3.47Å; E116-G148 PolarHBondContact OE1-N 3.05Å; E116-G148 VanDerWaalsContact OE1-N 3.07Å; E116-G148 PolarHBondContact OE2-N 3.25Å; E116-Y149 PolarHBondContact OE1-N 3.06Å
117	P	72.9	Confident	77.1	Confident	34 Å²	34	44.7 Å²	44.7	22%	0.221	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.6	-36.4	176.2	-31.9	39.2	0	0	0	115.1	N122 K127	P117-N122 WeakPolarHBondContact CA-ND2 3.36Å; P117-K127 HydrophobicContact CB-CD 3.93Å
118	Y	67.3	Low	75	Confident	94 Å²	94	50.4 Å²	50.4	37%	0.369	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	0.3	-179.8	-48.7	-78.9	0	0	0	112.9	E116 G139 R140	E116-Y118 PolarHBondContact O-N 3.15Å; Y118-G139 WeakPolarHBondContact OH-CA 3.43Å; Y118-R140 PolarHBondContact OH-N 3.33Å
119	G	66.8	Low	72.7	Confident	9 Å²	9	53.8 Å²	53.8	9%	0.093	25%	0.25	C	S	.	.	S	Bend	trans	-67.3	146.4	178.8	0	0	0	0	0	111.8	D114 E116 L121 N122	D114-G119 CarbonylContact O-C 3.49Å; D114-G119 WeakPolarHBondContact O-CA 3.38Å; E116-G119 PolarHBondContact O-N 3.16Å; G119-L121 PolarHBondContact O-N 2.75Å; G119-N122 PolarHBondContact O-N 3.4Å
120	K	69.4	Low	70.6	Confident	186 Å²	186	56.7 Å²	56.7	81%	0.809	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-25.1	-177.8	-65.9	-178.4	-178.2	177.8	0	112.7	D114	D114-K120 PolarHBondContact O-N 3.22Å
121	L	68.3	Low	68.6	Low	42 Å²	42	62.7 Å²	62.7	22%	0.22	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.5	29.8	-175.1	-60.9	176.8	0	0	0	111.8	D114 G119 P123 N181	D114-L121 CarbonylContact O-C 3.36Å; D114-L121 WeakPolarHBondContact O-CA 3.32Å; D114-L121 WeakPolarHBondContact O-CB 3.16Å; D114-L121 PolarHBondContact O-N 3.36Å; G119-L121 PolarHBondContact O-N 2.75Å; L121-P123 WeakPolarHBondContact O-CD 3.48Å; L121-N181 WeakPolarHBondContact CD1-O 3.5Å; L121-N181 PolarHBondContact O-ND2 3.45Å
122	N	68	Low	66.8	Low	31 Å²	31	66.8 Å²	66.8	17%	0.166	31%	0.307	C	S	.	.			trans	-60.4	121.8	174.1	-167.1	-48.9	0	0	0	110.6	E116 P117 G119 K124	E116-N122 VanDerWaalsContact C-ND2 3.33Å; E116-N122 WeakPolarHBondContact O-CB 3.49Å; E116-N122 PolarHBondContact O-ND2 3.41Å; P117-N122 WeakPolarHBondContact CA-ND2 3.36Å; G119-N122 PolarHBondContact O-N 3.4Å; N122-K124 VanDerWaalsContact C-N 3.31Å; N122-K124 PolarHBondContact O-N 3.13Å; N122-K124 WeakPolarHBondContact OD1-CB 3.41Å; N122-K124 PolarHBondContact OD1-N 3.2Å
123	P	59.1	Low	64.9	Low	47 Å²	47	71.2 Å²	71.2	31%	0.305	34%	0.338	S	S	.	.	S	Bend	trans	-73.4	-18.5	-177.7	32.8	-40.8	0	0	0	113.6	R88 L121 W125	R88-P123 VanDerWaalsContact NH1-CB 3.32Å; L121-P123 WeakPolarHBondContact O-CD 3.48Å; P123-W125 PolarHBondContact O-N 3.33Å
124	K	58.8	Low	63	Low	47 Å²	47	72.7 Å²	72.7	20%	0.204	35%	0.351	C	S	.	.			trans	-86.8	99.6	-176.3	-56.2	-163.4	-171.2	-160.1	0	109.9	Y90 Q91 G92 S94 N122 T126 K127	Y90-K124 PolarHBondContact O-NZ 3.26Å; Q91-K124 PolarHBondContact O-NZ 3.1Å; G92-K124 VanDerWaalsContact C-NZ 3.26Å; G92-K124 PolarHBondContact O-NZ 3.45Å; S94-K124 WeakPolarHBondContact O-CE 3.48Å; N122-K124 VanDerWaalsContact C-N 3.31Å; N122-K124 PolarHBondContact O-N 3.13Å; N122-K124 WeakPolarHBondContact OD1-CB 3.41Å; N122-K124 PolarHBondContact OD1-N 3.2Å; K124-T126 PolarHBondContact O-N 2.94Å; K124-K127 PolarHBondContact O-N 3.24Å
125	W	50.8	Low	61	Low	170 Å²	170	75.4 Å²	75.4	64%	0.644	37%	0.371	S	S	*	.	H	α-helix	trans	-52.2	-29.6	178.9	-176.2	78.4	0	0	0	113.9	P123 K127 W128 M129	P123-W125 PolarHBondContact O-N 3.33Å; W125-K127 VanDerWaalsContact C-N 3.25Å; W125-K127 PolarHBondContact O-N 2.64Å; W125-W128 AromaticContact NE1-CE3 3.78Å; W125-W128 WeakPolarHBondContact O-CB 3.36Å; W125-W128 PolarHBondContact O-N 2.88Å; W125-M129 HydrophobicContact CH2-SD 4.1Å; W125-M129 HydrophobicContact CZ3-SD 4.02Å; W125-M129 PolarHBondContact O-N 3.29Å
126	T	54.8	Low	59	Low	76 Å²	76	80.4 Å²	80.4	47%	0.466	41%	0.405	S	S	.	.	H	α-helix	trans	-57.9	-36.3	178.1	52.3	0	0	0	0	112.7	K124 M129 H130	K124-T126 PolarHBondContact O-N 2.94Å; T126-M129 PolarHBondContact O-N 3.01Å; T126-H130 WeakPolarHBondContact O-CB 2.94Å; T126-H130 PolarHBondContact O-N 3.22Å; T126-H130 PolarHBondContact O-ND1 2.98Å
127	K	52	Low	57.3	Low	43 Å²	43	83.2 Å²	83.2	19%	0.187	43%	0.425	C	S	.	.	H	α-helix	trans	-73.9	-29.3	176.9	-76	-168.5	175.1	177	0	113.4	S93 P117 K124 W125 H130 K131	S93-K127 VanDerWaalsContact O-CE 3.29Å; S93-K127 WeakPolarHBondContact O-CE 3.47Å; S93-K127 PolarHBondContact O-NZ 2.59Å; S93-K127 PolarHBondContact OG-NZ 3.07Å; P117-K127 HydrophobicContact CB-CD 3.93Å; K124-K127 PolarHBondContact O-N 3.24Å; W125-K127 VanDerWaalsContact C-N 3.25Å; W125-K127 PolarHBondContact O-N 2.64Å; K127-H130 WeakPolarHBondContact O-CB 3.31Å; K127-K131 VanDerWaalsContact O-CB 3.26Å; K127-K131 WeakPolarHBondContact O-CB 3.13Å; K127-K131 PolarHBondContact O-N 3.31Å
128	W	52.2	Low	56	Low	147 Å²	147	85.3 Å²	85.3	56%	0.557	43%	0.431	S	S	*	.	H	α-helix	trans	-65.9	-49.3	171.4	-177.8	90.1	0	0	0	110.7	W125 H130 K131 H132	W125-W128 AromaticContact NE1-CE3 3.78Å; W125-W128 WeakPolarHBondContact O-CB 3.36Å; W125-W128 PolarHBondContact O-N 2.88Å; W128-H130 VanDerWaalsContact C-N 3.29Å; W128-H130 PolarHBondContact O-N 2.76Å; W128-K131 WeakPolarHBondContact O-CB 3.37Å; W128-K131 PolarHBondContact O-N 2.92Å; W128-K131 VanDerWaalsContact O-N 3.16Å; W128-H132 AromaticContact CD1-CD2 3.78Å; W128-H132 AromaticContact CD1-NE2 3.73Å; W128-H132 AromaticContact CD2-CD2 3.67Å; W128-H132 AromaticContact CE2-CD2 3.31Å; W128-H132 AromaticContact CE2-NE2 3.57Å; W128-H132 AromaticContact CG-CD2 3.95Å; W128-H132 AromaticContact CZ2-CD2 3.69Å; W128-H132 AromaticContact CZ2-NE2 3.99Å; W128-H132 AromaticContact NE1-CD2 3.39Å; W128-H132 PolarHBondContact NE1-CD2 2.87Å; W128-H132 AromaticContact NE1-NE2 3.19Å; W128-H132 PolarHBondContact NE1-NE2 3.01Å; W128-H132 VanDerWaalsContact NE1-NE2 3.19Å; W128-H132 PolarHBondContact O-CD2 2.97Å; W128-H132 PolarHBondContact O-N 2.85Å; W128-H132 VanDerWaalsContact O-N 3.13Å
129	M	48.9	Very low	55.5	Low	71 Å²	71	81.7 Å²	81.7	35%	0.35	42%	0.422	S	S	.	.	H	α-helix	trans	-56.4	-46.5	176	-177.7	-175.6	73.6	0	0	111.4	W125 T126 H132 C133	W125-M129 HydrophobicContact CH2-SD 4.1Å; W125-M129 HydrophobicContact CZ3-SD 4.02Å; W125-M129 PolarHBondContact O-N 3.29Å; T126-M129 PolarHBondContact O-N 3.01Å; M129-H132 PolarHBondContact O-N 2.79Å; M129-C133 WeakPolarHBondContact O-CB 3.32Å; M129-C133 PolarHBondContact O-N 3.44Å; M129-C133 PolarHBondContact O-SG 3.36Å
130	H	54.5	Low	55.8	Low	80 Å²	80	83.5 Å²	83.5	37%	0.37	43%	0.426	S	S	.	.	H	α-helix	trans	-58.7	-45.5	174.9	-88.8	179.4	0	0	0	114.3	T126 K127 W128 H132 C134 F138	T126-H130 WeakPolarHBondContact O-CB 2.94Å; T126-H130 PolarHBondContact O-N 3.22Å; T126-H130 PolarHBondContact O-ND1 2.98Å; K127-H130 WeakPolarHBondContact O-CB 3.31Å; W128-H130 VanDerWaalsContact C-N 3.29Å; W128-H130 PolarHBondContact O-N 2.76Å; H130-H132 PolarHBondContact O-N 2.72Å; H130-C134 PolarHBondContact O-N 3.33Å; H130-F138 HydrophobicContact CB-CD1 4.06Å; H130-F138 HydrophobicContact CB-CD2 4.2Å; H130-F138 HydrophobicContact CB-CE1 3.35Å; H130-F138 HydrophobicContact CB-CE2 3.47Å; H130-F138 VanDerWaalsContact CB-CE2 3.47Å; H130-F138 HydrophobicContact CB-CG 4.5Å; H130-F138 HydrophobicContact CB-CZ 3.06Å; H130-F138 AromaticContact CD2-CZ 3.91Å; H130-F138 AromaticContact CG-CE1 3.79Å; H130-F138 AromaticContact CG-CE2 3.66Å; H130-F138 AromaticContact CG-CZ 3.1Å; H130-F138 AromaticContact ND1-CE1 3.85Å; H130-F138 AromaticContact ND1-CZ 3.31Å; H130-F138 VanDerWaalsContact ND1-CZ 3.31Å; H130-F138 WeakPolarHBondContact ND1-CZ 3.4Å; H130-F138 WeakPolarHBondContact O-CD2 3.29Å; H130-F138 WeakPolarHBondContact O-CE2 3.47Å
131	K	54.8	Low	56.3	Low	127 Å²	127	77.2 Å²	77.2	55%	0.552	41%	0.406	S	S	*	.	H	α-helix	trans	-59.8	-34.3	176	-176.7	178.1	-179.4	177.9	0	112.4	K127 W128	K127-K131 VanDerWaalsContact O-CB 3.26Å; K127-K131 WeakPolarHBondContact O-CB 3.13Å; K127-K131 PolarHBondContact O-N 3.31Å; W128-K131 WeakPolarHBondContact O-CB 3.37Å; W128-K131 PolarHBondContact O-N 2.92Å; W128-K131 VanDerWaalsContact O-N 3.16Å
132	H	56.8	Low	57.3	Low	110 Å²	110	75.2 Å²	75.2	51%	0.509	40%	0.395	S	S	.	.	H	α-helix	trans	-94.3	-26.5	-174.8	-72.5	-68.2	0	0	0	114.5	W128 M129 H130	W128-H132 AromaticContact CD1-CD2 3.78Å; W128-H132 AromaticContact CD1-NE2 3.73Å; W128-H132 AromaticContact CD2-CD2 3.67Å; W128-H132 AromaticContact CE2-CD2 3.31Å; W128-H132 AromaticContact CE2-NE2 3.57Å; W128-H132 AromaticContact CG-CD2 3.95Å; W128-H132 AromaticContact CZ2-CD2 3.69Å; W128-H132 AromaticContact CZ2-NE2 3.99Å; W128-H132 AromaticContact NE1-CD2 3.39Å; W128-H132 PolarHBondContact NE1-CD2 2.87Å; W128-H132 AromaticContact NE1-NE2 3.19Å; W128-H132 PolarHBondContact NE1-NE2 3.01Å; W128-H132 VanDerWaalsContact NE1-NE2 3.19Å; W128-H132 PolarHBondContact O-CD2 2.97Å; W128-H132 PolarHBondContact O-N 2.85Å; W128-H132 VanDerWaalsContact O-N 3.13Å; M129-H132 PolarHBondContact O-N 2.79Å; H130-H132 PolarHBondContact O-N 2.72Å
133	C	56.6	Low	58.4	Low	95 Å²	95	74.8 Å²	74.8	64%	0.642	39%	0.393	S	S	*	.	H	α-helix	trans	-95.6	-23.7	-176.1	-67	0	0	0	0	114.9	M129	M129-C133 WeakPolarHBondContact O-CB 3.32Å; M129-C133 PolarHBondContact O-N 3.44Å; M129-C133 PolarHBondContact O-SG 3.36Å
134	C	51.1	Low	59.8	Low	61 Å²	61	74 Å²	74	41%	0.412	39%	0.387	S	S	.	.			trans	-139.6	55.5	-172.5	-69.3	0	0	0	0	114.8	H130 C136 C137 F138	H130-C134 PolarHBondContact O-N 3.33Å; C134-C136 VanDerWaalsContact C-N 3.27Å; C134-C136 PolarHBondContact O-N 2.79Å; C134-C137 HydrophobicContact CB-CB 4.47Å; C134-C137 PolarHBondContact O-N 3.21Å; C134-F138 HydrophobicContact CB-CD2 3.87Å; C134-F138 HydrophobicContact CB-CE2 4.07Å; C134-F138 VanDerWaalsContact O-CD2 3.29Å; C134-F138 WeakPolarHBondContact O-CD2 3.41Å; C134-F138 PolarHBondContact O-N 3.2Å
135	P	48.7	Very low	61.1	Low	100 Å²	100	76.1 Å²	76.1	65%	0.649	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-56.2	-30	-169.7	19.8	-31.3	0	0	0	115.6	C137 F138	P135-C137 VanDerWaalsContact C-N 3.34Å; P135-C137 PolarHBondContact O-N 2.84Å; P135-F138 PolarHBondContact O-N 2.93Å
136	C	46.4	Very low	62.8	Low	106 Å²	106	70.1 Å²	70.1	72%	0.716	39%	0.386	S	S	*	.	G	3₁₀ helix	trans	-74.6	-20.3	178.4	61.4	0	0	0	0	114.4	C134 R322	C134-C136 VanDerWaalsContact C-N 3.27Å; C134-C136 PolarHBondContact O-N 2.79Å; C136-R322 PolarHBondContact O-NH1 3.31Å
137	C	45	Very low	64.5	Low	71 Å²	71	67.2 Å²	67.2	48%	0.48	37%	0.367	S	S	.	.	G	3₁₀ helix	trans	-97.4	-2.2	177.4	-67.8	0	0	0	0	113.5	C134 P135 R322	C134-C137 HydrophobicContact CB-CB 4.47Å; C134-C137 PolarHBondContact O-N 3.21Å; P135-C137 VanDerWaalsContact C-N 3.34Å; P135-C137 PolarHBondContact O-N 2.84Å; C137-R322 VanDerWaalsContact CA-NH2 3.31Å
138	F	46	Very low	66.5	Low	79 Å²	79	65.9 Å²	65.9	35%	0.346	37%	0.365	S	S	.	.			trans	-99.4	109.6	-165.8	-102.5	-77.6	0	0	0	113.4	H130 C134 P135	H130-F138 HydrophobicContact CB-CD1 4.06Å; H130-F138 HydrophobicContact CB-CD2 4.2Å; H130-F138 HydrophobicContact CB-CE1 3.35Å; H130-F138 HydrophobicContact CB-CE2 3.47Å; H130-F138 VanDerWaalsContact CB-CE2 3.47Å; H130-F138 HydrophobicContact CB-CG 4.5Å; H130-F138 HydrophobicContact CB-CZ 3.06Å; H130-F138 AromaticContact CD2-CZ 3.91Å; H130-F138 AromaticContact CG-CE1 3.79Å; H130-F138 AromaticContact CG-CE2 3.66Å; H130-F138 AromaticContact CG-CZ 3.1Å; H130-F138 AromaticContact ND1-CE1 3.85Å; H130-F138 AromaticContact ND1-CZ 3.31Å; H130-F138 VanDerWaalsContact ND1-CZ 3.31Å; H130-F138 WeakPolarHBondContact ND1-CZ 3.4Å; H130-F138 WeakPolarHBondContact O-CD2 3.29Å; H130-F138 WeakPolarHBondContact O-CE2 3.47Å; C134-F138 HydrophobicContact CB-CD2 3.87Å; C134-F138 HydrophobicContact CB-CE2 4.07Å; C134-F138 VanDerWaalsContact O-CD2 3.29Å; C134-F138 WeakPolarHBondContact O-CD2 3.41Å; C134-F138 PolarHBondContact O-N 3.2Å; P135-F138 PolarHBondContact O-N 2.93Å
139	G	57.3	Low	68.5	Low	18 Å²	18	58.9 Å²	58.9	19%	0.186	34%	0.339	C	S	.	.	S	Bend	trans	98.9	162.7	169.5	0	0	0	0	0	115.3	Y118 S141	Y118-G139 WeakPolarHBondContact OH-CA 3.43Å; G139-S141 PolarHBondContact O-N 2.8Å
140	R	72.9	Confident	70.8	Confident	46 Å²	46	55.6 Å²	55.6	17%	0.174	32%	0.323	C	S	.	.			trans	-81.6	95.4	175.6	-60.9	-169.3	156	94.3	-5.8	107.7	Y118 C142 L143 T266 D267 Y324	Y118-R140 PolarHBondContact OH-N 3.33Å; R140-C142 PolarHBondContact O-N 3.22Å; R140-L143 HydrophobicContact CB-CB 4.26Å; R140-L143 HydrophobicContact CB-CD1 3.75Å; R140-L143 HydrophobicContact CB-CG 3.82Å; R140-L143 HydrophobicContact CG-CD1 4.17Å; R140-L143 PolarHBondContact O-N 3.41Å; R140-T266 WeakPolarHBondContact CD-OG1 3.42Å; R140-T266 PolarHBondContact NE-O 2.95Å; R140-T266 PolarHBondContact NE-OG1 2.78Å; R140-T266 VanDerWaalsContact NE-OG1 3.14Å; R140-T266 PolarHBondContact NH2-O 3.05Å; R140-D267 IonicContact CZ-OD1 3.83Å; R140-D267 IonicContact CZ-OD2 2.87Å; R140-D267 IonicContact NH1-OD1 3.91Å; R140-D267 IonicContact NH1-OD2 3.03Å; R140-D267 PolarHBondContact NH1-OD2 3.1Å; R140-D267 IonicContact NH2-OD1 2.85Å; R140-D267 PolarHBondContact NH2-OD1 3.13Å; R140-D267 IonicContact NH2-OD2 2.92Å; R140-D267 PolarHBondContact NH2-OD2 2.78Å; R140-Y324 WeakPolarHBondContact CA-OH 3.48Å; R140-Y324 HydrophobicContact CB-CE2 4.15Å; R140-Y324 HydrophobicContact CG-CE1 3.88Å; R140-Y324 HydrophobicContact CG-CE2 4.11Å; R140-Y324 WeakPolarHBondContact CG-OH 3.47Å
141	S	79.9	Confident	72.8	Confident	55 Å²	55	52.1 Å²	52.1	39%	0.385	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.8	-11.6	-175	58.6	0	0	0	0	114.6	G139 F315	G139-S141 PolarHBondContact O-N 2.8Å; S141-F315 WeakPolarHBondContact O-CE1 3.36Å; S141-F315 WeakPolarHBondContact O-CZ 3.37Å
142	C	89.3	Confident	74.8	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-6.3	174.3	58.2	0	0	0	0	114.4	R140 P314 F315 K316	R140-C142 PolarHBondContact O-N 3.22Å; C142-P314 HydrophobicContact CB-CB 4.09Å; C142-P314 CarbonylContact O-C 3.45Å; C142-P314 WeakPolarHBondContact O-CA 3.48Å; C142-P314 VanDerWaalsContact O-CB 3.27Å; C142-P314 WeakPolarHBondContact O-CB 3.33Å; C142-F315 WeakPolarHBondContact O-CD1 3.2Å; C142-F315 WeakPolarHBondContact O-CE1 3.49Å; C142-F315 PolarHBondContact O-N 3.45Å; C142-K316 HydrophobicContact CB-CG 3.88Å; C142-K316 WeakPolarHBondContact CB-O 3.33Å
143	L	90.8	Very high	76.8	Confident	21 Å²	21	41.1 Å²	41.1	11%	0.11	26%	0.259	C	S	.	.	S	Bend	trans	-104.2	149	-179.9	-62.8	-176.2	0	0	0	111.6	R140 T266 L311 S312 P314	R140-L143 HydrophobicContact CB-CB 4.26Å; R140-L143 HydrophobicContact CB-CD1 3.75Å; R140-L143 HydrophobicContact CB-CG 3.82Å; R140-L143 HydrophobicContact CG-CD1 4.17Å; R140-L143 PolarHBondContact O-N 3.41Å; L143-T266 HydrophobicContact CD2-CG2 4.25Å; L143-L311 HydrophobicContact CD1-CB 3.95Å; L143-L311 HydrophobicContact CD1-CD2 3.58Å; L143-L311 HydrophobicContact CD1-CG 4.39Å; L143-S312 WeakPolarHBondContact CD2-O 3.47Å; L143-P314 HydrophobicContact CD2-CB 3.81Å
144	V	88.7	Confident	78.7	Confident	32 Å²	32	36.6 Å²	36.6	19%	0.194	23%	0.228	C	C	.	.			trans	-73.1	127.3	172.1	-170.7	0	0	0	0	109	Q147 F315 T377	V144-Q147 HydrophobicContact CB-CG 4.5Å; V144-Q147 VanDerWaalsContact CG1-CD 3.45Å; V144-Q147 HydrophobicContact CG1-CG 4.07Å; V144-F315 HydrophobicContact CG2-CD1 4.11Å; V144-T377 HydrophobicContact CG2-CG2 3.45Å; V144-T377 VanDerWaalsContact CG2-CG2 3.45Å
145	P	86.1	Confident	81	Confident	91 Å²	91	33.7 Å²	33.7	59%	0.591	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	143	179.3	-22.4	33.3	0	0	0	112.4	Q147	P145-Q147 VanDerWaalsContact C-N 3.29Å; P145-Q147 PolarHBondContact O-N 3.39Å
146	N	86.1	Confident	83.3	Confident	43 Å²	43	29 Å²	29	23%	0.23	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.1	29.8	167.4	-156.3	52.2	0	0	0	115.3	K113 E116	K113-N146 WeakPolarHBondContact CE-ND2 3.39Å; K113-N146 WeakPolarHBondContact CE-O 3.32Å; K113-N146 PolarHBondContact O-OD1 3.46Å; E116-N146 WeakPolarHBondContact OE2-CA 3.43Å
147	Q	91.2	Very high	85.8	Confident	16 Å²	16	25 Å²	25	8%	0.075	15%	0.149	C	C	.	.			trans	-122.1	22	174.8	-66.5	-173.4	-7.4	0	0	111.9	V144 P145 Y149 L150 S151	V144-Q147 HydrophobicContact CB-CG 4.5Å; V144-Q147 VanDerWaalsContact CG1-CD 3.45Å; V144-Q147 HydrophobicContact CG1-CG 4.07Å; P145-Q147 VanDerWaalsContact C-N 3.29Å; P145-Q147 PolarHBondContact O-N 3.39Å; Q147-Y149 VanDerWaalsContact C-N 3.3Å; Q147-Y149 PolarHBondContact O-N 3.05Å; Q147-L150 HydrophobicContact CB-CD1 4.34Å; Q147-L150 HydrophobicContact CG-CD1 4.31Å; Q147-L150 WeakPolarHBondContact O-CB 3.48Å; Q147-L150 PolarHBondContact O-N 3.06Å; Q147-L150 VanDerWaalsContact O-N 3.1Å; Q147-S151 PolarHBondContact O-N 3.49Å; Q147-S151 VanDerWaalsContact O-N 3.08Å
148	G	93.2	Very high	88.3	Confident	14 Å²	14	21.6 Å²	21.6	14%	0.144	13%	0.127	C	C	.	.	H	α-helix	trans	-60.5	-39.6	-178.3	0	0	0	0	0	112.5	E116 L150 S151 E152 G310	E116-G148 WeakPolarHBondContact OE1-CA 3.47Å; E116-G148 PolarHBondContact OE1-N 3.05Å; E116-G148 VanDerWaalsContact OE1-N 3.07Å; E116-G148 PolarHBondContact OE2-N 3.25Å; G148-L150 VanDerWaalsContact C-N 3.27Å; G148-L150 PolarHBondContact O-N 3.33Å; G148-S151 WeakPolarHBondContact O-CA 3.23Å; G148-S151 VanDerWaalsContact O-CB 3.31Å; G148-S151 WeakPolarHBondContact O-CB 3.16Å; G148-S151 PolarHBondContact O-N 3.47Å; G148-E152 WeakPolarHBondContact O-CG 3.31Å; G148-E152 PolarHBondContact O-N 2.84Å; G148-G310 VanDerWaalsContact CA-O 3.28Å; G148-G310 WeakPolarHBondContact CA-O 3.47Å; G148-G310 WeakPolarHBondContact O-CA 3.4Å
149	Y	95.1	Very high	90.8	Very high	1 Å²	1	18 Å²	18	0%	0.004	11%	0.111	C	C	.	.	H	α-helix	trans	-61	-32	175.5	80.5	-77.1	0	0	0	113.8	K113 E116 Q147 A153 V172 I216 D370	K113-Y149 HydrophobicContact CB-CD1 3.77Å; K113-Y149 HydrophobicContact CB-CE1 3.96Å; K113-Y149 HydrophobicContact CB-CG 4.33Å; K113-Y149 HydrophobicContact CD-CD1 4.22Å; K113-Y149 HydrophobicContact CD-CE1 3.54Å; K113-Y149 HydrophobicContact CG-CD1 3.8Å; K113-Y149 HydrophobicContact CG-CE1 3.64Å; E116-Y149 PolarHBondContact OE1-N 3.06Å; Q147-Y149 VanDerWaalsContact C-N 3.3Å; Q147-Y149 PolarHBondContact O-N 3.05Å; Y149-A153 PolarHBondContact O-N 2.97Å; Y149-V172 HydrophobicContact CD2-CG1 3.99Å; Y149-V172 HydrophobicContact CD2-CG2 4.06Å; Y149-V172 HydrophobicContact CE2-CG1 3.74Å; Y149-V172 HydrophobicContact CE2-CG2 4.13Å; Y149-I216 HydrophobicContact CE2-CD1 4.13Å; Y149-I216 HydrophobicContact CE2-CG1 4.13Å; Y149-D370 WeakPolarHBondContact CE1-OD2 3.33Å; Y149-D370 PolarHBondContact OH-OD2 2.91Å
150	L	96.5	Very high	92.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.005	12%	0.116	C	C	.	.	H	α-helix	trans	-74.4	-36.3	173.1	-69.1	179.6	0	0	0	111.5	Q147 G148 E152 A153 G154 V172 L366 F367 D370	Q147-L150 HydrophobicContact CB-CD1 4.34Å; Q147-L150 HydrophobicContact CG-CD1 4.31Å; Q147-L150 WeakPolarHBondContact O-CB 3.48Å; Q147-L150 PolarHBondContact O-N 3.06Å; Q147-L150 VanDerWaalsContact O-N 3.1Å; G148-L150 VanDerWaalsContact C-N 3.27Å; G148-L150 PolarHBondContact O-N 3.33Å; L150-E152 VanDerWaalsContact C-N 3.33Å; L150-A153 PolarHBondContact O-N 3.02Å; L150-G154 WeakPolarHBondContact O-CA 3.29Å; L150-G154 PolarHBondContact O-N 3.18Å; L150-V172 HydrophobicContact CD2-CG2 4.01Å; L150-L366 HydrophobicContact CD2-CD1 4.29Å; L150-L366 HydrophobicContact CD2-CG 4.28Å; L150-L366 WeakPolarHBondContact CD2-O 3.49Å; L150-F367 HydrophobicContact CB-CD1 4.06Å; L150-F367 HydrophobicContact CB-CE1 4.11Å; L150-F367 HydrophobicContact CD1-CB 4.36Å; L150-F367 HydrophobicContact CD1-CD1 4.36Å; L150-F367 HydrophobicContact CD1-CG 4.42Å; L150-D370 HydrophobicContact CD1-CB 3.72Å
151	S	97	Very high	93.8	Very high	7 Å²	7	21.3 Å²	21.3	5%	0.049	12%	0.12	C	C	.	.	H	α-helix	trans	-61.5	-41.8	173.1	179.7	0	0	0	0	111.3	Q147 G148 G154 A155 N309 S312	Q147-S151 PolarHBondContact O-N 3.49Å; Q147-S151 VanDerWaalsContact O-N 3.08Å; G148-S151 WeakPolarHBondContact O-CA 3.23Å; G148-S151 VanDerWaalsContact O-CB 3.31Å; G148-S151 WeakPolarHBondContact O-CB 3.16Å; G148-S151 PolarHBondContact O-N 3.47Å; S151-G154 PolarHBondContact O-N 2.86Å; S151-A155 WeakPolarHBondContact O-CB 3.33Å; S151-A155 PolarHBondContact O-N 2.99Å; S151-N309 PolarHBondContact OG-O 2.68Å; S151-S312 WeakPolarHBondContact OG-CB 3.49Å; S151-S312 PolarHBondContact OG-N 3.24Å; S151-S312 PolarHBondContact OG-OG 3.21Å
152	E	97.3	Very high	94.6	Very high	4 Å²	4	18.9 Å²	18.9	2%	0.019	10%	0.103	C	C	.	.	H	α-helix	trans	-60.4	-51.1	173.8	-67.3	-74.8	-171.4	0	0	112.4	K111 G148 L150 G154 A155 S156 T170 D308 N309 G310	K111-E152 IonicContact NZ-OE1 2.7Å; K111-E152 PolarHBondContact NZ-OE1 2.93Å; G148-E152 WeakPolarHBondContact O-CG 3.31Å; G148-E152 PolarHBondContact O-N 2.84Å; L150-E152 VanDerWaalsContact C-N 3.33Å; E152-G154 VanDerWaalsContact C-N 3.32Å; E152-G154 PolarHBondContact O-N 3.31Å; E152-A155 PolarHBondContact O-N 2.74Å; E152-S156 PolarHBondContact O-N 2.73Å; E152-T170 HydrophobicContact CB-CG2 4.03Å; E152-D308 WeakPolarHBondContact OE1-CA 3.35Å; E152-N309 VanDerWaalsContact CD-N 3.27Å; E152-N309 PolarHBondContact OE1-N 2.83Å; E152-N309 WeakPolarHBondContact OE2-CA 3.25Å; E152-N309 WeakPolarHBondContact OE2-CB 3.34Å; E152-N309 PolarHBondContact OE2-N 2.81Å; E152-G310 PolarHBondContact OE1-N 3.14Å; E152-G310 VanDerWaalsContact OE1-N 3.09Å
153	A	97.4	Very high	95	Very high	3 Å²	3	28 Å²	28	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-66.1	-35.5	178.1	0	0	0	0	0	112.2	Y149 L150 S156 L157 V172 L366	Y149-A153 PolarHBondContact O-N 2.97Å; L150-A153 PolarHBondContact O-N 3.02Å; A153-S156 PolarHBondContact O-N 2.99Å; A153-L157 PolarHBondContact O-N 3.36Å; A153-V172 HydrophobicContact CB-CG2 3.83Å; A153-L366 HydrophobicContact CB-CD1 4.08Å; A153-L366 HydrophobicContact CB-CD2 3.96Å
154	G	97.8	Very high	95.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-67.3	-37.8	178.2	0	0	0	0	0	112.4	L150 S151 E152 L157 V158	L150-G154 WeakPolarHBondContact O-CA 3.29Å; L150-G154 PolarHBondContact O-N 3.18Å; S151-G154 PolarHBondContact O-N 2.86Å; E152-G154 VanDerWaalsContact C-N 3.32Å; E152-G154 PolarHBondContact O-N 3.31Å; G154-L157 WeakPolarHBondContact O-CB 3.43Å; G154-L157 PolarHBondContact O-N 3.37Å; G154-V158 WeakPolarHBondContact O-CG2 3.48Å; G154-V158 PolarHBondContact O-N 3.29Å
155	A	98.5	Very high	95.8	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63.1	-43.4	173.6	0	0	0	0	0	111.6	S151 E152 L157 V158 D159 I263 N309	S151-A155 WeakPolarHBondContact O-CB 3.33Å; S151-A155 PolarHBondContact O-N 2.99Å; E152-A155 PolarHBondContact O-N 2.74Å; A155-L157 VanDerWaalsContact C-N 3.3Å; A155-L157 PolarHBondContact O-N 3.42Å; A155-V158 PolarHBondContact O-N 2.96Å; A155-D159 VanDerWaalsContact O-CB 3.32Å; A155-D159 WeakPolarHBondContact O-CB 3.48Å; A155-D159 PolarHBondContact O-N 3.2Å; A155-I263 HydrophobicContact CB-CD1 3.97Å; A155-N309 HydrophobicContact CB-CB 3.41Å; A155-N309 VanDerWaalsContact CB-CB 3.41Å
156	S	98	Very high	96.4	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-63.8	-35.1	173.9	179.9	0	0	0	0	112.5	E152 A153 Q160 T170	E152-S156 PolarHBondContact O-N 2.73Å; A153-S156 PolarHBondContact O-N 2.99Å; S156-Q160 WeakPolarHBondContact O-CB 3.49Å; S156-Q160 VanDerWaalsContact O-CG 3.25Å; S156-Q160 WeakPolarHBondContact O-CG 3.49Å; S156-Q160 PolarHBondContact O-N 3.15Å; S156-T170 PolarHBondContact OG-N 2.86Å
157	L	97.3	Very high	96.9	Very high	22 Å²	22	25.1 Å²	25.1	12%	0.115	12%	0.116	C	C	.	.	H	α-helix	trans	-65.6	-47.5	175.5	-171.8	155	0	0	0	111.7	A153 G154 A155 Q160 R161 L359 D362 L363 L366	A153-L157 PolarHBondContact O-N 3.36Å; G154-L157 WeakPolarHBondContact O-CB 3.43Å; G154-L157 PolarHBondContact O-N 3.37Å; A155-L157 VanDerWaalsContact C-N 3.3Å; A155-L157 PolarHBondContact O-N 3.42Å; L157-Q160 PolarHBondContact O-N 2.89Å; L157-R161 HydrophobicContact CD2-CG 4.09Å; L157-R161 WeakPolarHBondContact O-CB 3.41Å; L157-R161 WeakPolarHBondContact O-CG 3.41Å; L157-R161 PolarHBondContact O-N 2.83Å; L157-L359 HydrophobicContact CD2-CD1 3.57Å; L157-D362 HydrophobicContact CD1-CB 4.06Å; L157-D362 HydrophobicContact CD2-CB 3.93Å; L157-L363 HydrophobicContact CD2-CD2 4.15Å; L157-L363 HydrophobicContact CD2-CG 4.26Å; L157-L366 HydrophobicContact CD1-CB 4.42Å; L157-L366 HydrophobicContact CD1-CD2 4.16Å
158	V	98.3	Very high	97.3	Very high	1 Å²	1	24.9 Å²	24.9	1%	0.006	12%	0.116	C	C	.	.	H	α-helix	trans	-62.1	-44.8	177	172.8	0	0	0	0	110.8	G154 A155 Q160 R161 L162 L259 I263 F313 L359 L363	G154-V158 WeakPolarHBondContact O-CG2 3.48Å; G154-V158 PolarHBondContact O-N 3.29Å; A155-V158 PolarHBondContact O-N 2.96Å; V158-Q160 PolarHBondContact O-N 2.87Å; V158-R161 PolarHBondContact O-N 3.44Å; V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 2.95Å; V158-L259 HydrophobicContact CB-CD1 4.29Å; V158-L259 HydrophobicContact CG1-CD1 4.02Å; V158-I263 HydrophobicContact CB-CG2 4.22Å; V158-I263 HydrophobicContact CG1-CG2 4.15Å; V158-I263 HydrophobicContact CG2-CG2 4.06Å; V158-F313 HydrophobicContact CG2-CE1 4.28Å; V158-F313 HydrophobicContact CG2-CZ 4.06Å; V158-L359 HydrophobicContact CG2-CD1 4.11Å; V158-L359 HydrophobicContact CG2-CD2 4.5Å; V158-L363 HydrophobicContact CG2-CD1 4.41Å; V158-L363 HydrophobicContact CG2-CD2 4.38Å
159	D	98.4	Very high	97.4	Very high	3 Å²	3	25.7 Å²	25.7	2%	0.016	12%	0.118	C	C	.	.	H	α-helix	trans	-54.7	-49.6	175.9	175.6	98.4	0	0	0	112.1	A155 L162 R163 L164 N165 I166 V167 L259	A155-D159 VanDerWaalsContact O-CB 3.32Å; A155-D159 WeakPolarHBondContact O-CB 3.48Å; A155-D159 PolarHBondContact O-N 3.2Å; D159-L162 CarbonylContact O-C 3.14Å; D159-L162 PolarHBondContact O-N 3.43Å; D159-R163 PolarHBondContact O-N 3.41Å; D159-L164 PolarHBondContact O-N 2.91Å; D159-L164 WeakPolarHBondContact OD1-CB 3.16Å; D159-N165 PolarHBondContact OD1-N 3.43Å; D159-N165 WeakPolarHBondContact OD2-CA 3.39Å; D159-N165 PolarHBondContact OD2-N 2.92Å; D159-N165 VanDerWaalsContact OD2-N 3.14Å; D159-I166 WeakPolarHBondContact OD1-CG1 3.46Å; D159-I166 PolarHBondContact OD1-N 2.96Å; D159-V167 HydrophobicContact CB-CB 3.88Å; D159-V167 HydrophobicContact CB-CG2 3.74Å; D159-V167 PolarHBondContact OD1-N 2.72Å; D159-L259 HydrophobicContact CB-CD1 4.39Å
160	Q	96.7	Very high	97.5	Very high	63 Å²	63	25.6 Å²	25.6	29%	0.294	12%	0.118	S	C	.	.	H	α-helix	trans	-67.2	-41.7	-179.8	-73.9	174.9	-16.1	0	0	112.5	S156 L157 V158 L162 R163 R171	S156-Q160 WeakPolarHBondContact O-CB 3.49Å; S156-Q160 VanDerWaalsContact O-CG 3.25Å; S156-Q160 WeakPolarHBondContact O-CG 3.49Å; S156-Q160 PolarHBondContact O-N 3.15Å; L157-Q160 PolarHBondContact O-N 2.89Å; V158-Q160 PolarHBondContact O-N 2.87Å; Q160-L162 VanDerWaalsContact C-N 3.26Å; Q160-L162 PolarHBondContact O-N 3.01Å; Q160-R163 PolarHBondContact O-N 3.39Å; Q160-R171 VanDerWaalsContact CD-NH2 3.32Å; Q160-R171 VanDerWaalsContact OE1-CZ 3.25Å
161	R	96.7	Very high	97.5	Very high	71 Å²	71	27.3 Å²	27.3	27%	0.268	12%	0.124	S	C	.	.	H	α-helix	trans	-63.1	-33.8	177.8	-75.4	-62.6	-131.8	127.4	0.4	112.2	L157 V158 F355 S358 L359 D362	L157-R161 HydrophobicContact CD2-CG 4.09Å; L157-R161 WeakPolarHBondContact O-CB 3.41Å; L157-R161 WeakPolarHBondContact O-CG 3.41Å; L157-R161 PolarHBondContact O-N 2.83Å; V158-R161 PolarHBondContact O-N 3.44Å; R161-F355 HydrophobicContact CB-CE2 4.37Å; R161-F355 HydrophobicContact CB-CZ 4.12Å; R161-F355 WeakPolarHBondContact O-CE2 3.38Å; R161-F355 WeakPolarHBondContact O-CZ 3.35Å; R161-S358 PolarHBondContact NH2-OG 2.91Å; R161-L359 HydrophobicContact CB-CD1 3.99Å; R161-L359 HydrophobicContact CG-CD1 3.87Å; R161-D362 IonicContact CZ-OD2 3.3Å; R161-D362 IonicContact NE-OD2 2.75Å; R161-D362 PolarHBondContact NE-OD2 3.19Å; R161-D362 IonicContact NH2-OD1 3.95Å; R161-D362 IonicContact NH2-OD2 2.71Å; R161-D362 PolarHBondContact NH2-OD2 3.26Å
162	L	97.3	Very high	97.5	Very high	3 Å²	3	27.4 Å²	27.4	2%	0.016	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.6	-2.3	177	-70.1	170.5	0	0	0	114	V158 D159 Q160 L164 V258 L262 L349 L350 F355	V158-L162 HydrophobicContact CG1-CD1 3.79Å; V158-L162 WeakPolarHBondContact O-CB 3.47Å; V158-L162 PolarHBondContact O-N 2.95Å; D159-L162 CarbonylContact O-C 3.14Å; D159-L162 PolarHBondContact O-N 3.43Å; Q160-L162 VanDerWaalsContact C-N 3.26Å; Q160-L162 PolarHBondContact O-N 3.01Å; L162-L164 HydrophobicContact CB-CD1 4.14Å; L162-L164 HydrophobicContact CB-CD2 4.15Å; L162-L164 HydrophobicContact CB-CG 3.73Å; L162-L164 HydrophobicContact CD1-CD1 4.21Å; L162-L164 PolarHBondContact O-N 3.22Å; L162-V258 HydrophobicContact CD1-CG1 4.34Å; L162-L262 HydrophobicContact CD1-CD1 3.36Å; L162-L349 HydrophobicContact CD2-CB 4.21Å; L162-L349 HydrophobicContact CD2-CD1 4.2Å; L162-L350 HydrophobicContact CD2-CD2 3.8Å; L162-L350 HydrophobicContact CD2-CG 4.24Å; L162-F355 HydrophobicContact CD2-CE1 3.71Å; L162-F355 HydrophobicContact CD2-CZ 3.68Å; L162-F355 HydrophobicContact CG-CZ 4.22Å
163	R	97.2	Very high	97.4	Very high	193 Å²	193	27.2 Å²	27.2	73%	0.728	12%	0.123	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.7	41	-177.3	-52	177.2	-174.9	171.9	0.9	112.6	D159 Q160 N165	D159-R163 PolarHBondContact O-N 3.41Å; Q160-R163 PolarHBondContact O-N 3.39Å; R163-N165 PolarHBondContact O-OD1 3.1Å; R163-N165 VanDerWaalsContact O-OD1 3.13Å
164	L	98	Very high	97.3	Very high	2 Å²	2	30.1 Å²	30.1	1%	0.01	13%	0.134	C	C	.	.			trans	-77	-41.7	177.1	-58.2	178.7	0	0	0	110.1	D159 L162 I166 K255 V258 L259 V346	D159-L164 PolarHBondContact O-N 2.91Å; D159-L164 WeakPolarHBondContact OD1-CB 3.16Å; L162-L164 HydrophobicContact CB-CD1 4.14Å; L162-L164 HydrophobicContact CB-CD2 4.15Å; L162-L164 HydrophobicContact CB-CG 3.73Å; L162-L164 HydrophobicContact CD1-CD1 4.21Å; L162-L164 PolarHBondContact O-N 3.22Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 HydrophobicContact CB-CG1 4.17Å; L164-I166 PolarHBondContact O-N 3.31Å; L164-K255 HydrophobicContact CB-CB 4.33Å; L164-K255 HydrophobicContact CD2-CB 4.14Å; L164-K255 HydrophobicContact CD2-CG 4.07Å; L164-K255 VanDerWaalsContact O-CD 3.31Å; L164-K255 WeakPolarHBondContact O-CD 3.16Å; L164-K255 PolarHBondContact O-NZ 3.1Å; L164-K255 VanDerWaalsContact O-NZ 3.1Å; L164-V258 HydrophobicContact CD1-CG1 4.22Å; L164-V258 HydrophobicContact CD2-CG1 4.34Å; L164-L259 HydrophobicContact CD1-CB 3.82Å; L164-L259 HydrophobicContact CD1-CD1 4.45Å; L164-V346 HydrophobicContact CD2-CG1 4Å
165	N	97.5	Very high	97.1	Very high	116 Å²	116	30.1 Å²	30.1	62%	0.62	13%	0.134	S	C	*	.			trans	60.6	37.1	176.9	-58.6	92.3	0	0	0	113.2	D159 R163	D159-N165 PolarHBondContact OD1-N 3.43Å; D159-N165 WeakPolarHBondContact OD2-CA 3.39Å; D159-N165 PolarHBondContact OD2-N 2.92Å; D159-N165 VanDerWaalsContact OD2-N 3.14Å; R163-N165 PolarHBondContact O-OD1 3.1Å; R163-N165 VanDerWaalsContact O-OD1 3.13Å
166	I	98.2	Very high	96.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	14%	0.141	C	C	.	.			trans	-111.8	-21.5	177.5	60	168.5	0	0	0	112.5	D159 L164 P168 K255 L256 L259 L304 F305 A306	D159-I166 WeakPolarHBondContact OD1-CG1 3.46Å; D159-I166 PolarHBondContact OD1-N 2.96Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 HydrophobicContact CB-CG1 4.17Å; L164-I166 PolarHBondContact O-N 3.31Å; I166-P168 WeakPolarHBondContact O-CD 3.32Å; I166-K255 HydrophobicContact CD1-CB 4.11Å; I166-K255 HydrophobicContact CG2-CB 4.06Å; I166-K255 HydrophobicContact CG2-CD 4.07Å; I166-L256 HydrophobicContact CD1-CB 4.04Å; I166-L256 HydrophobicContact CD1-CD1 4.39Å; I166-L259 HydrophobicContact CD1-CB 4.21Å; I166-L259 HydrophobicContact CD1-CD2 3.93Å; I166-L259 HydrophobicContact CG1-CD2 4.21Å; I166-L304 HydrophobicContact CB-CD2 4.24Å; I166-L304 HydrophobicContact CD1-CD2 4.39Å; I166-L304 HydrophobicContact CG2-CD2 4.37Å; I166-F305 CarbonylContact O-C 3.42Å; I166-F305 VanDerWaalsContact O-CA 3.22Å; I166-F305 WeakPolarHBondContact O-CA 3.34Å; I166-A306 HydrophobicContact CD1-CB 4.11Å; I166-A306 HydrophobicContact CG1-CB 4.24Å; I166-A306 PolarHBondContact O-N 3.05Å
167	V	98.3	Very high	96.6	Very high	7 Å²	7	31.4 Å²	31.4	4%	0.042	14%	0.142	C	C	.	.	S	Bend	trans	-88.2	118.1	173.8	-177.4	0	0	0	0	108.9	D159 T169 L259 A306	D159-V167 HydrophobicContact CB-CB 3.88Å; D159-V167 HydrophobicContact CB-CG2 3.74Å; D159-V167 PolarHBondContact OD1-N 2.72Å; V167-T169 PolarHBondContact O-N 2.99Å; V167-L259 HydrophobicContact CG2-CD2 3.29Å; V167-A306 HydrophobicContact CG2-CB 3.99Å
168	P	97.8	Very high	96.3	Very high	12 Å²	12	36 Å²	36	8%	0.078	16%	0.163	C	C	.	.	P	Polyproline II helix	trans	-54.7	132.4	171.3	-22.6	32.9	0	0	0	110	I166 T170 Q220 L221 V223 F305 I307	I166-P168 WeakPolarHBondContact O-CD 3.32Å; P168-T170 PolarHBondContact O-N 3Å; P168-T170 VanDerWaalsContact O-N 3.1Å; P168-T170 PolarHBondContact O-OG1 2.89Å; P168-Q220 HydrophobicContact CB-CG 3.96Å; P168-L221 HydrophobicContact CB-CB 4.48Å; P168-L221 VanDerWaalsContact CB-O 3.3Å; P168-L221 WeakPolarHBondContact CB-O 3.28Å; P168-V223 HydrophobicContact CB-CG1 4.07Å; P168-V223 HydrophobicContact CG-CG1 3.79Å; P168-V223 HydrophobicContact CG-CG2 4.29Å; P168-F305 HydrophobicContact CG-CB 4.35Å; P168-F305 HydrophobicContact CG-CD1 4.11Å; P168-I307 HydrophobicContact CG-CG2 4.39Å
169	T	97	Very high	96	Very high	30 Å²	30	37.5 Å²	37.5	18%	0.184	17%	0.173	C	C	.	.	P	Polyproline II helix	trans	-47.9	122.9	-171.6	-61	0	0	0	0	110.9	F69 V167 R171 L221	F69-T169 HydrophobicContact CB-CG2 4.5Å; F69-T169 HydrophobicContact CD2-CG2 3.71Å; F69-T169 HydrophobicContact CE2-CG2 4.38Å; F69-T169 HydrophobicContact CG-CG2 4.38Å; V167-T169 PolarHBondContact O-N 2.99Å; T169-R171 HydrophobicContact CG2-CG 4.48Å; T169-L221 PolarHBondContact O-N 2.8Å
170	T	97.2	Very high	95.8	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	128.3	-176	-54.5	0	0	0	0	110.1	E152 S156 P168 F219 Q220	E152-T170 HydrophobicContact CB-CG2 4.03Å; S156-T170 PolarHBondContact OG-N 2.86Å; P168-T170 PolarHBondContact O-N 3Å; P168-T170 VanDerWaalsContact O-N 3.1Å; P168-T170 PolarHBondContact O-OG1 2.89Å; T170-F219 VanDerWaalsContact CA-O 3.31Å; T170-F219 WeakPolarHBondContact CA-O 3.38Å; T170-Q220 HydrophobicContact CG2-CB 3.97Å; T170-Q220 VanDerWaalsContact OG1-CB 3.3Å; T170-Q220 WeakPolarHBondContact OG1-CB 3.35Å; T170-Q220 VanDerWaalsContact OG1-CG 3.24Å; T170-Q220 WeakPolarHBondContact OG1-CG 3.27Å; T170-Q220 PolarHBondContact OG1-NE2 2.81Å
171	R	96.2	Very high	95.5	Very high	37 Å²	37	36.6 Å²	36.6	14%	0.14	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	164.8	178.8	-56.2	-66.7	-175.7	-124.9	7	111.5	L59 D66 F69 Q160 T169 S218 F219	L59-R171 HydrophobicContact CD1-CB 4.4Å; D66-R171 IonicContact OD2-NH2 3.65Å; F69-R171 HydrophobicContact CD1-CG 4.11Å; F69-R171 HydrophobicContact CD2-CG 4.12Å; F69-R171 HydrophobicContact CE1-CB 3.82Å; F69-R171 HydrophobicContact CE1-CG 3.78Å; F69-R171 HydrophobicContact CE2-CB 4.04Å; F69-R171 HydrophobicContact CE2-CG 3.77Å; F69-R171 HydrophobicContact CG-CG 4.28Å; F69-R171 HydrophobicContact CZ-CB 3.49Å; F69-R171 VanDerWaalsContact CZ-CB 3.49Å; F69-R171 HydrophobicContact CZ-CG 3.61Å; Q160-R171 VanDerWaalsContact CD-NH2 3.32Å; Q160-R171 VanDerWaalsContact OE1-CZ 3.25Å; T169-R171 HydrophobicContact CG2-CG 4.48Å; R171-S218 WeakPolarHBondContact O-CA 3.41Å; R171-F219 PolarHBondContact N-O 2.98Å; R171-F219 PolarHBondContact O-N 3.1Å
172	V	96.1	Very high	95.2	Very high	8 Å²	8	33.7 Å²	33.7	5%	0.048	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	121.2	171.9	-176.7	0	0	0	0	108.9	V60 Y149 L150 A153 I216 G217 L366	V60-V172 HydrophobicContact CB-CG1 4.19Å; V60-V172 HydrophobicContact CG2-CB 4.5Å; V60-V172 HydrophobicContact CG2-CG1 3.81Å; V60-V172 PolarHBondContact N-O 3.16Å; Y149-V172 HydrophobicContact CD2-CG1 3.99Å; Y149-V172 HydrophobicContact CD2-CG2 4.06Å; Y149-V172 HydrophobicContact CE2-CG1 3.74Å; Y149-V172 HydrophobicContact CE2-CG2 4.13Å; L150-V172 HydrophobicContact CD2-CG2 4.01Å; A153-V172 HydrophobicContact CB-CG2 3.83Å; V172-I216 HydrophobicContact CG1-CD1 3.76Å; V172-I216 HydrophobicContact CG1-CG1 3.61Å; V172-G217 WeakPolarHBondContact CA-O 3.47Å; V172-L366 HydrophobicContact CG2-CD1 3.83Å
173	V	95.3	Very high	94.8	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	165.6	179	-52.8	0	0	0	0	110.8	P58 L59 F69 L73 F110 L175 I216 G217 F219	P58-V173 CarbonylContact O-C 3.55Å; P58-V173 VanDerWaalsContact O-CA 3.23Å; P58-V173 WeakPolarHBondContact O-CA 3.49Å; P58-V173 WeakPolarHBondContact O-CB 3.48Å; L59-V173 HydrophobicContact CD1-CG1 4.24Å; F69-V173 HydrophobicContact CE1-CG1 4.16Å; F69-V173 HydrophobicContact CZ-CG1 4.08Å; L73-V173 HydrophobicContact CD1-CB 4.45Å; L73-V173 HydrophobicContact CD1-CG1 4.23Å; L73-V173 HydrophobicContact CD2-CG1 4.08Å; F110-V173 HydrophobicContact CD2-CG2 3.95Å; F110-V173 HydrophobicContact CE2-CG2 3.61Å; V173-L175 HydrophobicContact CG2-CD1 4.43Å; V173-L175 HydrophobicContact CG2-CG 4.02Å; V173-I216 WeakPolarHBondContact O-CA 3.46Å; V173-G217 PolarHBondContact N-O 2.9Å; V173-G217 PolarHBondContact O-N 3.49Å; V173-F219 HydrophobicContact CB-CB 4.28Å; V173-F219 HydrophobicContact CG1-CB 3.84Å; V173-F219 HydrophobicContact CG1-CG 4.38Å; V173-F219 HydrophobicContact CG2-CB 3.43Å; V173-F219 VanDerWaalsContact CG2-CB 3.43Å; V173-F219 HydrophobicContact CG2-CD2 3.97Å; V173-F219 HydrophobicContact CG2-CG 4.02Å
174	R	94.7	Very high	94.3	Very high	64 Å²	64	31.8 Å²	31.8	24%	0.242	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	124.7	168.4	-74.5	177.9	-76.3	-109.1	-0.2	108.7	Y56 S57 P58 V60 P214 K215 I216	Y56-R174 HydrophobicContact CE2-CB 4.04Å; Y56-R174 PolarHBondContact OH-O 2.95Å; S57-R174 PolarHBondContact O-NE 2.92Å; S57-R174 PolarHBondContact O-NH2 2.8Å; P58-R174 PolarHBondContact O-N 3.47Å; V60-R174 HydrophobicContact CG2-CG 4.11Å; R174-P214 HydrophobicContact CB-CB 4.22Å; R174-K215 VanDerWaalsContact CA-O 3.31Å; R174-K215 WeakPolarHBondContact CA-O 3.17Å; R174-I216 HydrophobicContact CG-CB 4.35Å
175	L	94.4	Very high	93.7	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	153.9	175.1	-69.5	-177.1	0	0	0	111.1	L73 L77 I80 V99 F110 V173 F180 K215 F219	L73-L175 HydrophobicContact CD1-CD2 4.14Å; L77-L175 HydrophobicContact CD2-CD2 3.71Å; I80-L175 HydrophobicContact CD1-CD2 4.46Å; V99-L175 HydrophobicContact CG2-CD1 4.38Å; F110-L175 HydrophobicContact CB-CD1 4.25Å; F110-L175 HydrophobicContact CD1-CD1 4.12Å; F110-L175 HydrophobicContact CD2-CD1 3.84Å; F110-L175 HydrophobicContact CD2-CG 4.42Å; F110-L175 HydrophobicContact CE1-CB 4.1Å; F110-L175 HydrophobicContact CE1-CD1 4.43Å; F110-L175 HydrophobicContact CE2-CB 4.42Å; F110-L175 HydrophobicContact CE2-CD1 4.18Å; F110-L175 HydrophobicContact CE2-CG 4.27Å; F110-L175 HydrophobicContact CG-CD1 3.81Å; F110-L175 HydrophobicContact CZ-CB 4.05Å; F110-L175 HydrophobicContact CZ-CD1 4.47Å; F110-L175 HydrophobicContact CZ-CG 4.4Å; V173-L175 HydrophobicContact CG2-CD1 4.43Å; V173-L175 HydrophobicContact CG2-CG 4.02Å; L175-F180 HydrophobicContact CB-CE2 3.84Å; L175-F180 HydrophobicContact CB-CZ 4.05Å; L175-K215 PolarHBondContact N-O 3.47Å; L175-K215 PolarHBondContact O-N 2.75Å; L175-F219 HydrophobicContact CD1-CD2 3.84Å; L175-F219 HydrophobicContact CD1-CE2 3.97Å
176	V	93.3	Very high	93.2	Very high	24 Å²	24	32 Å²	32	15%	0.145	18%	0.175	C	C	.	.			trans	-131.6	120.4	178.6	-173.3	0	0	0	0	107.5	I80 L212 P214	I80-V176 VanDerWaalsContact CG2-O 3.23Å; I80-V176 WeakPolarHBondContact CG2-O 3.5Å; V176-L212 HydrophobicContact CG1-CB 3.88Å; V176-L212 WeakPolarHBondContact CG1-O 3.33Å; V176-P214 VanDerWaalsContact CG2-CA 3.42Å; V176-P214 HydrophobicContact CG2-CB 3.53Å
177	S	92.9	Very high	92.7	Very high	4 Å²	4	35.6 Å²	35.6	3%	0.028	19%	0.189	C	C	.	.			trans	-150.9	142.2	174.7	-177.7	0	0	0	0	110.6	P86 S179 F180 Y182	P86-S177 WeakPolarHBondContact CD-OG 3.24Å; S177-S179 PolarHBondContact O-N 3.08Å; S177-S179 PolarHBondContact OG-OG 3.07Å; S177-F180 PolarHBondContact O-N 2.96Å; S177-Y182 VanDerWaalsContact O-CE2 3.32Å; S177-Y182 WeakPolarHBondContact O-CE2 3.41Å
178	E	91.7	Very high	92	Very high	118 Å²	118	37.7 Å²	37.7	55%	0.551	21%	0.206	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-23.3	178.8	-58.1	-161.7	154.2	0	0	113.8	L85 F180 R187 L212	L85-E178 HydrophobicContact CD1-CB 4.23Å; E178-F180 VanDerWaalsContact C-N 3.28Å; E178-F180 PolarHBondContact O-N 3.12Å; E178-R187 PolarHBondContact O-NH1 2.84Å; E178-R187 PolarHBondContact O-NH2 2.86Å; E178-L212 HydrophobicContact CB-CD1 4.43Å; E178-L212 HydrophobicContact CG-CD1 4.13Å
179	S	92	Very high	91.4	Very high	33 Å²	33	43 Å²	43	23%	0.231	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-16.9	179.6	68.5	0	0	0	0	113.8	P86 R88 S177	P86-S179 VanDerWaalsContact O-CB 3.29Å; P86-S179 WeakPolarHBondContact O-CB 3.33Å; P86-S179 PolarHBondContact O-OG 2.8Å; R88-S179 PolarHBondContact NH2-O 3.35Å; S177-S179 PolarHBondContact O-N 3.08Å; S177-S179 PolarHBondContact OG-OG 3.07Å
180	F	93.8	Very high	90.7	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.223	C	C	.	.	S	Bend	trans	-70.4	158.7	176.1	-57.9	-21.6	0	0	0	112.3	P86 Y97 F110 L175 S177 E178 Y182 R187 K215	P86-F180 HydrophobicContact CB-CE1 4.02Å; P86-F180 HydrophobicContact CG-CE1 3.99Å; P86-F180 HydrophobicContact CG-CZ 4.19Å; Y97-F180 AromaticContact CD1-CD1 3.91Å; Y97-F180 HydrophobicContact CD1-CD1 3.91Å; Y97-F180 HydrophobicContact CD1-CE1 4.09Å; Y97-F180 AromaticContact CD2-CD1 3.94Å; Y97-F180 HydrophobicContact CD2-CD1 3.94Å; Y97-F180 AromaticContact CD2-CE1 3.97Å; Y97-F180 HydrophobicContact CD2-CE1 3.97Å; Y97-F180 AromaticContact CE1-CD1 3.79Å; Y97-F180 HydrophobicContact CE1-CD1 3.79Å; Y97-F180 HydrophobicContact CE1-CE1 4.44Å; Y97-F180 AromaticContact CE2-CD1 3.85Å; Y97-F180 HydrophobicContact CE2-CD1 3.85Å; Y97-F180 HydrophobicContact CE2-CE1 4.34Å; Y97-F180 AromaticContact CG-CD1 3.99Å; Y97-F180 HydrophobicContact CG-CD1 3.99Å; Y97-F180 AromaticContact CG-CE1 3.85Å; Y97-F180 HydrophobicContact CG-CE1 3.85Å; Y97-F180 AromaticContact CZ-CD1 3.76Å; Y97-F180 WeakPolarHBondContact OH-CA 3.18Å; F110-F180 AromaticContact CD1-CE1 3.94Å; F110-F180 HydrophobicContact CD1-CE1 3.94Å; F110-F180 HydrophobicContact CD1-CE2 4.11Å; F110-F180 AromaticContact CD1-CZ 3.51Å; F110-F180 HydrophobicContact CD1-CZ 3.51Å; F110-F180 HydrophobicContact CE1-CE1 4.34Å; F110-F180 AromaticContact CE1-CE2 3.76Å; F110-F180 HydrophobicContact CE1-CE2 3.76Å; F110-F180 AromaticContact CE1-CZ 3.66Å; F110-F180 HydrophobicContact CE1-CZ 3.66Å; L175-F180 HydrophobicContact CB-CE2 3.84Å; L175-F180 HydrophobicContact CB-CZ 4.05Å; S177-F180 PolarHBondContact O-N 2.96Å; E178-F180 VanDerWaalsContact C-N 3.28Å; E178-F180 PolarHBondContact O-N 3.12Å; F180-Y182 HydrophobicContact CB-CD2 4.25Å; F180-Y182 HydrophobicContact CB-CE2 3.73Å; F180-Y182 HydrophobicContact CD2-CE2 4.45Å; F180-Y182 PolarHBondContact O-N 3.17Å; F180-R187 PolarHBondContact O-NH2 3.18Å; F180-K215 HydrophobicContact CB-CD 3.94Å; F180-K215 HydrophobicContact CD2-CD 3.95Å; F180-K215 HydrophobicContact CD2-CG 4.48Å; F180-K215 HydrophobicContact CG-CD 4.26Å
181	N	90.8	Very high	89.9	Confident	46 Å²	46	50.3 Å²	50.3	25%	0.246	25%	0.254	C	S	.	.			trans	-84.4	93.9	-179.7	-167.1	21.8	0	0	0	111.7	Y97 E115 L121 K215	Y97-N181 PolarHBondContact OH-N 3.45Å; E115-N181 HydrophobicContact CG-CB 4.21Å; E115-N181 WeakPolarHBondContact OE1-CB 3.5Å; E115-N181 PolarHBondContact OE1-N 3.11Å; L121-N181 WeakPolarHBondContact CD1-O 3.5Å; L121-N181 PolarHBondContact O-ND2 3.45Å; N181-K215 WeakPolarHBondContact O-CE 3.23Å; N181-K215 PolarHBondContact O-NZ 3.09Å
182	Y	89.7	Confident	88.9	Confident	10 Å²	10	53.1 Å²	53.1	4%	0.039	28%	0.275	C	S	.	.			trans	-96.7	153.7	172.8	-68.8	-79.9	0	0	0	112.4	S177 F180 D186 L212 P213 K215	S177-Y182 VanDerWaalsContact O-CE2 3.32Å; S177-Y182 WeakPolarHBondContact O-CE2 3.41Å; F180-Y182 HydrophobicContact CB-CD2 4.25Å; F180-Y182 HydrophobicContact CB-CE2 3.73Å; F180-Y182 HydrophobicContact CD2-CE2 4.45Å; F180-Y182 PolarHBondContact O-N 3.17Å; Y182-D186 HydrophobicContact CD1-CB 4.41Å; Y182-L212 HydrophobicContact CD1-CD2 4.44Å; Y182-L212 HydrophobicContact CD2-CB 4.44Å; Y182-L212 HydrophobicContact CD2-CD1 3.81Å; Y182-L212 HydrophobicContact CD2-CD2 3.96Å; Y182-L212 HydrophobicContact CD2-CG 4.28Å; Y182-L212 HydrophobicContact CE1-CB 4.3Å; Y182-L212 HydrophobicContact CE2-CB 3.97Å; Y182-L212 HydrophobicContact CE2-CD1 3.68Å; Y182-L212 HydrophobicContact CE2-CD2 4.34Å; Y182-L212 HydrophobicContact CE2-CG 4.21Å; Y182-L212 HydrophobicContact CG-CD2 3.99Å; Y182-P213 HydrophobicContact CD1-CG 4Å; Y182-P213 HydrophobicContact CE1-CG 3.8Å; Y182-P213 WeakPolarHBondContact CE1-O 3.32Å; Y182-P213 PolarHBondContact OH-O 3.44Å; Y182-K215 HydrophobicContact CE1-CD 4.08Å; Y182-K215 VanDerWaalsContact CE1-CE 3.49Å; Y182-K215 HydrophobicContact CE1-CG 3.82Å
183	S	88.1	Confident	88.2	Confident	33 Å²	33	56.7 Å²	56.7	23%	0.231	29%	0.291	C	S	.	.			trans	-62.2	155.7	172.6	76.1	0	0	0	0	111.6	V185 D186 R187	S183-V185 PolarHBondContact O-N 2.97Å; S183-D186 PolarHBondContact O-N 2.91Å; S183-D186 PolarHBondContact OG-N 2.92Å; S183-D186 PolarHBondContact OG-OD2 3.09Å; S183-R187 PolarHBondContact O-N 2.83Å; S183-R187 VanDerWaalsContact O-N 3.1Å
184	T	86.7	Confident	87.3	Confident	124 Å²	124	61 Å²	61	76%	0.761	31%	0.311	S	S	*	.	H	α-helix	trans	-58	-34.3	173.8	50.4	0	0	0	0	111.5	A188	T184-A188 WeakPolarHBondContact O-CB 3.43Å; T184-A188 PolarHBondContact O-N 3.44Å
185	V	85.9	Confident	86.2	Confident	78 Å²	78	63.5 Å²	63.5	47%	0.473	33%	0.325	S	S	.	.	H	α-helix	trans	-65.5	-46.5	176.6	179.4	0	0	0	0	111.3	S183 R187 A188 K189	S183-V185 PolarHBondContact O-N 2.97Å; V185-R187 PolarHBondContact O-N 3.19Å; V185-A188 PolarHBondContact O-N 2.88Å; V185-K189 HydrophobicContact CG1-CD 4.07Å; V185-K189 HydrophobicContact CG1-CG 4.4Å; V185-K189 WeakPolarHBondContact O-CB 3.49Å; V185-K189 WeakPolarHBondContact O-CG 3.24Å; V185-K189 PolarHBondContact O-N 3.32Å
186	D	87	Confident	85.1	Confident	44 Å²	44	67.1 Å²	67.1	24%	0.235	34%	0.341	C	S	.	.	H	α-helix	trans	-65.8	-40.3	-179.9	-64.1	-41.6	0	0	0	111.6	Y182 S183 K189 S190 P213	Y182-D186 HydrophobicContact CD1-CB 4.41Å; S183-D186 PolarHBondContact O-N 2.91Å; S183-D186 PolarHBondContact OG-N 2.92Å; S183-D186 PolarHBondContact OG-OD2 3.09Å; D186-K189 PolarHBondContact O-N 3.41Å; D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 2.55Å; D186-P213 HydrophobicContact CB-CG 4.34Å
187	R	88.3	Confident	84.2	Confident	76 Å²	76	66.7 Å²	66.7	29%	0.287	34%	0.34	S	S	.	.	H	α-helix	trans	-65.6	-37.3	174.5	-67.8	-172	178.7	-86	2.9	112.1	E178 F180 S183 V185 S190 R191 L212	E178-R187 PolarHBondContact O-NH1 2.84Å; E178-R187 PolarHBondContact O-NH2 2.86Å; F180-R187 PolarHBondContact O-NH2 3.18Å; S183-R187 PolarHBondContact O-N 2.83Å; S183-R187 VanDerWaalsContact O-N 3.1Å; V185-R187 PolarHBondContact O-N 3.19Å; R187-S190 PolarHBondContact O-OG 3.39Å; R187-R191 VanDerWaalsContact O-CG 3.28Å; R187-R191 WeakPolarHBondContact O-CG 3.13Å; R187-R191 PolarHBondContact O-N 2.82Å; R187-L212 HydrophobicContact CG-CD2 4.2Å
188	A	83.6	Confident	83.5	Confident	50 Å²	50	70.8 Å²	70.8	41%	0.413	37%	0.368	S	S	.	.	H	α-helix	trans	-66.8	-48.2	174.7	0	0	0	0	0	110.9	T184 V185 S190 R191 T192	T184-A188 WeakPolarHBondContact O-CB 3.43Å; T184-A188 PolarHBondContact O-N 3.44Å; V185-A188 PolarHBondContact O-N 2.88Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 2.79Å; A188-R191 PolarHBondContact O-N 3.12Å; A188-T192 PolarHBondContact O-N 3.07Å; A188-T192 PolarHBondContact O-OG1 3.45Å
189	K	83.9	Confident	82.7	Confident	123 Å²	123	73.3 Å²	73.3	54%	0.535	37%	0.373	S	S	.	.	H	α-helix	trans	-57.8	-42.9	177.3	-75.5	177.1	179.4	177.1	0	112.2	V185 D186 T192 K193	V185-K189 HydrophobicContact CG1-CD 4.07Å; V185-K189 HydrophobicContact CG1-CG 4.4Å; V185-K189 WeakPolarHBondContact O-CB 3.49Å; V185-K189 WeakPolarHBondContact O-CG 3.24Å; V185-K189 PolarHBondContact O-N 3.32Å; D186-K189 PolarHBondContact O-N 3.41Å; K189-T192 PolarHBondContact O-N 2.85Å; K189-K193 WeakPolarHBondContact O-CB 3.46Å; K189-K193 WeakPolarHBondContact O-CG 3.43Å; K189-K193 PolarHBondContact O-N 3.23Å
190	S	82.6	Confident	81.8	Confident	12 Å²	12	76.2 Å²	76.2	8%	0.084	38%	0.382	C	S	.	.	H	α-helix	trans	-64.2	-44.1	178.5	71.4	0	0	0	0	111.6	D186 R187 A188 K193 Q194	D186-S190 PolarHBondContact O-N 2.75Å; D186-S190 PolarHBondContact O-OG 2.55Å; R187-S190 PolarHBondContact O-OG 3.39Å; A188-S190 VanDerWaalsContact C-N 3.34Å; A188-S190 PolarHBondContact O-N 2.79Å; S190-K193 PolarHBondContact O-N 3.12Å; S190-Q194 WeakPolarHBondContact O-CB 3.44Å; S190-Q194 VanDerWaalsContact O-CG 3.29Å; S190-Q194 WeakPolarHBondContact O-CG 3.29Å; S190-Q194 PolarHBondContact O-N 2.92Å
191	R	82	Confident	80.6	Confident	173 Å²	173	80.3 Å²	80.3	65%	0.653	41%	0.408	S	S	*	.	H	α-helix	trans	-63	-43.9	175.9	-72	172.7	-179.6	177.2	-0.1	112.1	R187 A188 Q194 H195	R187-R191 VanDerWaalsContact O-CG 3.28Å; R187-R191 WeakPolarHBondContact O-CG 3.13Å; R187-R191 PolarHBondContact O-N 2.82Å; A188-R191 PolarHBondContact O-N 3.12Å; R191-Q194 PolarHBondContact O-N 3.45Å; R191-H195 VanDerWaalsContact O-CB 3.29Å; R191-H195 WeakPolarHBondContact O-CB 3.3Å; R191-H195 PolarHBondContact O-N 3.43Å
192	T	75.3	Confident	79.4	Confident	95 Å²	95	85.9 Å²	85.9	58%	0.583	43%	0.432	S	S	*	.	H	α-helix	trans	-61.6	-44.7	177.1	-57.2	0	0	0	0	111.2	A188 K189 H195 F196	A188-T192 PolarHBondContact O-N 3.07Å; A188-T192 PolarHBondContact O-OG1 3.45Å; K189-T192 PolarHBondContact O-N 2.85Å; T192-H195 PolarHBondContact O-N 3.16Å; T192-F196 VanDerWaalsContact O-CB 3.29Å; T192-F196 WeakPolarHBondContact O-CB 3.44Å; T192-F196 PolarHBondContact O-N 3.46Å
193	K	79.6	Confident	78	Confident	84 Å²	84	89.9 Å²	89.9	37%	0.365	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-44.8	176.4	-75	-179.5	177.7	-174.4	0	112.1	K189 S190 F196 A197 F207	K189-K193 WeakPolarHBondContact O-CB 3.46Å; K189-K193 WeakPolarHBondContact O-CG 3.43Å; K189-K193 PolarHBondContact O-N 3.23Å; S190-K193 PolarHBondContact O-N 3.12Å; K193-F196 PolarHBondContact O-N 3.4Å; K193-A197 VanDerWaalsContact O-CB 3.27Å; K193-A197 WeakPolarHBondContact O-CB 2.77Å; K193-A197 PolarHBondContact O-N 3.42Å; K193-F207 HydrophobicContact CB-CD2 4.42Å; K193-F207 HydrophobicContact CB-CE2 4.44Å; K193-F207 HydrophobicContact CG-CD1 4.41Å; K193-F207 HydrophobicContact CG-CE1 4.42Å; K193-F207 HydrophobicContact CG-CZ 4.48Å
194	Q	78	Confident	76.6	Confident	90 Å²	90	88.5 Å²	88.5	42%	0.421	45%	0.445	S	S	.	.	H	α-helix	trans	-61	-45.8	176.2	-75	171.8	-12.9	0	0	111.7	S190 R191 A197 S198	S190-Q194 WeakPolarHBondContact O-CB 3.44Å; S190-Q194 VanDerWaalsContact O-CG 3.29Å; S190-Q194 WeakPolarHBondContact O-CG 3.29Å; S190-Q194 PolarHBondContact O-N 2.92Å; R191-Q194 PolarHBondContact O-N 3.45Å; Q194-A197 PolarHBondContact O-N 3.38Å; Q194-S198 PolarHBondContact O-N 3.25Å; Q194-S198 PolarHBondContact O-OG 3.22Å
195	H	69.9	Low	75.3	Confident	117 Å²	117	93 Å²	93	54%	0.542	45%	0.448	S	S	.	.	H	α-helix	trans	-68.3	-35.2	179.7	-167.3	-68.9	0	0	0	112.7	R191 T192 S198 R199	R191-H195 VanDerWaalsContact O-CB 3.29Å; R191-H195 WeakPolarHBondContact O-CB 3.3Å; R191-H195 PolarHBondContact O-N 3.43Å; T192-H195 PolarHBondContact O-N 3.16Å; H195-S198 PolarHBondContact O-OG 3.05Å; H195-R199 VanDerWaalsContact O-CB 3.26Å; H195-R199 WeakPolarHBondContact O-CB 3.42Å; H195-R199 PolarHBondContact O-N 3.44Å; H195-R199 VanDerWaalsContact O-N 3.14Å
196	F	72.8	Confident	73.8	Confident	75 Å²	75	96 Å²	96	33%	0.329	46%	0.457	S	S	.	.	H	α-helix	trans	-72.9	-38.6	176.2	-172.1	-84.6	0	0	0	111.3	T192 K193 R199 F200 L203 F207	T192-F196 VanDerWaalsContact O-CB 3.29Å; T192-F196 WeakPolarHBondContact O-CB 3.44Å; T192-F196 PolarHBondContact O-N 3.46Å; K193-F196 PolarHBondContact O-N 3.4Å; F196-R199 PolarHBondContact O-N 3.1Å; F196-F200 HydrophobicContact CD2-CD2 4.15Å; F196-F200 HydrophobicContact CE1-CB 4.44Å; F196-F200 AromaticContact CE2-CD2 3.98Å; F196-F200 HydrophobicContact CE2-CD2 3.98Å; F196-F200 HydrophobicContact CE2-CE2 4.44Å; F196-F200 HydrophobicContact CZ-CD2 4.28Å; F196-F200 PolarHBondContact O-N 3.48Å; F196-L203 HydrophobicContact CD1-CB 4.48Å; F196-L203 HydrophobicContact CE1-CB 3.47Å; F196-L203 VanDerWaalsContact CE1-CB 3.47Å; F196-L203 HydrophobicContact CE1-CD1 4.38Å; F196-L203 HydrophobicContact CE1-CG 4.46Å; F196-L203 HydrophobicContact CZ-CB 4Å; F196-L203 HydrophobicContact CZ-CD1 4.07Å; F196-F207 HydrophobicContact CB-CE2 3.84Å; F196-F207 HydrophobicContact CB-CZ 4.04Å; F196-F207 HydrophobicContact CD1-CD2 4.49Å; F196-F207 AromaticContact CD1-CE2 3.28Å; F196-F207 HydrophobicContact CD1-CE2 3.28Å; F196-F207 AromaticContact CD1-CZ 3.31Å; F196-F207 HydrophobicContact CD1-CZ 3.31Å; F196-F207 HydrophobicContact CE1-CE2 4.1Å; F196-F207 AromaticContact CE1-CZ 3.82Å; F196-F207 HydrophobicContact CE1-CZ 3.82Å; F196-F207 AromaticContact CG-CE2 3.92Å; F196-F207 HydrophobicContact CG-CE2 3.92Å; F196-F207 AromaticContact CG-CZ 3.85Å; F196-F207 HydrophobicContact CG-CZ 3.85Å
197	A	74.4	Confident	72.4	Confident	15 Å²	15	96.8 Å²	96.8	12%	0.124	46%	0.458	C	S	.	.	H	α-helix	trans	-67.7	-36.8	175.8	0	0	0	0	0	113.2	K193 Q194 R199 P201 F207 L210	K193-A197 VanDerWaalsContact O-CB 3.27Å; K193-A197 WeakPolarHBondContact O-CB 2.77Å; K193-A197 PolarHBondContact O-N 3.42Å; Q194-A197 PolarHBondContact O-N 3.38Å; A197-R199 VanDerWaalsContact C-N 3.34Å; A197-P201 WeakPolarHBondContact O-CA 3.18Å; A197-F207 HydrophobicContact CB-CD2 4.27Å; A197-L210 HydrophobicContact CB-CD1 3.85Å; A197-L210 HydrophobicContact CB-CD2 3.33Å; A197-L210 HydrophobicContact CB-CG 4.25Å
198	S	78	Confident	70.8	Confident	91 Å²	91	100.2 Å²	100.2	64%	0.636	48%	0.483	S	S	*	.	H	α-helix	trans	-69.9	-31.3	174	66.1	0	0	0	0	112.6	Q194 H195	Q194-S198 PolarHBondContact O-N 3.25Å; Q194-S198 PolarHBondContact O-OG 3.22Å; H195-S198 PolarHBondContact O-OG 3.05Å
199	R	74.4	Confident	69.7	Low	170 Å²	170	101.9 Å²	101.9	64%	0.642	48%	0.478	S	S	*	.	H	α-helix	trans	-83.9	-36.7	179.9	-170.3	172.8	-177.1	149.7	1.6	113.8	H195 F196 A197	H195-R199 VanDerWaalsContact O-CB 3.26Å; H195-R199 WeakPolarHBondContact O-CB 3.42Å; H195-R199 PolarHBondContact O-N 3.44Å; H195-R199 VanDerWaalsContact O-N 3.14Å; F196-R199 PolarHBondContact O-N 3.1Å; A197-R199 VanDerWaalsContact C-N 3.34Å
200	F	73.7	Confident	68.6	Low	95 Å²	95	100.3 Å²	100.3	42%	0.417	48%	0.475	S	S	.	.			trans	-131.5	80.5	-178.5	-61.3	-74.6	0	0	0	109.8	F196 E202 L203 G204	F196-F200 HydrophobicContact CD2-CD2 4.15Å; F196-F200 HydrophobicContact CE1-CB 4.44Å; F196-F200 AromaticContact CE2-CD2 3.98Å; F196-F200 HydrophobicContact CE2-CD2 3.98Å; F196-F200 HydrophobicContact CE2-CE2 4.44Å; F196-F200 HydrophobicContact CZ-CD2 4.28Å; F196-F200 PolarHBondContact O-N 3.48Å; F200-E202 PolarHBondContact O-N 3.34Å; F200-E202 VanDerWaalsContact O-N 3.15Å; F200-L203 HydrophobicContact CB-CB 4.23Å; F200-L203 HydrophobicContact CB-CD1 4.12Å; F200-L203 HydrophobicContact CG-CD1 4.39Å; F200-L203 PolarHBondContact O-N 2.96Å; F200-L203 VanDerWaalsContact O-N 3.16Å; F200-G204 PolarHBondContact O-N 2.85Å
201	P	69.1	Low	68.4	Low	85 Å²	85	100.6 Å²	100.6	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-56.1	-35.1	-175.8	-25.9	34.2	0	0	0	113.4	A197 G204 R205	A197-P201 WeakPolarHBondContact O-CA 3.18Å; P201-G204 PolarHBondContact O-N 3.44Å; P201-R205 PolarHBondContact O-N 2.94Å
202	E	65.6	Low	68.7	Low	163 Å²	163	92.9 Å²	92.9	76%	0.762	45%	0.452	S	S	*	.	H	α-helix	trans	-67.6	-40.1	-179.5	-59.4	-158.5	164.7	0	0	113.1	F200 H206	F200-E202 PolarHBondContact O-N 3.34Å; F200-E202 VanDerWaalsContact O-N 3.15Å; E202-H206 PolarHBondContact O-CE1 3.29Å; E202-H206 PolarHBondContact O-ND1 2.77Å
203	L	59.6	Low	69.4	Low	94 Å²	94	90.8 Å²	90.8	49%	0.492	44%	0.44	S	S	.	.	H	α-helix	trans	-81	-28.8	174.4	-70.3	149.4	0	0	0	111.4	F196 F200 R205 H206	F196-L203 HydrophobicContact CD1-CB 4.48Å; F196-L203 HydrophobicContact CE1-CB 3.47Å; F196-L203 VanDerWaalsContact CE1-CB 3.47Å; F196-L203 HydrophobicContact CE1-CD1 4.38Å; F196-L203 HydrophobicContact CE1-CG 4.46Å; F196-L203 HydrophobicContact CZ-CB 4Å; F196-L203 HydrophobicContact CZ-CD1 4.07Å; F200-L203 HydrophobicContact CB-CB 4.23Å; F200-L203 HydrophobicContact CB-CD1 4.12Å; F200-L203 HydrophobicContact CG-CD1 4.39Å; F200-L203 PolarHBondContact O-N 2.96Å; F200-L203 VanDerWaalsContact O-N 3.16Å; L203-R205 PolarHBondContact O-N 3.42Å; L203-H206 WeakPolarHBondContact O-CB 3.37Å; L203-H206 PolarHBondContact O-N 2.97Å; L203-H206 PolarHBondContact O-ND1 3.09Å
204	G	57.9	Low	70	Confident	5 Å²	5	89.2 Å²	89.2	5%	0.052	44%	0.438	C	S	.	.	H	α-helix	trans	-61.3	-30	175.6	0	0	0	0	0	113.7	F200 P201 H206 F207	F200-G204 PolarHBondContact O-N 2.85Å; P201-G204 PolarHBondContact O-N 3.44Å; G204-H206 PolarHBondContact O-N 2.97Å; G204-F207 WeakPolarHBondContact O-CB 3.36Å; G204-F207 PolarHBondContact O-N 3.49Å
205	R	58.9	Low	70.7	Confident	217 Å²	217	85.2 Å²	85.2	82%	0.819	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-23.7	172.5	-76.6	177.8	176.3	176.7	-0.6	113.7	P201 L203 F207	P201-R205 PolarHBondContact O-N 2.94Å; L203-R205 PolarHBondContact O-N 3.42Å; R205-F207 VanDerWaalsContact C-N 3.28Å
206	H	55.2	Low	71.9	Confident	143 Å²	143	81.7 Å²	81.7	66%	0.662	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.2	-8.1	177.1	-60.3	80	0	0	0	112.5	E202 L203 G204 N208	E202-H206 PolarHBondContact O-CE1 3.29Å; E202-H206 PolarHBondContact O-ND1 2.77Å; L203-H206 WeakPolarHBondContact O-CB 3.37Å; L203-H206 PolarHBondContact O-N 2.97Å; L203-H206 PolarHBondContact O-ND1 3.09Å; G204-H206 PolarHBondContact O-N 2.97Å; H206-N208 PolarHBondContact O-N 3.18Å; H206-N208 PolarHBondContact O-OD1 3.36Å
207	F	58.4	Low	73	Confident	59 Å²	59	78.1 Å²	78.1	26%	0.259	39%	0.388	S	S	.	.			trans	-78.4	109.1	169.9	-62.5	-45.6	0	0	0	109.4	K193 F196 A197 G204 R205 R209 L210	K193-F207 HydrophobicContact CB-CD2 4.42Å; K193-F207 HydrophobicContact CB-CE2 4.44Å; K193-F207 HydrophobicContact CG-CD1 4.41Å; K193-F207 HydrophobicContact CG-CE1 4.42Å; K193-F207 HydrophobicContact CG-CZ 4.48Å; F196-F207 HydrophobicContact CB-CE2 3.84Å; F196-F207 HydrophobicContact CB-CZ 4.04Å; F196-F207 HydrophobicContact CD1-CD2 4.49Å; F196-F207 AromaticContact CD1-CE2 3.28Å; F196-F207 HydrophobicContact CD1-CE2 3.28Å; F196-F207 AromaticContact CD1-CZ 3.31Å; F196-F207 HydrophobicContact CD1-CZ 3.31Å; F196-F207 HydrophobicContact CE1-CE2 4.1Å; F196-F207 AromaticContact CE1-CZ 3.82Å; F196-F207 HydrophobicContact CE1-CZ 3.82Å; F196-F207 AromaticContact CG-CE2 3.92Å; F196-F207 HydrophobicContact CG-CE2 3.92Å; F196-F207 AromaticContact CG-CZ 3.85Å; F196-F207 HydrophobicContact CG-CZ 3.85Å; A197-F207 HydrophobicContact CB-CD2 4.27Å; G204-F207 WeakPolarHBondContact O-CB 3.36Å; G204-F207 PolarHBondContact O-N 3.49Å; R205-F207 VanDerWaalsContact C-N 3.28Å; F207-R209 PolarHBondContact O-N 3.06Å; F207-L210 HydrophobicContact CB-CD2 3.77Å; F207-L210 HydrophobicContact CD2-CD2 3.62Å; F207-L210 HydrophobicContact CG-CD2 4.17Å
208	N	53.3	Low	74.1	Confident	149 Å²	149	77.5 Å²	77.5	80%	0.797	38%	0.383	S	S	*	.	S	Bend	trans	-56.5	-14.9	178.1	-59	-12.2	0	0	0	113.7	H206	H206-N208 PolarHBondContact O-N 3.18Å; H206-N208 PolarHBondContact O-OD1 3.36Å
209	R	61.8	Low	75	Confident	84 Å²	84	73.1 Å²	73.1	32%	0.317	35%	0.353	S	S	.	.			trans	-160.9	125.2	171.9	-168.2	177.6	173.9	119.2	25.4	111.9	F207 G211 L212	F207-R209 PolarHBondContact O-N 3.06Å; R209-G211 PolarHBondContact O-N 2.94Å; R209-L212 PolarHBondContact NE-O 3.39Å; R209-L212 VanDerWaalsContact NE-O 3.16Å
210	L	60.1	Low	76.1	Confident	90 Å²	90	65.7 Å²	65.7	47%	0.471	33%	0.325	S	S	.	.	S	Bend	trans	-92.3	69.5	173.2	-61.3	175.3	0	0	0	110.2	A197 F207	A197-L210 HydrophobicContact CB-CD1 3.85Å; A197-L210 HydrophobicContact CB-CD2 3.33Å; A197-L210 HydrophobicContact CB-CG 4.25Å; F207-L210 HydrophobicContact CB-CD2 3.77Å; F207-L210 HydrophobicContact CD2-CD2 3.62Å; F207-L210 HydrophobicContact CG-CD2 4.17Å
211	G	79.6	Confident	77.3	Confident	18 Å²	18	63 Å²	63	19%	0.186	32%	0.315	C	S	.	.	S	Bend	trans	178.6	-174.5	180	0	0	0	0	0	115.2	R209	R209-G211 PolarHBondContact O-N 2.94Å
212	L	87.5	Confident	78.6	Confident	11 Å²	11	62.4 Å²	62.4	6%	0.058	30%	0.304	C	S	.	.	P	Polyproline II helix	trans	-64.6	148.7	173.6	-68.7	163.8	0	0	0	110.6	V176 E178 Y182 R187 R209	V176-L212 HydrophobicContact CG1-CB 3.88Å; V176-L212 WeakPolarHBondContact CG1-O 3.33Å; E178-L212 HydrophobicContact CB-CD1 4.43Å; E178-L212 HydrophobicContact CG-CD1 4.13Å; Y182-L212 HydrophobicContact CD1-CD2 4.44Å; Y182-L212 HydrophobicContact CD2-CB 4.44Å; Y182-L212 HydrophobicContact CD2-CD1 3.81Å; Y182-L212 HydrophobicContact CD2-CD2 3.96Å; Y182-L212 HydrophobicContact CD2-CG 4.28Å; Y182-L212 HydrophobicContact CE1-CB 4.3Å; Y182-L212 HydrophobicContact CE2-CB 3.97Å; Y182-L212 HydrophobicContact CE2-CD1 3.68Å; Y182-L212 HydrophobicContact CE2-CD2 4.34Å; Y182-L212 HydrophobicContact CE2-CG 4.21Å; Y182-L212 HydrophobicContact CG-CD2 3.99Å; R187-L212 HydrophobicContact CG-CD2 4.2Å; R209-L212 PolarHBondContact NE-O 3.39Å; R209-L212 VanDerWaalsContact NE-O 3.16Å
213	P	89.5	Confident	80	Confident	51 Å²	51	56 Å²	56	33%	0.331	28%	0.276	S	S	.	.	P	Polyproline II helix	trans	-67.4	144.9	178	27.2	-31.9	0	0	0	110.6	Y182 D186	Y182-P213 HydrophobicContact CD1-CG 4Å; Y182-P213 HydrophobicContact CE1-CG 3.8Å; Y182-P213 WeakPolarHBondContact CE1-O 3.32Å; Y182-P213 PolarHBondContact OH-O 3.44Å; D186-P213 HydrophobicContact CB-CG 4.34Å
214	P	91.9	Very high	81.6	Confident	51 Å²	51	55.3 Å²	55.3	33%	0.331	28%	0.279	S	S	.	.	P	Polyproline II helix	trans	-70.4	137.8	178.3	28.8	-33.3	0	0	0	112.7	Y56 R174 V176	Y56-P214 HydrophobicContact CD2-CB 4.45Å; Y56-P214 HydrophobicContact CD2-CG 4.43Å; Y56-P214 HydrophobicContact CE2-CB 3.73Å; Y56-P214 HydrophobicContact CE2-CG 4.19Å; R174-P214 HydrophobicContact CB-CB 4.22Å; V176-P214 VanDerWaalsContact CG2-CA 3.42Å; V176-P214 HydrophobicContact CG2-CB 3.53Å
215	K	94.1	Very high	83.2	Confident	7 Å²	7	58.4 Å²	58.4	3%	0.03	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	128.2	174.1	-70.4	-172.4	169.1	-139	0	110.2	F110 P112 D114 E115 R174 L175 F180 N181 Y182	F110-K215 WeakPolarHBondContact CZ-O 3.46Å; P112-K215 HydrophobicContact CB-CB 4.07Å; P112-K215 HydrophobicContact CB-CD 3.99Å; P112-K215 HydrophobicContact CG-CD 4.47Å; D114-K215 WeakPolarHBondContact OD1-CD 3.45Å; D114-K215 IonicContact OD1-NZ 3.07Å; D114-K215 PolarHBondContact OD1-NZ 3.41Å; D114-K215 WeakPolarHBondContact OD2-CE 3.42Å; D114-K215 IonicContact OD2-NZ 2.64Å; D114-K215 PolarHBondContact OD2-NZ 3.42Å; E115-K215 IonicContact OE1-NZ 3.57Å; E115-K215 PolarHBondContact OE1-NZ 3.18Å; R174-K215 VanDerWaalsContact CA-O 3.31Å; R174-K215 WeakPolarHBondContact CA-O 3.17Å; L175-K215 PolarHBondContact N-O 3.47Å; L175-K215 PolarHBondContact O-N 2.75Å; F180-K215 HydrophobicContact CB-CD 3.94Å; F180-K215 HydrophobicContact CD2-CD 3.95Å; F180-K215 HydrophobicContact CD2-CG 4.48Å; F180-K215 HydrophobicContact CG-CD 4.26Å; N181-K215 WeakPolarHBondContact O-CE 3.23Å; N181-K215 PolarHBondContact O-NZ 3.09Å; Y182-K215 HydrophobicContact CE1-CD 4.08Å; Y182-K215 VanDerWaalsContact CE1-CE 3.49Å; Y182-K215 HydrophobicContact CE1-CG 3.82Å
216	I	94.9	Very high	84.9	Confident	42 Å²	42	49.3 Å²	49.3	22%	0.215	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	140.8	169.3	-167.3	169.8	0	0	0	110	V60 P112 K113 Y149 V172 V173 R174 I369	V60-I216 HydrophobicContact CG2-CD1 4.24Å; V60-I216 HydrophobicContact CG2-CG1 4.42Å; P112-I216 WeakPolarHBondContact CA-O 3.43Å; K113-I216 HydrophobicContact CB-CG2 3.97Å; K113-I216 HydrophobicContact CD-CG2 4.07Å; K113-I216 PolarHBondContact N-O 2.83Å; Y149-I216 HydrophobicContact CE2-CD1 4.13Å; Y149-I216 HydrophobicContact CE2-CG1 4.13Å; V172-I216 HydrophobicContact CG1-CD1 3.76Å; V172-I216 HydrophobicContact CG1-CG1 3.61Å; V173-I216 WeakPolarHBondContact O-CA 3.46Å; R174-I216 HydrophobicContact CG-CB 4.35Å; I216-I369 HydrophobicContact CD1-CG2 4.13Å
217	G	95.3	Very high	86.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	176.9	178.7	0	0	0	0	0	113	K111 V172 V173	K111-G217 WeakPolarHBondContact O-CA 3.04Å; V172-G217 WeakPolarHBondContact CA-O 3.47Å; V173-G217 PolarHBondContact N-O 2.9Å; V173-G217 PolarHBondContact O-N 3.49Å
218	S	96.8	Very high	88.5	Confident	2 Å²	2	49.9 Å²	49.9	1%	0.014	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	134.7	174.7	59.1	0	0	0	0	109.5	F110 K111 R171	F110-S218 WeakPolarHBondContact CA-O 3.48Å; F110-S218 WeakPolarHBondContact CD2-O 3.42Å; K111-S218 PolarHBondContact N-O 3.42Å; K111-S218 PolarHBondContact O-N 3.14Å; K111-S218 VanDerWaalsContact O-N 3.09Å; R171-S218 WeakPolarHBondContact O-CA 3.41Å
219	F	97.4	Very high	90.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	108.1	175.3	-173.8	-81.2	0	0	0	108.6	F69 V72 L73 A76 V99 A108 F110 T170 R171 V173 L175 L221	F69-F219 AromaticContact CE2-CD1 3.7Å; F69-F219 HydrophobicContact CE2-CD1 3.7Å; F69-F219 HydrophobicContact CE2-CE1 4.3Å; F69-F219 HydrophobicContact CZ-CB 4.33Å; F69-F219 AromaticContact CZ-CD1 3.57Å; F69-F219 HydrophobicContact CZ-CD1 3.57Å; F69-F219 HydrophobicContact CZ-CE1 4.26Å; F69-F219 HydrophobicContact CZ-CG 4.3Å; V72-F219 HydrophobicContact CG1-CE1 4.15Å; V72-F219 HydrophobicContact CG1-CZ 4.33Å; L73-F219 HydrophobicContact CD1-CD2 4.5Å; L73-F219 HydrophobicContact CD1-CE2 4.22Å; L73-F219 HydrophobicContact CD1-CZ 4.31Å; A76-F219 HydrophobicContact CB-CE2 4.14Å; A76-F219 HydrophobicContact CB-CZ 4.04Å; V99-F219 HydrophobicContact CB-CE2 4.3Å; V99-F219 HydrophobicContact CG1-CE2 4.11Å; V99-F219 HydrophobicContact CG2-CE2 4.09Å; A108-F219 HydrophobicContact CB-CD1 3.82Å; A108-F219 HydrophobicContact CB-CD2 4.12Å; A108-F219 HydrophobicContact CB-CE1 3.29Å; A108-F219 HydrophobicContact CB-CE2 3.63Å; A108-F219 HydrophobicContact CB-CG 4.22Å; A108-F219 HydrophobicContact CB-CZ 3.19Å; F110-F219 HydrophobicContact CB-CD2 4.46Å; F110-F219 HydrophobicContact CD2-CB 4.26Å; F110-F219 HydrophobicContact CD2-CD2 4.24Å; T170-F219 VanDerWaalsContact CA-O 3.31Å; T170-F219 WeakPolarHBondContact CA-O 3.38Å; R171-F219 PolarHBondContact N-O 2.98Å; R171-F219 PolarHBondContact O-N 3.1Å; V173-F219 HydrophobicContact CB-CB 4.28Å; V173-F219 HydrophobicContact CG1-CB 3.84Å; V173-F219 HydrophobicContact CG1-CG 4.38Å; V173-F219 HydrophobicContact CG2-CB 3.43Å; V173-F219 VanDerWaalsContact CG2-CB 3.43Å; V173-F219 HydrophobicContact CG2-CD2 3.97Å; V173-F219 HydrophobicContact CG2-CG 4.02Å; L175-F219 HydrophobicContact CD1-CD2 3.84Å; L175-F219 HydrophobicContact CD1-CE2 3.97Å; F219-L221 HydrophobicContact CE1-CD2 4.3Å
220	Q	97.9	Very high	92	Very high	14 Å²	14	41.3 Å²	41.3	7%	0.065	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	130.1	-177.3	175.8	166.4	90.7	0	0	109.3	A108 V109 P168 T170	A108-Q220 CarbonylContact C-O 3.47Å; A108-Q220 WeakPolarHBondContact CA-O 3.47Å; A108-Q220 VanDerWaalsContact CB-O 3.25Å; A108-Q220 WeakPolarHBondContact CB-O 3.33Å; V109-Q220 PolarHBondContact N-O 2.67Å; V109-Q220 PolarHBondContact O-N 3.33Å; P168-Q220 HydrophobicContact CB-CG 3.96Å; T170-Q220 HydrophobicContact CG2-CB 3.97Å; T170-Q220 VanDerWaalsContact OG1-CB 3.3Å; T170-Q220 WeakPolarHBondContact OG1-CB 3.35Å; T170-Q220 VanDerWaalsContact OG1-CG 3.24Å; T170-Q220 WeakPolarHBondContact OG1-CG 3.27Å; T170-Q220 PolarHBondContact OG1-NE2 2.81Å
221	L	97.7	Very high	93.7	Very high	38 Å²	38	40.8 Å²	40.8	20%	0.199	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-59	138.4	175.4	-62.4	-174.3	0	0	0	111.1	F69 V72 P168 T169 F219	F69-L221 HydrophobicContact CD2-CD1 4.46Å; F69-L221 HydrophobicContact CD2-CD2 3.92Å; F69-L221 HydrophobicContact CD2-CG 4.12Å; F69-L221 HydrophobicContact CE2-CD2 4.23Å; V72-L221 HydrophobicContact CB-CD2 3.9Å; V72-L221 HydrophobicContact CG1-CD2 3.69Å; V72-L221 HydrophobicContact CG2-CD2 4.1Å; P168-L221 HydrophobicContact CB-CB 4.48Å; P168-L221 VanDerWaalsContact CB-O 3.3Å; P168-L221 WeakPolarHBondContact CB-O 3.28Å; T169-L221 PolarHBondContact O-N 2.8Å; F219-L221 HydrophobicContact CE1-CD2 4.3Å
222	F	96.8	Very high	94.4	Very high	72 Å²	72	41.9 Å²	41.9	32%	0.316	23%	0.232	S	C	.	.			trans	-82.8	131.6	179.3	-176.7	-94.7	0	0	0	110.4	F98 K106 I107 V109	F98-F222 HydrophobicContact CD1-CD2 4.19Å; F98-F222 HydrophobicContact CD1-CE2 4.13Å; F98-F222 HydrophobicContact CE1-CD2 4.06Å; F98-F222 AromaticContact CE1-CE2 3.69Å; F98-F222 HydrophobicContact CE1-CE2 3.69Å; K106-F222 HydrophobicContact CB-CD1 3.92Å; K106-F222 HydrophobicContact CB-CD2 4.21Å; K106-F222 HydrophobicContact CB-CE1 4.01Å; K106-F222 HydrophobicContact CB-CE2 4.3Å; K106-F222 HydrophobicContact CB-CG 4.03Å; K106-F222 HydrophobicContact CB-CZ 4.21Å; K106-F222 HydrophobicContact CD-CE2 4.13Å; K106-F222 HydrophobicContact CD-CZ 4.06Å; K106-F222 VanDerWaalsContact O-CD1 3.3Å; K106-F222 WeakPolarHBondContact O-CD1 3.44Å; I107-F222 WeakPolarHBondContact O-CB 3.16Å; I107-F222 PolarHBondContact O-N 2.67Å; V109-F222 HydrophobicContact CG2-CD2 4.34Å
223	V	95	Very high	94.7	Very high	30 Å²	30	42.3 Å²	42.3	18%	0.182	23%	0.234	C	C	.	.			trans	-104.7	120.3	175.7	-68	0	0	0	0	110.3	P168 L274 F305	P168-V223 HydrophobicContact CB-CG1 4.07Å; P168-V223 HydrophobicContact CG-CG1 3.79Å; P168-V223 HydrophobicContact CG-CG2 4.29Å; V223-L274 HydrophobicContact CG2-CD1 4.25Å; V223-F305 HydrophobicContact CB-CD1 4.39Å; V223-F305 HydrophobicContact CB-CE1 4.45Å; V223-F305 HydrophobicContact CB-CG 4.42Å; V223-F305 HydrophobicContact CG1-CD1 3.82Å; V223-F305 HydrophobicContact CG1-CE1 3.82Å; V223-F305 HydrophobicContact CG1-CG 4.32Å; V223-F305 HydrophobicContact CG1-CZ 4.35Å; V223-F305 HydrophobicContact CG2-CB 4.22Å; V223-F305 HydrophobicContact CG2-CD1 4.31Å; V223-F305 HydrophobicContact CG2-CD2 4.22Å; V223-F305 HydrophobicContact CG2-CG 3.97Å
224	S	93.3	Very high	94.9	Very high	79 Å²	79	46.5 Å²	46.5	55%	0.552	24%	0.244	S	C	*	.	S	Bend	trans	-85.8	158.3	-179.5	61	0	0	0	0	112.1	C226	S224-C226 VanDerWaalsContact C-N 3.27Å; S224-C226 PolarHBondContact O-N 2.96Å; S224-C226 PolarHBondContact O-SG 2.84Å; S224-C226 VanDerWaalsContact O-SG 3.39Å
225	G	92.7	Very high	94.9	Very high	69 Å²	69	47.8 Å²	47.8	71%	0.711	25%	0.245	S	C	*	.	S	Bend	trans	71.9	14.6	175.3	0	0	0	0	0	115.5
226	C	94.2	Very high	94.7	Very high	27 Å²	27	48.8 Å²	48.8	18%	0.182	25%	0.249	C	C	.	.			trans	-98.1	153.1	-177.8	-57	0	0	0	0	111.6	S224 L274 F305	S224-C226 VanDerWaalsContact C-N 3.27Å; S224-C226 PolarHBondContact O-N 2.96Å; S224-C226 PolarHBondContact O-SG 2.84Å; S224-C226 VanDerWaalsContact O-SG 3.39Å; C226-L274 HydrophobicContact CB-CB 3.82Å; C226-L274 HydrophobicContact CB-CD1 3.8Å; C226-L274 HydrophobicContact CB-CG 4.44Å; C226-F305 VanDerWaalsContact SG-CD2 3.55Å
227	R	94.1	Very high	94.4	Very high	131 Å²	131	52.9 Å²	52.9	49%	0.494	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	159.3	168.8	-63.8	-170.2	178.7	-148.3	3	110.7	Y231 L274 I275	R227-Y231 HydrophobicContact CB-CD1 4.17Å; R227-Y231 HydrophobicContact CB-CG 4.45Å; R227-Y231 VanDerWaalsContact NH1-CE2 3.25Å; R227-Y231 PolarHBondContact NH1-OH 3.3Å; R227-L274 CarbonylContact O-C 3.56Å; R227-L274 VanDerWaalsContact O-CA 3.29Å; R227-L274 WeakPolarHBondContact O-CA 3.36Å; R227-I275 PolarHBondContact N-O 2.9Å; R227-I275 PolarHBondContact O-N 3.41Å
228	D	93.8	Very high	94.2	Very high	82 Å²	82	59.9 Å²	59.9	44%	0.439	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-50.4	138.6	175.8	-54.4	2.4	0	0	0	110.8	D230 Y231	D228-D230 PolarHBondContact O-N 2.67Å; D228-Y231 VanDerWaalsContact O-CB 3.26Å; D228-Y231 WeakPolarHBondContact O-CB 3.45Å; D228-Y231 PolarHBondContact O-N 3.48Å
229	A	95.7	Very high	93.8	Very high	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-60.9	-36.4	-179.3	0	0	0	0	0	112.5	Y231 W232 L233 N270 W273 I275	A229-Y231 PolarHBondContact O-N 2.62Å; A229-W232 PolarHBondContact O-N 3.03Å; A229-L233 HydrophobicContact CB-CD1 4.39Å; A229-L233 WeakPolarHBondContact O-CB 3.42Å; A229-L233 WeakPolarHBondContact O-CG 3.47Å; A229-L233 PolarHBondContact O-N 2.77Å; A229-N270 WeakPolarHBondContact CB-O 3.4Å; A229-N270 PolarHBondContact N-O 3.43Å; A229-W273 HydrophobicContact CB-CD2 3.28Å; A229-W273 HydrophobicContact CB-CE3 3.25Å; A229-W273 HydrophobicContact CB-CG 4.05Å; A229-W273 HydrophobicContact CB-CH2 3.45Å; A229-W273 VanDerWaalsContact CB-CH2 3.45Å; A229-W273 HydrophobicContact CB-CZ2 3.43Å; A229-W273 VanDerWaalsContact CB-CZ2 3.43Å; A229-W273 HydrophobicContact CB-CZ3 3.36Å; A229-W273 VanDerWaalsContact CB-O 3.29Å; A229-W273 WeakPolarHBondContact CB-O 3.45Å; A229-W273 PolarHBondContact N-O 3.31Å; A229-I275 HydrophobicContact CB-CD1 3.84Å; A229-I275 HydrophobicContact CB-CG1 4.13Å
230	D	94	Very high	93.3	Very high	53 Å²	53	72.2 Å²	72.2	28%	0.283	38%	0.378	S	S	.	.	H	α-helix	trans	-53.9	-33.4	172.4	-178.7	56.4	0	0	0	113.3	D228 R234 N270	D228-D230 PolarHBondContact O-N 2.67Å; D230-R234 VanDerWaalsContact CG-CZ 3.42Å; D230-R234 WeakPolarHBondContact O-CG 3.47Å; D230-R234 PolarHBondContact O-N 3.24Å; D230-R234 IonicContact OD1-CZ 3.08Å; D230-R234 VanDerWaalsContact OD1-CZ 3.3Å; D230-R234 IonicContact OD1-NE 2.69Å; D230-R234 IonicContact OD1-NH1 3.9Å; D230-R234 IonicContact OD1-NH2 2.7Å; D230-R234 PolarHBondContact OD1-NH2 2.93Å; D230-R234 IonicContact OD2-CZ 2.89Å; D230-R234 IonicContact OD2-NH1 2.77Å; D230-R234 PolarHBondContact OD2-NH1 3.02Å; D230-R234 IonicContact OD2-NH2 3.96Å; D230-R234 PolarHBondContact OD2-NH2 3.07Å; D230-N270 HydrophobicContact CB-CB 4Å; D230-N270 PolarHBondContact N-O 2.86Å
231	Y	94.7	Very high	93	Very high	79 Å²	79	72.9 Å²	72.9	31%	0.31	38%	0.382	S	S	.	.	H	α-helix	trans	-64.5	-54	172.9	174.9	-87.4	0	0	0	110.7	R227 D228 A229 R234 H235	R227-Y231 HydrophobicContact CB-CD1 4.17Å; R227-Y231 HydrophobicContact CB-CG 4.45Å; R227-Y231 VanDerWaalsContact NH1-CE2 3.25Å; R227-Y231 PolarHBondContact NH1-OH 3.3Å; D228-Y231 VanDerWaalsContact O-CB 3.26Å; D228-Y231 WeakPolarHBondContact O-CB 3.45Å; D228-Y231 PolarHBondContact O-N 3.48Å; A229-Y231 PolarHBondContact O-N 2.62Å; Y231-R234 PolarHBondContact O-N 3.39Å; Y231-H235 AromaticContact CD1-CE1 3.86Å; Y231-H235 AromaticContact CD1-ND1 3.85Å; Y231-H235 AromaticContact CD2-CE1 3.85Å; Y231-H235 AromaticContact CE1-CE1 3.36Å; Y231-H235 WeakPolarHBondContact CE1-CE1 3.36Å; Y231-H235 AromaticContact CE1-ND1 3.66Å; Y231-H235 AromaticContact CE1-NE2 3.84Å; Y231-H235 AromaticContact CE2-CE1 3.38Å; Y231-H235 WeakPolarHBondContact CE2-CE1 3.23Å; Y231-H235 AromaticContact CZ-CE1 3.09Å; Y231-H235 AromaticContact CZ-ND1 3.88Å; Y231-H235 AromaticContact CZ-NE2 3.46Å; Y231-H235 PolarHBondContact O-N 2.94Å; Y231-H235 PolarHBondContact O-ND1 2.88Å; Y231-H235 PolarHBondContact OH-CE1 3.49Å; Y231-H235 PolarHBondContact OH-NE2 3.14Å
232	W	94.7	Very high	92.6	Very high	41 Å²	41	74 Å²	74	16%	0.155	39%	0.391	C	S	.	.	H	α-helix	trans	-70.6	-38.2	-174.7	-79.4	110.8	0	0	0	113.3	A229 R234 H235 F236 I275 Y277	A229-W232 PolarHBondContact O-N 3.03Å; W232-R234 VanDerWaalsContact C-N 3.29Å; W232-R234 PolarHBondContact O-N 3.37Å; W232-H235 HydrophobicContact CE3-CB 4.33Å; W232-H235 WeakPolarHBondContact O-CA 3.45Å; W232-H235 WeakPolarHBondContact O-CB 3.29Å; W232-H235 PolarHBondContact O-N 3.26Å; W232-F236 HydrophobicContact CB-CD2 4.48Å; W232-F236 HydrophobicContact CB-CE2 3.85Å; W232-F236 HydrophobicContact CB-CZ 3.96Å; W232-F236 HydrophobicContact CD2-CZ 4.19Å; W232-F236 AromaticContact CE3-CE1 3.71Å; W232-F236 HydrophobicContact CE3-CE1 3.71Å; W232-F236 AromaticContact CE3-CZ 3.76Å; W232-F236 HydrophobicContact CE3-CZ 3.76Å; W232-F236 HydrophobicContact CG-CZ 4.33Å; W232-F236 HydrophobicContact CZ3-CE1 4.33Å; W232-F236 WeakPolarHBondContact O-CD2 3.49Å; W232-F236 VanDerWaalsContact O-CG 3.25Å; W232-F236 WeakPolarHBondContact O-CG 3.46Å; W232-F236 PolarHBondContact O-N 3.48Å; W232-I275 HydrophobicContact CB-CB 4.26Å; W232-I275 HydrophobicContact CB-CD1 3.87Å; W232-I275 HydrophobicContact CB-CG2 4.31Å; W232-I275 HydrophobicContact CG-CB 4.02Å; W232-I275 HydrophobicContact CG-CG2 3.95Å; W232-I275 PolarHBondContact NE1-O 3.36Å; W232-I275 VanDerWaalsContact NE1-O 3.11Å; W232-Y277 HydrophobicContact CE3-CD1 4.12Å; W232-Y277 AromaticContact CH2-CD1 3.58Å; W232-Y277 HydrophobicContact CH2-CD1 3.58Å; W232-Y277 HydrophobicContact CH2-CG 4.2Å; W232-Y277 HydrophobicContact CZ2-CD1 4.36Å; W232-Y277 AromaticContact CZ3-CD1 3.44Å; W232-Y277 HydrophobicContact CZ3-CD1 3.44Å; W232-Y277 VanDerWaalsContact CZ3-CD1 3.44Å; W232-Y277 HydrophobicContact CZ3-CE1 4.31Å; W232-Y277 HydrophobicContact CZ3-CG 4.18Å
233	L	93.8	Very high	92.3	Very high	20 Å²	20	79.1 Å²	79.1	11%	0.105	41%	0.414	C	S	.	.	H	α-helix	trans	-57.1	-43.2	176.2	-70	169.4	0	0	0	111.4	A229 H235 F236 D237 F249 W273 L331 M333	A229-L233 HydrophobicContact CB-CD1 4.39Å; A229-L233 WeakPolarHBondContact O-CB 3.42Å; A229-L233 WeakPolarHBondContact O-CG 3.47Å; A229-L233 PolarHBondContact O-N 2.77Å; L233-H235 VanDerWaalsContact C-N 3.28Å; L233-H235 PolarHBondContact O-N 3.39Å; L233-F236 PolarHBondContact O-N 3Å; L233-D237 PolarHBondContact O-N 3.46Å; L233-F249 HydrophobicContact CD2-CE1 4.18Å; L233-F249 HydrophobicContact CD2-CZ 4.09Å; L233-W273 HydrophobicContact CD1-CH2 3.9Å; L233-W273 HydrophobicContact CD1-CZ2 3.87Å; L233-W273 HydrophobicContact CD2-CH2 4.41Å; L233-W273 HydrophobicContact CG-CH2 4.4Å; L233-L331 HydrophobicContact CD1-CD1 3.96Å; L233-L331 HydrophobicContact CD1-CD2 3.8Å; L233-M333 HydrophobicContact CD2-CE 3.59Å
234	R	93.2	Very high	92.1	Very high	140 Å²	140	81.4 Å²	81.4	53%	0.528	43%	0.429	S	S	.	.	H	α-helix	trans	-64.5	-29.9	173.6	-70.2	-176	-169.5	115.1	5.5	113.6	D230 Y231 W232 N238	D230-R234 VanDerWaalsContact CG-CZ 3.42Å; D230-R234 WeakPolarHBondContact O-CG 3.47Å; D230-R234 PolarHBondContact O-N 3.24Å; D230-R234 IonicContact OD1-CZ 3.08Å; D230-R234 VanDerWaalsContact OD1-CZ 3.3Å; D230-R234 IonicContact OD1-NE 2.69Å; D230-R234 IonicContact OD1-NH1 3.9Å; D230-R234 IonicContact OD1-NH2 2.7Å; D230-R234 PolarHBondContact OD1-NH2 2.93Å; D230-R234 IonicContact OD2-CZ 2.89Å; D230-R234 IonicContact OD2-NH1 2.77Å; D230-R234 PolarHBondContact OD2-NH1 3.02Å; D230-R234 IonicContact OD2-NH2 3.96Å; D230-R234 PolarHBondContact OD2-NH2 3.07Å; Y231-R234 PolarHBondContact O-N 3.39Å; W232-R234 VanDerWaalsContact C-N 3.29Å; W232-R234 PolarHBondContact O-N 3.37Å; R234-N238 PolarHBondContact O-ND2 3Å
235	H	91.9	Very high	92.1	Very high	77 Å²	77	77.9 Å²	77.9	36%	0.356	40%	0.404	S	S	.	.	H	α-helix	trans	-71.7	-43.7	174.4	-73.4	69.3	0	0	0	110.2	Y231 W232 L233 D237 N238 E239	Y231-H235 AromaticContact CD1-CE1 3.86Å; Y231-H235 AromaticContact CD1-ND1 3.85Å; Y231-H235 AromaticContact CD2-CE1 3.85Å; Y231-H235 AromaticContact CE1-CE1 3.36Å; Y231-H235 WeakPolarHBondContact CE1-CE1 3.36Å; Y231-H235 AromaticContact CE1-ND1 3.66Å; Y231-H235 AromaticContact CE1-NE2 3.84Å; Y231-H235 AromaticContact CE2-CE1 3.38Å; Y231-H235 WeakPolarHBondContact CE2-CE1 3.23Å; Y231-H235 AromaticContact CZ-CE1 3.09Å; Y231-H235 AromaticContact CZ-ND1 3.88Å; Y231-H235 AromaticContact CZ-NE2 3.46Å; Y231-H235 PolarHBondContact O-N 2.94Å; Y231-H235 PolarHBondContact O-ND1 2.88Å; Y231-H235 PolarHBondContact OH-CE1 3.49Å; Y231-H235 PolarHBondContact OH-NE2 3.14Å; W232-H235 HydrophobicContact CE3-CB 4.33Å; W232-H235 WeakPolarHBondContact O-CA 3.45Å; W232-H235 WeakPolarHBondContact O-CB 3.29Å; W232-H235 PolarHBondContact O-N 3.26Å; L233-H235 VanDerWaalsContact C-N 3.28Å; L233-H235 PolarHBondContact O-N 3.39Å; H235-D237 VanDerWaalsContact C-N 3.28Å; H235-D237 PolarHBondContact O-N 3.17Å; H235-N238 PolarHBondContact O-N 2.64Å; H235-E239 PolarHBondContact O-N 2.99Å
236	F	91.8	Very high	92.1	Very high	28 Å²	28	76.5 Å²	76.5	12%	0.123	39%	0.386	C	S	.	.	H	α-helix	trans	-67.8	-25.2	-179.4	-56	-28.7	0	0	0	113.9	W232 L233 N238 E239 L241 F249 Y277 I302	W232-F236 HydrophobicContact CB-CD2 4.48Å; W232-F236 HydrophobicContact CB-CE2 3.85Å; W232-F236 HydrophobicContact CB-CZ 3.96Å; W232-F236 HydrophobicContact CD2-CZ 4.19Å; W232-F236 AromaticContact CE3-CE1 3.71Å; W232-F236 HydrophobicContact CE3-CE1 3.71Å; W232-F236 AromaticContact CE3-CZ 3.76Å; W232-F236 HydrophobicContact CE3-CZ 3.76Å; W232-F236 HydrophobicContact CG-CZ 4.33Å; W232-F236 HydrophobicContact CZ3-CE1 4.33Å; W232-F236 WeakPolarHBondContact O-CD2 3.49Å; W232-F236 VanDerWaalsContact O-CG 3.25Å; W232-F236 WeakPolarHBondContact O-CG 3.46Å; W232-F236 PolarHBondContact O-N 3.48Å; L233-F236 PolarHBondContact O-N 3Å; F236-N238 VanDerWaalsContact C-N 3.25Å; F236-N238 PolarHBondContact O-N 2.81Å; F236-E239 WeakPolarHBondContact CA-O 3.45Å; F236-E239 CarbonylContact O-C 3.57Å; F236-L241 HydrophobicContact CD1-CD1 4.17Å; F236-L241 HydrophobicContact CD1-CD2 3.77Å; F236-L241 HydrophobicContact CD1-CG 3.71Å; F236-L241 HydrophobicContact CD2-CD1 3.98Å; F236-L241 HydrophobicContact CD2-CG 4.39Å; F236-L241 HydrophobicContact CE1-CD1 4.1Å; F236-L241 HydrophobicContact CE1-CD2 3.41Å; F236-L241 VanDerWaalsContact CE1-CD2 3.41Å; F236-L241 HydrophobicContact CE1-CG 3.81Å; F236-L241 HydrophobicContact CE2-CD1 3.88Å; F236-L241 HydrophobicContact CE2-CG 4.45Å; F236-L241 HydrophobicContact CG-CD1 4.14Å; F236-L241 HydrophobicContact CG-CG 4.04Å; F236-L241 HydrophobicContact CZ-CD1 3.95Å; F236-L241 HydrophobicContact CZ-CD2 3.89Å; F236-L241 HydrophobicContact CZ-CG 4.18Å; F236-F249 HydrophobicContact CD2-CE1 4.14Å; F236-F249 HydrophobicContact CE2-CE1 4.16Å; F236-F249 HydrophobicContact CE2-CZ 4.34Å; F236-Y277 HydrophobicContact CE1-CD1 4.44Å; F236-Y277 HydrophobicContact CZ-CG 4.5Å; F236-I302 HydrophobicContact CE2-CD1 3.98Å; F236-I302 HydrophobicContact CZ-CD1 3.82Å
237	D	88.5	Confident	92.1	Very high	128 Å²	128	79 Å²	79	68%	0.684	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.8	-29.3	169.5	-74.9	-21.5	0	0	0	112.5	L233 H235	L233-D237 PolarHBondContact O-N 3.46Å; H235-D237 VanDerWaalsContact C-N 3.28Å; H235-D237 PolarHBondContact O-N 3.17Å
238	N	89.4	Confident	92.1	Very high	147 Å²	147	76.6 Å²	76.6	79%	0.786	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-39.1	179.2	-66.6	-56.5	0	0	0	112.5	R234 H235 F236	R234-N238 PolarHBondContact O-ND2 3Å; H235-N238 PolarHBondContact O-N 2.64Å; F236-N238 VanDerWaalsContact C-N 3.25Å; F236-N238 PolarHBondContact O-N 2.81Å
239	E	88.5	Confident	92.2	Very high	155 Å²	155	73 Å²	73	72%	0.724	38%	0.379	S	S	*	.	S	Bend	trans	-127.3	104	-179.1	-174.8	177.1	-176.1	0	0	109.7	H235 F236 L241	H235-E239 PolarHBondContact O-N 2.99Å; F236-E239 WeakPolarHBondContact CA-O 3.45Å; F236-E239 CarbonylContact O-C 3.57Å; E239-L241 PolarHBondContact O-N 2.87Å
240	S	88.5	Confident	92.3	Very high	107 Å²	107	76 Å²	76	75%	0.748	39%	0.39	S	S	*	.	P	Polyproline II helix	trans	-66	133.7	-177.8	-56.6	0	0	0	0	111.5
241	L	89.9	Confident	92.4	Very high	27 Å²	27	75.7 Å²	75.7	14%	0.141	39%	0.386	C	S	.	.	P	Polyproline II helix	trans	-58.8	146	174.6	-72.4	172.8	0	0	0	111.6	F236 E239 T245 A246 F249 Y277 I302	F236-L241 HydrophobicContact CD1-CD1 4.17Å; F236-L241 HydrophobicContact CD1-CD2 3.77Å; F236-L241 HydrophobicContact CD1-CG 3.71Å; F236-L241 HydrophobicContact CD2-CD1 3.98Å; F236-L241 HydrophobicContact CD2-CG 4.39Å; F236-L241 HydrophobicContact CE1-CD1 4.1Å; F236-L241 HydrophobicContact CE1-CD2 3.41Å; F236-L241 VanDerWaalsContact CE1-CD2 3.41Å; F236-L241 HydrophobicContact CE1-CG 3.81Å; F236-L241 HydrophobicContact CE2-CD1 3.88Å; F236-L241 HydrophobicContact CE2-CG 4.45Å; F236-L241 HydrophobicContact CG-CD1 4.14Å; F236-L241 HydrophobicContact CG-CG 4.04Å; F236-L241 HydrophobicContact CZ-CD1 3.95Å; F236-L241 HydrophobicContact CZ-CD2 3.89Å; F236-L241 HydrophobicContact CZ-CG 4.18Å; E239-L241 PolarHBondContact O-N 2.87Å; L241-T245 HydrophobicContact CD1-CG2 4.46Å; L241-T245 HydrophobicContact CD2-CG2 4.06Å; L241-A246 HydrophobicContact CB-CB 4.07Å; L241-F249 HydrophobicContact CD1-CB 4.26Å; L241-F249 HydrophobicContact CD1-CD1 4.11Å; L241-F249 HydrophobicContact CD1-CG 4.38Å; L241-Y277 HydrophobicContact CD2-CD2 4.41Å; L241-Y277 HydrophobicContact CD2-CE1 4.34Å; L241-Y277 HydrophobicContact CD2-CE2 3.77Å; L241-I302 HydrophobicContact CD1-CD1 4.01Å
242	P	90.1	Very high	92.6	Very high	61 Å²	61	72.9 Å²	72.9	40%	0.396	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-53.1	141.7	166.8	-24.5	34.2	0	0	0	110.8	P244 T245 A246 P300	P242-P244 VanDerWaalsContact C-CD 3.44Å; P242-T245 WeakPolarHBondContact O-CB 3.49Å; P242-T245 PolarHBondContact O-N 3.35Å; P242-A246 PolarHBondContact O-N 2.73Å; P242-P300 HydrophobicContact CG-CG 4.39Å
243	K	90.5	Very high	92.7	Very high	180 Å²	180	71 Å²	71	78%	0.783	37%	0.369	S	S	*	.	H	α-helix	trans	-49.4	-45.3	-174.6	-66.2	-176.6	179.2	-179.4	0	114.4	T245 A246 S247	K243-T245 VanDerWaalsContact C-N 3.35Å; K243-T245 PolarHBondContact O-N 3.28Å; K243-A246 PolarHBondContact O-N 2.92Å; K243-S247 PolarHBondContact O-N 3.36Å; K243-S247 VanDerWaalsContact O-N 3.08Å; K243-S247 PolarHBondContact O-OG 2.66Å
244	P	91.4	Very high	92.9	Very high	78 Å²	78	70.2 Å²	70.2	51%	0.506	37%	0.365	S	S	.	.	H	α-helix	trans	-61.9	-42.4	179	-22.5	35	0	0	0	112.6	P242 S247 E248 M299	P242-P244 VanDerWaalsContact C-CD 3.44Å; P244-S247 PolarHBondContact O-N 2.87Å; P244-E248 PolarHBondContact O-N 2.82Å; P244-E248 VanDerWaalsContact O-N 3.08Å; P244-M299 HydrophobicContact CB-CE 4.01Å; P244-M299 HydrophobicContact CG-CE 4.04Å
245	T	92.5	Very high	93.2	Very high	5 Å²	5	64.6 Å²	64.6	3%	0.031	34%	0.344	C	S	.	.	H	α-helix	trans	-69.4	-36.6	178.6	-50.2	0	0	0	0	112	L241 P242 K243 S247 E248 F249 Y277 P300 I302	L241-T245 HydrophobicContact CD1-CG2 4.46Å; L241-T245 HydrophobicContact CD2-CG2 4.06Å; P242-T245 WeakPolarHBondContact O-CB 3.49Å; P242-T245 PolarHBondContact O-N 3.35Å; K243-T245 VanDerWaalsContact C-N 3.35Å; K243-T245 PolarHBondContact O-N 3.28Å; T245-S247 VanDerWaalsContact C-N 3.33Å; T245-E248 PolarHBondContact O-N 2.77Å; T245-F249 WeakPolarHBondContact O-CB 3.47Å; T245-F249 PolarHBondContact O-N 2.83Å; T245-Y277 HydrophobicContact CG2-CD2 4.45Å; T245-Y277 HydrophobicContact CG2-CE2 3.82Å; T245-P300 WeakPolarHBondContact OG1-CG 3.31Å; T245-P300 PolarHBondContact OG1-O 3.45Å; T245-I302 HydrophobicContact CG2-CB 4.03Å; T245-I302 HydrophobicContact CG2-CG2 3.73Å
246	A	93.3	Very high	93.5	Very high	40 Å²	40	61 Å²	61	33%	0.331	33%	0.327	S	S	.	.	H	α-helix	trans	-62.7	-40.7	174.3	0	0	0	0	0	111.5	L241 P242 K243 F249 R250	L241-A246 HydrophobicContact CB-CB 4.07Å; P242-A246 PolarHBondContact O-N 2.73Å; K243-A246 PolarHBondContact O-N 2.92Å; A246-F249 PolarHBondContact O-N 3.17Å; A246-R250 WeakPolarHBondContact O-CB 3.43Å; A246-R250 PolarHBondContact O-N 3.35Å
247	S	93.9	Very high	93.8	Very high	81 Å²	81	59.6 Å²	59.6	57%	0.566	32%	0.322	S	S	*	.	H	α-helix	trans	-64.2	-44	174.4	-62.7	0	0	0	0	112.4	K243 P244 T245 R250 F251	K243-S247 PolarHBondContact O-N 3.36Å; K243-S247 VanDerWaalsContact O-N 3.08Å; K243-S247 PolarHBondContact O-OG 2.66Å; P244-S247 PolarHBondContact O-N 2.87Å; T245-S247 VanDerWaalsContact C-N 3.33Å; S247-R250 PolarHBondContact O-N 2.94Å; S247-F251 PolarHBondContact O-N 3.06Å
248	E	94.7	Very high	94.3	Very high	79 Å²	79	53.5 Å²	53.5	37%	0.369	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-44.8	175.3	-179.1	57.3	-147	0	0	111.2	P244 T245 R250 F251 Q252 I302	P244-E248 PolarHBondContact O-N 2.82Å; P244-E248 VanDerWaalsContact O-N 3.08Å; T245-E248 PolarHBondContact O-N 2.77Å; E248-R250 VanDerWaalsContact C-N 3.32Å; E248-R250 PolarHBondContact O-N 3.34Å; E248-F251 WeakPolarHBondContact O-CB 3.49Å; E248-F251 PolarHBondContact O-N 2.89Å; E248-F251 VanDerWaalsContact O-N 3.15Å; E248-Q252 WeakPolarHBondContact O-CG 3.15Å; E248-Q252 PolarHBondContact O-N 2.87Å; E248-Q252 PolarHBondContact OE1-NE2 3.18Å; E248-I302 HydrophobicContact CB-CG2 4.05Å; E248-I302 HydrophobicContact CG-CG2 3.89Å
249	F	95.7	Very high	94.8	Very high	6 Å²	6	46.5 Å²	46.5	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-60.3	-42.3	177.5	-177.4	-131.6	0	0	0	112.2	L233 F236 L241 T245 A246 Q252 F253 W273 I275 I302 M333	L233-F249 HydrophobicContact CD2-CE1 4.18Å; L233-F249 HydrophobicContact CD2-CZ 4.09Å; F236-F249 HydrophobicContact CD2-CE1 4.14Å; F236-F249 HydrophobicContact CE2-CE1 4.16Å; F236-F249 HydrophobicContact CE2-CZ 4.34Å; L241-F249 HydrophobicContact CD1-CB 4.26Å; L241-F249 HydrophobicContact CD1-CD1 4.11Å; L241-F249 HydrophobicContact CD1-CG 4.38Å; T245-F249 WeakPolarHBondContact O-CB 3.47Å; T245-F249 PolarHBondContact O-N 2.83Å; A246-F249 PolarHBondContact O-N 3.17Å; F249-Q252 PolarHBondContact O-N 3.29Å; F249-F253 WeakPolarHBondContact O-CB 3.49Å; F249-F253 PolarHBondContact O-N 3.43Å; F249-W273 HydrophobicContact CE2-CZ3 4.31Å; F249-W273 HydrophobicContact CZ-CH2 4.45Å; F249-W273 HydrophobicContact CZ-CZ3 4.29Å; F249-I275 HydrophobicContact CE2-CD1 3.42Å; F249-I275 VanDerWaalsContact CE2-CD1 3.42Å; F249-I275 HydrophobicContact CE2-CG1 3.97Å; F249-I275 HydrophobicContact CZ-CD1 3.52Å; F249-I302 HydrophobicContact CB-CD1 3.9Å; F249-I302 HydrophobicContact CB-CG1 4.4Å; F249-I302 HydrophobicContact CB-CG2 3.99Å; F249-I302 HydrophobicContact CD2-CD1 3.62Å; F249-I302 HydrophobicContact CD2-CG1 3.98Å; F249-I302 HydrophobicContact CE2-CD1 4.32Å; F249-I302 HydrophobicContact CG-CD1 3.76Å; F249-I302 HydrophobicContact CG-CG1 4.45Å; F249-M333 HydrophobicContact CD1-CE 4.34Å; F249-M333 HydrophobicContact CD1-SD 3.74Å; F249-M333 HydrophobicContact CE1-CE 3.49Å; F249-M333 VanDerWaalsContact CE1-CE 3.49Å; F249-M333 HydrophobicContact CE1-SD 3.5Å; F249-M333 WeakPolarHBondContact CE1-SD 3.44Å; F249-M333 HydrophobicContact CZ-CE 4.07Å; F249-M333 HydrophobicContact CZ-SD 4.43Å
250	R	96.2	Very high	95.2	Very high	65 Å²	65	39.1 Å²	39.1	25%	0.245	22%	0.217	C	C	.	.	H	α-helix	trans	-61.3	-43.8	174.7	176.3	173	163.7	-168.7	-10.9	111.5	A246 S247 E248 Q252 F253 E254 E336 P337	A246-R250 WeakPolarHBondContact O-CB 3.43Å; A246-R250 PolarHBondContact O-N 3.35Å; S247-R250 PolarHBondContact O-N 2.94Å; E248-R250 VanDerWaalsContact C-N 3.32Å; E248-R250 PolarHBondContact O-N 3.34Å; R250-Q252 VanDerWaalsContact C-N 3.35Å; R250-Q252 PolarHBondContact O-N 2.84Å; R250-F253 WeakPolarHBondContact O-CB 3.46Å; R250-F253 PolarHBondContact O-N 3.13Å; R250-E254 HydrophobicContact CG-CG 4.41Å; R250-E254 IonicContact CZ-OE1 3.26Å; R250-E254 IonicContact NE-OE1 3.5Å; R250-E254 PolarHBondContact NE-OE1 3.22Å; R250-E254 VanDerWaalsContact NE-OE1 3.16Å; R250-E254 IonicContact NH2-OE1 2.67Å; R250-E254 WeakPolarHBondContact O-CG 3.02Å; R250-E254 PolarHBondContact O-N 2.65Å; R250-E336 WeakPolarHBondContact CD-OE2 3.34Å; R250-E336 IonicContact CZ-OE2 3.69Å; R250-E336 VanDerWaalsContact CZ-OE2 3.26Å; R250-E336 IonicContact NE-OE2 3.67Å; R250-E336 IonicContact NH1-OE2 3.83Å; R250-E336 PolarHBondContact NH1-OE2 3.34Å; R250-P337 PolarHBondContact NH2-O 3.17Å
251	F	97.3	Very high	95.7	Very high	45 Å²	45	34.4 Å²	34.4	20%	0.197	18%	0.183	C	C	.	.	H	α-helix	trans	-61.3	-43.1	177.3	-178.5	-123.6	0	0	0	111.9	S247 E248 F253 E254 K255 A341 I342	S247-F251 PolarHBondContact O-N 3.06Å; E248-F251 WeakPolarHBondContact O-CB 3.49Å; E248-F251 PolarHBondContact O-N 2.89Å; E248-F251 VanDerWaalsContact O-N 3.15Å; F251-F253 PolarHBondContact O-N 3.42Å; F251-E254 PolarHBondContact O-N 2.87Å; F251-K255 WeakPolarHBondContact O-CG 3.29Å; F251-K255 PolarHBondContact O-N 2.98Å; F251-A341 HydrophobicContact CD2-CB 3.85Å; F251-A341 HydrophobicContact CE2-CB 3.82Å; F251-I342 HydrophobicContact CD2-CB 4.38Å; F251-I342 HydrophobicContact CE2-CB 4.27Å; F251-I342 HydrophobicContact CE2-CD1 4.27Å
252	Q	97.7	Very high	96.1	Very high	21 Å²	21	33.4 Å²	33.4	10%	0.098	18%	0.177	C	C	.	.	H	α-helix	trans	-63.4	-39.4	174.2	-64.9	-70	-25.2	0	0	112.5	E248 F249 R250 K255 L256 L304	E248-Q252 WeakPolarHBondContact O-CG 3.15Å; E248-Q252 PolarHBondContact O-N 2.87Å; E248-Q252 PolarHBondContact OE1-NE2 3.18Å; F249-Q252 PolarHBondContact O-N 3.29Å; R250-Q252 VanDerWaalsContact C-N 3.35Å; R250-Q252 PolarHBondContact O-N 2.84Å; Q252-K255 WeakPolarHBondContact O-CB 3.34Å; Q252-K255 PolarHBondContact O-N 3.41Å; Q252-L256 PolarHBondContact O-N 3.37Å; Q252-L304 HydrophobicContact CB-CB 3.84Å
253	F	98.1	Very high	96.5	Very high	1 Å²	1	30.6 Å²	30.6	0%	0.004	16%	0.159	C	C	.	.	H	α-helix	trans	-63.2	-43.1	174.4	173.9	-99.9	0	0	0	112.3	F249 R250 F251 K255 L256 V257 W273 W328 L331 M333 A334 P402	F249-F253 WeakPolarHBondContact O-CB 3.49Å; F249-F253 PolarHBondContact O-N 3.43Å; R250-F253 WeakPolarHBondContact O-CB 3.46Å; R250-F253 PolarHBondContact O-N 3.13Å; F251-F253 PolarHBondContact O-N 3.42Å; F253-K255 VanDerWaalsContact C-N 3.28Å; F253-K255 PolarHBondContact O-N 3.18Å; F253-L256 WeakPolarHBondContact O-CB 3.04Å; F253-L256 PolarHBondContact O-N 3.29Å; F253-L256 VanDerWaalsContact O-N 3.08Å; F253-V257 HydrophobicContact CD1-CG2 4.21Å; F253-V257 HydrophobicContact CE1-CG2 3.72Å; F253-V257 HydrophobicContact CE2-CG2 4.42Å; F253-V257 HydrophobicContact CZ-CG2 3.84Å; F253-V257 WeakPolarHBondContact O-CG2 3.4Å; F253-V257 PolarHBondContact O-N 2.96Å; F253-W273 HydrophobicContact CD2-CH2 4.4Å; F253-W328 HydrophobicContact CE2-CB 3.69Å; F253-W328 HydrophobicContact CE2-CG 4.37Å; F253-W328 HydrophobicContact CZ-CB 4Å; F253-W328 HydrophobicContact CZ-CE3 4.34Å; F253-L331 HydrophobicContact CE2-CD1 3.89Å; F253-L331 HydrophobicContact CZ-CD1 4.46Å; F253-M333 HydrophobicContact CD1-CB 4.23Å; F253-M333 HydrophobicContact CE1-CB 4.19Å; F253-A334 HydrophobicContact CE1-CB 4.32Å; F253-A334 HydrophobicContact CZ-CB 4.13Å; F253-P402 HydrophobicContact CE1-CG 4.43Å
254	E	98.4	Very high	96.8	Very high	3 Å²	3	23 Å²	23	1%	0.014	13%	0.126	C	C	.	.	H	α-helix	trans	-63.4	-34.7	177.9	-71.3	170.7	161.4	0	0	111.8	R250 F251 V257 V258 F338 S339 I342	R250-E254 HydrophobicContact CG-CG 4.41Å; R250-E254 IonicContact CZ-OE1 3.26Å; R250-E254 IonicContact NE-OE1 3.5Å; R250-E254 PolarHBondContact NE-OE1 3.22Å; R250-E254 VanDerWaalsContact NE-OE1 3.16Å; R250-E254 IonicContact NH2-OE1 2.67Å; R250-E254 WeakPolarHBondContact O-CG 3.02Å; R250-E254 PolarHBondContact O-N 2.65Å; F251-E254 PolarHBondContact O-N 2.87Å; E254-V257 WeakPolarHBondContact O-CB 3.46Å; E254-V257 PolarHBondContact O-N 2.72Å; E254-V258 WeakPolarHBondContact O-CG2 3.46Å; E254-V258 PolarHBondContact O-N 2.96Å; E254-F338 HydrophobicContact CB-CD1 4.4Å; E254-F338 HydrophobicContact CG-CD1 4.11Å; E254-S339 PolarHBondContact OE1-N 2.94Å; E254-S339 VanDerWaalsContact OE2-CB 3.25Å; E254-S339 WeakPolarHBondContact OE2-CB 3.29Å; E254-S339 PolarHBondContact OE2-OG 3.24Å; E254-I342 HydrophobicContact CB-CB 4.04Å; E254-I342 HydrophobicContact CB-CD1 4.39Å; E254-I342 HydrophobicContact CB-CG1 3.97Å; E254-I342 HydrophobicContact CB-CG2 4.08Å; E254-I342 HydrophobicContact CG-CG2 4.36Å; E254-I342 VanDerWaalsContact OE2-CG2 3.26Å; E254-I342 WeakPolarHBondContact OE2-CG2 3.46Å
255	K	98.6	Very high	97	Very high	23 Å²	23	19.3 Å²	19.3	10%	0.1	10%	0.102	C	C	.	.	H	α-helix	trans	-61.5	-41.7	170.7	-65.9	171.6	172.4	-172.1	0	112.4	L164 I166 F251 Q252 F253 V257 V258 L259 I342	L164-K255 HydrophobicContact CB-CB 4.33Å; L164-K255 HydrophobicContact CD2-CB 4.14Å; L164-K255 HydrophobicContact CD2-CG 4.07Å; L164-K255 VanDerWaalsContact O-CD 3.31Å; L164-K255 WeakPolarHBondContact O-CD 3.16Å; L164-K255 PolarHBondContact O-NZ 3.1Å; L164-K255 VanDerWaalsContact O-NZ 3.1Å; I166-K255 HydrophobicContact CD1-CB 4.11Å; I166-K255 HydrophobicContact CG2-CB 4.06Å; I166-K255 HydrophobicContact CG2-CD 4.07Å; F251-K255 WeakPolarHBondContact O-CG 3.29Å; F251-K255 PolarHBondContact O-N 2.98Å; Q252-K255 WeakPolarHBondContact O-CB 3.34Å; Q252-K255 PolarHBondContact O-N 3.41Å; F253-K255 VanDerWaalsContact C-N 3.28Å; F253-K255 PolarHBondContact O-N 3.18Å; K255-V257 VanDerWaalsContact C-N 3.33Å; K255-V257 PolarHBondContact O-N 3.03Å; K255-V258 PolarHBondContact O-N 3.43Å; K255-L259 PolarHBondContact O-N 3.42Å; K255-I342 HydrophobicContact CG-CD1 3.88Å
256	L	98.5	Very high	97.1	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-60.4	-44.5	174.8	175.6	68.6	0	0	0	111.1	I166 Q252 F253 L259 D260 W273 L304 A306	I166-L256 HydrophobicContact CD1-CB 4.04Å; I166-L256 HydrophobicContact CD1-CD1 4.39Å; Q252-L256 PolarHBondContact O-N 3.37Å; F253-L256 WeakPolarHBondContact O-CB 3.04Å; F253-L256 PolarHBondContact O-N 3.29Å; F253-L256 VanDerWaalsContact O-N 3.08Å; L256-L259 PolarHBondContact O-N 2.99Å; L256-D260 WeakPolarHBondContact O-CB 3.4Å; L256-D260 PolarHBondContact O-N 3.23Å; L256-W273 HydrophobicContact CD2-CB 4.24Å; L256-W273 HydrophobicContact CD2-CD2 3.61Å; L256-W273 HydrophobicContact CD2-CE3 3.92Å; L256-W273 HydrophobicContact CD2-CG 3.76Å; L256-L304 HydrophobicContact CB-CD1 4.27Å; L256-L304 HydrophobicContact CB-CD2 3.96Å; L256-L304 HydrophobicContact CD1-CD2 4.3Å; L256-L304 HydrophobicContact CD2-CD1 4.22Å; L256-L304 HydrophobicContact CD2-CD2 4.31Å; L256-L304 HydrophobicContact CG-CD2 4.42Å; L256-A306 HydrophobicContact CD1-CB 3.81Å
257	V	98.5	Very high	97.1	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-58.6	-48.7	176.7	170.7	0	0	0	0	110.9	F253 E254 K255 Y261 W328 F338 P402 L405	F253-V257 HydrophobicContact CD1-CG2 4.21Å; F253-V257 HydrophobicContact CE1-CG2 3.72Å; F253-V257 HydrophobicContact CE2-CG2 4.42Å; F253-V257 HydrophobicContact CZ-CG2 3.84Å; F253-V257 WeakPolarHBondContact O-CG2 3.4Å; F253-V257 PolarHBondContact O-N 2.96Å; E254-V257 WeakPolarHBondContact O-CB 3.46Å; E254-V257 PolarHBondContact O-N 2.72Å; K255-V257 VanDerWaalsContact C-N 3.33Å; K255-V257 PolarHBondContact O-N 3.03Å; V257-Y261 WeakPolarHBondContact O-CB 3.45Å; V257-Y261 PolarHBondContact O-N 3.43Å; V257-W328 HydrophobicContact CB-CH2 4.26Å; V257-W328 HydrophobicContact CB-CZ2 4.39Å; V257-W328 HydrophobicContact CB-CZ3 4.45Å; V257-W328 HydrophobicContact CG1-CH2 3.71Å; V257-W328 HydrophobicContact CG1-CZ2 4.24Å; V257-W328 HydrophobicContact CG1-CZ3 4Å; V257-W328 HydrophobicContact CG2-CD2 4.08Å; V257-W328 HydrophobicContact CG2-CE3 3.81Å; V257-W328 HydrophobicContact CG2-CH2 4.1Å; V257-W328 HydrophobicContact CG2-CZ2 4.28Å; V257-W328 HydrophobicContact CG2-CZ3 3.84Å; V257-F338 HydrophobicContact CB-CE1 4.39Å; V257-F338 HydrophobicContact CG1-CE1 3.81Å; V257-F338 HydrophobicContact CG1-CZ 3.74Å; V257-P402 HydrophobicContact CG1-CB 3.88Å; V257-P402 HydrophobicContact CG1-CG 4.17Å; V257-P402 HydrophobicContact CG2-CB 4.05Å; V257-P402 HydrophobicContact CG2-CG 4.16Å; V257-L405 HydrophobicContact CG1-CD2 4.36Å
258	V	98.6	Very high	97.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-57.8	-51	178.3	167.3	0	0	0	0	110.7	L162 L164 E254 K255 L262 I342 V346 L392	L162-V258 HydrophobicContact CD1-CG1 4.34Å; L164-V258 HydrophobicContact CD1-CG1 4.22Å; L164-V258 HydrophobicContact CD2-CG1 4.34Å; E254-V258 WeakPolarHBondContact O-CG2 3.46Å; E254-V258 PolarHBondContact O-N 2.96Å; K255-V258 PolarHBondContact O-N 3.43Å; V258-L262 HydrophobicContact CG1-CD1 3.84Å; V258-L262 WeakPolarHBondContact O-CB 3.32Å; V258-L262 VanDerWaalsContact O-CG 3.26Å; V258-L262 WeakPolarHBondContact O-CG 3.32Å; V258-L262 PolarHBondContact O-N 3.22Å; V258-L262 VanDerWaalsContact O-N 3.1Å; V258-I342 HydrophobicContact CG2-CD1 4.27Å; V258-I342 HydrophobicContact CG2-CG1 4.08Å; V258-V346 HydrophobicContact CG1-CG1 4.37Å; V258-V346 HydrophobicContact CG2-CG2 4.33Å; V258-L392 HydrophobicContact CB-CD2 4.44Å; V258-L392 HydrophobicContact CG1-CD2 4.02Å; V258-L392 HydrophobicContact CG2-CD2 4.32Å
259	L	98.7	Very high	97.1	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.2	-57	179.9	176.9	67.4	0	0	0	111.5	V158 D159 L164 I166 V167 K255 L256 Y261 L262 I263 A306	V158-L259 HydrophobicContact CB-CD1 4.29Å; V158-L259 HydrophobicContact CG1-CD1 4.02Å; D159-L259 HydrophobicContact CB-CD1 4.39Å; L164-L259 HydrophobicContact CD1-CB 3.82Å; L164-L259 HydrophobicContact CD1-CD1 4.45Å; I166-L259 HydrophobicContact CD1-CB 4.21Å; I166-L259 HydrophobicContact CD1-CD2 3.93Å; I166-L259 HydrophobicContact CG1-CD2 4.21Å; V167-L259 HydrophobicContact CG2-CD2 3.29Å; K255-L259 PolarHBondContact O-N 3.42Å; L256-L259 PolarHBondContact O-N 2.99Å; L259-Y261 VanDerWaalsContact C-N 3.28Å; L259-Y261 PolarHBondContact O-N 2.86Å; L259-L262 PolarHBondContact O-N 3.39Å; L259-I263 HydrophobicContact CD1-CD1 4.38Å; L259-I263 HydrophobicContact CD1-CG2 4.22Å; L259-I263 HydrophobicContact CG-CD1 4.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 2.95Å; L259-A306 HydrophobicContact CD2-CB 3.94Å
260	D	98.4	Very high	96.9	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-61.8	-36.6	-174.8	-86.9	-19.3	0	0	0	112.5	L256 R264 N265 R268 F326 W328	L256-D260 WeakPolarHBondContact O-CB 3.4Å; L256-D260 PolarHBondContact O-N 3.23Å; D260-R264 CarbonylContact O-C 3.58Å; D260-R264 WeakPolarHBondContact O-CA 3.45Å; D260-R264 PolarHBondContact O-N 3.38Å; D260-N265 HydrophobicContact CB-CB 4.17Å; D260-N265 PolarHBondContact O-N 3.39Å; D260-N265 VanDerWaalsContact OD1-CB 3.29Å; D260-N265 WeakPolarHBondContact OD1-CB 3.35Å; D260-N265 PolarHBondContact OD1-ND2 3.36Å; D260-R268 VanDerWaalsContact CG-NE 3.34Å; D260-R268 IonicContact OD1-CZ 2.72Å; D260-R268 VanDerWaalsContact OD1-CZ 3.3Å; D260-R268 IonicContact OD1-NE 3.7Å; D260-R268 PolarHBondContact OD1-NE 3Å; D260-R268 IonicContact OD1-NH2 3.81Å; D260-R268 PolarHBondContact OD1-NH2 2.98Å; D260-R268 WeakPolarHBondContact OD2-CB 3.24Å; D260-R268 WeakPolarHBondContact OD2-CG 3.49Å; D260-R268 IonicContact OD2-CZ 2.96Å; D260-R268 IonicContact OD2-NE 3.12Å; D260-R268 PolarHBondContact OD2-NE 2.96Å; D260-R268 IonicContact OD2-NH2 2.65Å; D260-F326 HydrophobicContact CB-CD1 4.18Å; D260-F326 HydrophobicContact CB-CE1 4.06Å; D260-F326 WeakPolarHBondContact O-CE1 3.45Å; D260-W328 HydrophobicContact CB-CZ2 4.15Å; D260-W328 PolarHBondContact OD2-NE1 3.12Å
261	Y	98.4	Very high	96.7	Very high	7 Å²	7	14.8 Å²	14.8	3%	0.027	7%	0.074	C	C	.	.	H	α-helix	trans	-67.9	-46.9	178.6	-165.1	-97.1	0	0	0	111.3	V257 L259 R264 F326 Q388 N391 L392 L405 V406	V257-Y261 WeakPolarHBondContact O-CB 3.45Å; V257-Y261 PolarHBondContact O-N 3.43Å; L259-Y261 VanDerWaalsContact C-N 3.28Å; L259-Y261 PolarHBondContact O-N 2.86Å; Y261-R264 PolarHBondContact O-N 2.93Å; Y261-R264 VanDerWaalsContact O-N 3.14Å; Y261-F326 HydrophobicContact CD2-CE2 4Å; Y261-F326 HydrophobicContact CD2-CZ 4.2Å; Y261-F326 HydrophobicContact CE2-CE2 4.48Å; Y261-Q388 HydrophobicContact CD1-CB 4.01Å; Y261-Q388 HydrophobicContact CE1-CB 4.01Å; Y261-Q388 WeakPolarHBondContact CE1-O 3.5Å; Y261-Q388 VanDerWaalsContact O-CG 3.25Å; Y261-Q388 WeakPolarHBondContact O-CG 3.38Å; Y261-Q388 PolarHBondContact OH-OE1 3.31Å; Y261-N391 HydrophobicContact CE1-CB 3.91Å; Y261-N391 VanDerWaalsContact OH-CB 3.22Å; Y261-N391 WeakPolarHBondContact OH-CB 3.26Å; Y261-N391 PolarHBondContact OH-ND2 2.77Å; Y261-L392 HydrophobicContact CD1-CB 4.02Å; Y261-L392 HydrophobicContact CE1-CB 4.19Å; Y261-L405 HydrophobicContact CD1-CD1 4.23Å; Y261-L405 HydrophobicContact CD1-CD2 4.08Å; Y261-L405 HydrophobicContact CD1-CG 4.39Å; Y261-L405 HydrophobicContact CD2-CD1 4.43Å; Y261-L405 HydrophobicContact CD2-CD2 3.79Å; Y261-L405 HydrophobicContact CD2-CG 3.87Å; Y261-L405 HydrophobicContact CE1-CD1 3.61Å; Y261-L405 HydrophobicContact CE1-CD2 4.28Å; Y261-L405 HydrophobicContact CE1-CG 4.11Å; Y261-L405 HydrophobicContact CE2-CD1 3.85Å; Y261-L405 HydrophobicContact CE2-CD2 4.01Å; Y261-L405 HydrophobicContact CE2-CG 3.55Å; Y261-L405 HydrophobicContact CG-CD2 3.82Å; Y261-L405 HydrophobicContact CG-CG 4.27Å; Y261-L405 WeakPolarHBondContact OH-CD1 3.39Å; Y261-L405 PolarHBondContact OH-O 2.89Å; Y261-V406 HydrophobicContact CD2-CG1 4.47Å; Y261-V406 HydrophobicContact CE2-CG1 4.48Å
262	L	98	Very high	96.5	Very high	6 Å²	6	13.7 Å²	13.7	3%	0.031	7%	0.071	C	C	.	.	H	α-helix	trans	-63.8	-46.8	-179.1	-72.8	175.6	0	0	0	112.9	L162 V258 L259 R264 L350 V389 L392	L162-L262 HydrophobicContact CD1-CD1 3.36Å; V258-L262 HydrophobicContact CG1-CD1 3.84Å; V258-L262 WeakPolarHBondContact O-CB 3.32Å; V258-L262 VanDerWaalsContact O-CG 3.26Å; V258-L262 WeakPolarHBondContact O-CG 3.32Å; V258-L262 PolarHBondContact O-N 3.22Å; V258-L262 VanDerWaalsContact O-N 3.1Å; L259-L262 PolarHBondContact O-N 3.39Å; L262-R264 PolarHBondContact O-N 3.44Å; L262-L350 HydrophobicContact CD1-CD1 4.41Å; L262-L350 HydrophobicContact CD1-CD2 3.84Å; L262-L350 HydrophobicContact CD2-CD2 4.25Å; L262-V389 HydrophobicContact CD2-CB 4.31Å; L262-V389 HydrophobicContact CD2-CG2 3.52Å; L262-L392 HydrophobicContact CD1-CD2 4.15Å; L262-L392 HydrophobicContact CD2-CD2 3.84Å; L262-L392 HydrophobicContact CG-CD2 3.79Å
263	I	98	Very high	96.5	Very high	2 Å²	2	12.7 Å²	12.7	1%	0.01	7%	0.066	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-5.1	177.2	73.3	-177.3	0	0	0	112.3	A155 V158 L259 N265 F313	A155-I263 HydrophobicContact CB-CD1 3.97Å; V158-I263 HydrophobicContact CB-CG2 4.22Å; V158-I263 HydrophobicContact CG1-CG2 4.15Å; V158-I263 HydrophobicContact CG2-CG2 4.06Å; L259-I263 HydrophobicContact CD1-CD1 4.38Å; L259-I263 HydrophobicContact CD1-CG2 4.22Å; L259-I263 HydrophobicContact CG-CD1 4.24Å; L259-I263 WeakPolarHBondContact O-CG1 3.44Å; L259-I263 PolarHBondContact O-N 2.95Å; I263-N265 HydrophobicContact CD1-CB 4.31Å; I263-N265 HydrophobicContact CG1-CB 4.14Å; I263-N265 PolarHBondContact O-N 3.07Å; I263-F313 HydrophobicContact CB-CE1 4.11Å; I263-F313 HydrophobicContact CB-CE2 4.19Å; I263-F313 HydrophobicContact CB-CZ 3.93Å; I263-F313 HydrophobicContact CG2-CE1 3.86Å; I263-F313 HydrophobicContact CG2-CE2 4.18Å; I263-F313 HydrophobicContact CG2-CZ 3.54Å; I263-F313 PolarHBondContact O-N 2.69Å
264	R	97.3	Very high	96.4	Very high	21 Å²	21	13.7 Å²	13.7	8%	0.079	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	43.8	62.3	-170.4	-175.3	47.4	-176	118.4	-1.5	111.7	D260 Y261 L262 T266 P314 A323 Y324 F326 Q388	D260-R264 CarbonylContact O-C 3.58Å; D260-R264 WeakPolarHBondContact O-CA 3.45Å; D260-R264 PolarHBondContact O-N 3.38Å; Y261-R264 PolarHBondContact O-N 2.93Å; Y261-R264 VanDerWaalsContact O-N 3.14Å; L262-R264 PolarHBondContact O-N 3.44Å; R264-T266 WeakPolarHBondContact O-CG2 3.48Å; R264-T266 PolarHBondContact O-N 3.24Å; R264-P314 HydrophobicContact CB-CG 3.85Å; R264-P314 HydrophobicContact CG-CG 3.7Å; R264-A323 PolarHBondContact NH2-O 3.25Å; R264-Y324 PolarHBondContact NH1-O 3.46Å; R264-Y324 PolarHBondContact NH2-O 2.97Å; R264-F326 VanDerWaalsContact CD-CZ 3.5Å; R264-Q388 HydrophobicContact CB-CG 4.41Å
265	N	96.5	Very high	96.4	Very high	1 Å²	1	13.6 Å²	13.6	1%	0.005	7%	0.071	C	C	.	.			trans	-59.2	132.6	177.2	-166.1	-14.5	0	0	0	110.4	D260 I263 D267 R268 L311 F326	D260-N265 HydrophobicContact CB-CB 4.17Å; D260-N265 PolarHBondContact O-N 3.39Å; D260-N265 VanDerWaalsContact OD1-CB 3.29Å; D260-N265 WeakPolarHBondContact OD1-CB 3.35Å; D260-N265 PolarHBondContact OD1-ND2 3.36Å; I263-N265 HydrophobicContact CD1-CB 4.31Å; I263-N265 HydrophobicContact CG1-CB 4.14Å; I263-N265 PolarHBondContact O-N 3.07Å; N265-D267 PolarHBondContact OD1-N 3.43Å; N265-R268 PolarHBondContact ND2-NE 3.32Å; N265-R268 PolarHBondContact ND2-NH2 2.93Å; N265-R268 VanDerWaalsContact ND2-NH2 3.14Å; N265-L311 PolarHBondContact OD1-O 2.88Å; N265-F326 WeakPolarHBondContact O-CE1 3.08Å
266	T	94.1	Very high	96.3	Very high	2 Å²	2	15.1 Å²	15.1	1%	0.012	8%	0.076	C	C	.	.	S	Bend	trans	-105.3	1.6	-175.7	68.6	0	0	0	0	113.3	R140 L143 R264 L311 Y324	R140-T266 WeakPolarHBondContact CD-OG1 3.42Å; R140-T266 PolarHBondContact NE-O 2.95Å; R140-T266 PolarHBondContact NE-OG1 2.78Å; R140-T266 VanDerWaalsContact NE-OG1 3.14Å; R140-T266 PolarHBondContact NH2-O 3.05Å; L143-T266 HydrophobicContact CD2-CG2 4.25Å; R264-T266 WeakPolarHBondContact O-CG2 3.48Å; R264-T266 PolarHBondContact O-N 3.24Å; T266-L311 WeakPolarHBondContact CB-O 3.36Å; T266-L311 PolarHBondContact N-O 2.88Å; T266-L311 PolarHBondContact OG1-O 3.17Å; T266-Y324 HydrophobicContact CG2-CD2 4.4Å
267	D	93.3	Very high	96.1	Very high	47 Å²	47	17.2 Å²	17.2	25%	0.251	8%	0.084	S	C	.	.			trans	-143.5	31.3	-174.8	-145.5	17.2	0	0	0	114.4	R140 N265 G269 N272 L311	R140-D267 IonicContact CZ-OD1 3.83Å; R140-D267 IonicContact CZ-OD2 2.87Å; R140-D267 IonicContact NH1-OD1 3.91Å; R140-D267 IonicContact NH1-OD2 3.03Å; R140-D267 PolarHBondContact NH1-OD2 3.1Å; R140-D267 IonicContact NH2-OD1 2.85Å; R140-D267 PolarHBondContact NH2-OD1 3.13Å; R140-D267 IonicContact NH2-OD2 2.92Å; R140-D267 PolarHBondContact NH2-OD2 2.78Å; N265-D267 PolarHBondContact OD1-N 3.43Å; D267-G269 PolarHBondContact O-N 2.96Å; D267-N272 PolarHBondContact O-ND2 3.27Å; D267-L311 HydrophobicContact CB-CB 4.02Å; D267-L311 HydrophobicContact CB-CD1 3.84Å; D267-L311 WeakPolarHBondContact OD2-CD1 3.35Å
268	R	95	Very high	95.6	Very high	1 Å²	1	22.4 Å²	22.4	0%	0.004	11%	0.108	C	C	.	.			trans	-83	90.9	173.5	-171.4	76.7	64.2	-164.9	-2.8	111.3	D260 N265 N272 I307 N309 Y327	D260-R268 VanDerWaalsContact CG-NE 3.34Å; D260-R268 IonicContact OD1-CZ 2.72Å; D260-R268 VanDerWaalsContact OD1-CZ 3.3Å; D260-R268 IonicContact OD1-NE 3.7Å; D260-R268 PolarHBondContact OD1-NE 3Å; D260-R268 IonicContact OD1-NH2 3.81Å; D260-R268 PolarHBondContact OD1-NH2 2.98Å; D260-R268 WeakPolarHBondContact OD2-CB 3.24Å; D260-R268 WeakPolarHBondContact OD2-CG 3.49Å; D260-R268 IonicContact OD2-CZ 2.96Å; D260-R268 IonicContact OD2-NE 3.12Å; D260-R268 PolarHBondContact OD2-NE 2.96Å; D260-R268 IonicContact OD2-NH2 2.65Å; N265-R268 PolarHBondContact ND2-NE 3.32Å; N265-R268 PolarHBondContact ND2-NH2 2.93Å; N265-R268 VanDerWaalsContact ND2-NH2 3.14Å; R268-N272 PolarHBondContact NH1-O 3.32Å; R268-I307 PolarHBondContact NH1-O 2.98Å; R268-N309 PolarHBondContact NH2-OD1 3.25Å; R268-Y327 VanDerWaalsContact O-CB 3.29Å; R268-Y327 WeakPolarHBondContact O-CB 3.41Å; R268-Y327 VanDerWaalsContact O-CD2 3.25Å; R268-Y327 WeakPolarHBondContact O-CD2 3.33Å; R268-Y327 PolarHBondContact O-N 3.34Å
269	G	93	Very high	94.7	Very high	6 Å²	6	26.1 Å²	26.1	6%	0.062	13%	0.134	C	C	.	.			trans	-82	172.1	160.3	0	0	0	0	0	112.5	D267 D271 N272 W273	D267-G269 PolarHBondContact O-N 2.96Å; G269-D271 WeakPolarHBondContact CA-OD1 3.49Å; G269-D271 PolarHBondContact O-N 3.16Å; G269-N272 PolarHBondContact O-N 3.16Å; G269-W273 PolarHBondContact O-NE1 3.08Å
270	N	93.5	Very high	93.3	Very high	32 Å²	32	28 Å²	28	17%	0.171	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-3.3	175.7	-68.7	-20.3	0	0	0	114.2	A229 D230 W273	A229-N270 WeakPolarHBondContact CB-O 3.4Å; A229-N270 PolarHBondContact N-O 3.43Å; D230-N270 HydrophobicContact CB-CB 4Å; D230-N270 PolarHBondContact N-O 2.86Å; N270-W273 PolarHBondContact OD1-NE1 3.38Å
271	D	91.5	Very high	91.3	Very high	92 Å²	92	36 Å²	36	49%	0.492	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-17	170.7	55.4	-32.4	0	0	0	112.8	G269	G269-D271 WeakPolarHBondContact CA-OD1 3.49Å; G269-D271 PolarHBondContact O-N 3.16Å
272	N	92.5	Very high	89.1	Confident	23 Å²	23	42.5 Å²	42.5	12%	0.123	22%	0.219	C	C	.	.	S	Bend	trans	-99.9	17.6	-175.9	-68.4	-16.4	0	0	0	113.6	D267 R268 G269 I307	D267-N272 PolarHBondContact O-ND2 3.27Å; R268-N272 PolarHBondContact NH1-O 3.32Å; G269-N272 PolarHBondContact O-N 3.16Å; N272-I307 WeakPolarHBondContact O-CG1 3.39Å
273	W	97.3	Very high	86.9	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	143.6	166	53.1	-72	0	0	0	108	A229 L233 F249 F253 L256 G269 N270 I275 L304 F305 L331	A229-W273 HydrophobicContact CB-CD2 3.28Å; A229-W273 HydrophobicContact CB-CE3 3.25Å; A229-W273 HydrophobicContact CB-CG 4.05Å; A229-W273 HydrophobicContact CB-CH2 3.45Å; A229-W273 VanDerWaalsContact CB-CH2 3.45Å; A229-W273 HydrophobicContact CB-CZ2 3.43Å; A229-W273 VanDerWaalsContact CB-CZ2 3.43Å; A229-W273 HydrophobicContact CB-CZ3 3.36Å; A229-W273 VanDerWaalsContact CB-O 3.29Å; A229-W273 WeakPolarHBondContact CB-O 3.45Å; A229-W273 PolarHBondContact N-O 3.31Å; L233-W273 HydrophobicContact CD1-CH2 3.9Å; L233-W273 HydrophobicContact CD1-CZ2 3.87Å; L233-W273 HydrophobicContact CD2-CH2 4.41Å; L233-W273 HydrophobicContact CG-CH2 4.4Å; F249-W273 HydrophobicContact CE2-CZ3 4.31Å; F249-W273 HydrophobicContact CZ-CH2 4.45Å; F249-W273 HydrophobicContact CZ-CZ3 4.29Å; F253-W273 HydrophobicContact CD2-CH2 4.4Å; L256-W273 HydrophobicContact CD2-CB 4.24Å; L256-W273 HydrophobicContact CD2-CD2 3.61Å; L256-W273 HydrophobicContact CD2-CE3 3.92Å; L256-W273 HydrophobicContact CD2-CG 3.76Å; G269-W273 PolarHBondContact O-NE1 3.08Å; N270-W273 PolarHBondContact OD1-NE1 3.38Å; W273-I275 HydrophobicContact CE3-CD1 4.46Å; W273-I275 HydrophobicContact CE3-CG1 4.28Å; W273-I275 HydrophobicContact CH2-CD1 4.41Å; W273-I275 HydrophobicContact CZ3-CD1 3.79Å; W273-I275 HydrophobicContact CZ3-CG1 4.05Å; W273-L304 HydrophobicContact CE3-CD1 3.44Å; W273-L304 VanDerWaalsContact CE3-CD1 3.44Å; W273-L304 HydrophobicContact CE3-CD2 4.41Å; W273-L304 HydrophobicContact CE3-CG 3.8Å; W273-L304 HydrophobicContact CZ3-CD1 3.53Å; W273-L304 HydrophobicContact CZ3-CG 4.3Å; W273-F305 CarbonylContact C-O 3.54Å; W273-F305 VanDerWaalsContact CA-O 3.29Å; W273-F305 WeakPolarHBondContact CA-O 3.22Å; W273-L331 HydrophobicContact CH2-CD1 4.18Å; W273-L331 HydrophobicContact CZ2-CD1 3.86Å
274	L	97.4	Very high	84.8	Confident	22 Å²	22	58.4 Å²	58.4	12%	0.115	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	152.3	-171.1	-48.6	178.1	0	0	0	110.3	V223 C226 R227 L304 F305 I307	V223-L274 HydrophobicContact CG2-CD1 4.25Å; C226-L274 HydrophobicContact CB-CB 3.82Å; C226-L274 HydrophobicContact CB-CD1 3.8Å; C226-L274 HydrophobicContact CB-CG 4.44Å; R227-L274 CarbonylContact O-C 3.56Å; R227-L274 VanDerWaalsContact O-CA 3.29Å; R227-L274 WeakPolarHBondContact O-CA 3.36Å; L274-L304 CarbonylContact O-C 3.54Å; L274-L304 WeakPolarHBondContact O-CA 3.32Å; L274-F305 HydrophobicContact CB-CB 4.32Å; L274-F305 PolarHBondContact N-O 2.9Å; L274-F305 PolarHBondContact O-N 3.48Å; L274-I307 HydrophobicContact CD1-CD1 3.93Å; L274-I307 HydrophobicContact CD1-CG2 4.25Å; L274-I307 HydrophobicContact CD2-CD1 3.86Å; L274-I307 HydrophobicContact CG-CD1 3.78Å; L274-I307 HydrophobicContact CG-CG1 4.17Å; L274-I307 HydrophobicContact CG-CG2 4.47Å
275	I	97.4	Very high	82.5	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	132.9	171.4	-63.7	167.3	0	0	0	108.5	R227 A229 W232 F249 W273 I302 E303	R227-I275 PolarHBondContact N-O 2.9Å; R227-I275 PolarHBondContact O-N 3.41Å; A229-I275 HydrophobicContact CB-CD1 3.84Å; A229-I275 HydrophobicContact CB-CG1 4.13Å; W232-I275 HydrophobicContact CB-CB 4.26Å; W232-I275 HydrophobicContact CB-CD1 3.87Å; W232-I275 HydrophobicContact CB-CG2 4.31Å; W232-I275 HydrophobicContact CG-CB 4.02Å; W232-I275 HydrophobicContact CG-CG2 3.95Å; W232-I275 PolarHBondContact NE1-O 3.36Å; W232-I275 VanDerWaalsContact NE1-O 3.11Å; F249-I275 HydrophobicContact CE2-CD1 3.42Å; F249-I275 VanDerWaalsContact CE2-CD1 3.42Å; F249-I275 HydrophobicContact CE2-CG1 3.97Å; F249-I275 HydrophobicContact CZ-CD1 3.52Å; W273-I275 HydrophobicContact CE3-CD1 4.46Å; W273-I275 HydrophobicContact CE3-CG1 4.28Å; W273-I275 HydrophobicContact CH2-CD1 4.41Å; W273-I275 HydrophobicContact CZ3-CD1 3.79Å; W273-I275 HydrophobicContact CZ3-CG1 4.05Å; I275-I302 HydrophobicContact CG2-CD1 4Å; I275-I302 HydrophobicContact CG2-CG1 3.91Å; I275-E303 WeakPolarHBondContact CA-O 3.06Å
276	R	96.3	Very high	80.1	Confident	55 Å²	55	70.5 Å²	70.5	21%	0.208	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	115	165.8	-178.2	164	66.5	-170.6	3.4	107.5	I302 E303 F305	R276-I302 WeakPolarHBondContact O-CA 3.15Å; R276-E303 HydrophobicContact CB-CB 4.43Å; R276-E303 IonicContact CZ-OE1 3.16Å; R276-E303 IonicContact CZ-OE2 3.51Å; R276-E303 PolarHBondContact N-O 2.88Å; R276-E303 IonicContact NE-OE2 2.92Å; R276-E303 PolarHBondContact NE-OE2 3.14Å; R276-E303 IonicContact NH2-OE1 3.75Å; R276-E303 PolarHBondContact NH2-OE1 3.21Å; R276-E303 IonicContact NH2-OE2 2.73Å; R276-E303 PolarHBondContact NH2-OE2 3.03Å; R276-E303 PolarHBondContact O-N 2.99Å; R276-F305 HydrophobicContact CB-CE2 3.95Å
277	Y	94.1	Very high	78	Confident	44 Å²	44	77.2 Å²	77.2	17%	0.173	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	121.6	177.6	178.7	-117.5	0	0	0	109.2	W232 F236 L241 T245 P300 K301 I302	W232-Y277 HydrophobicContact CE3-CD1 4.12Å; W232-Y277 AromaticContact CH2-CD1 3.58Å; W232-Y277 HydrophobicContact CH2-CD1 3.58Å; W232-Y277 HydrophobicContact CH2-CG 4.2Å; W232-Y277 HydrophobicContact CZ2-CD1 4.36Å; W232-Y277 AromaticContact CZ3-CD1 3.44Å; W232-Y277 HydrophobicContact CZ3-CD1 3.44Å; W232-Y277 VanDerWaalsContact CZ3-CD1 3.44Å; W232-Y277 HydrophobicContact CZ3-CE1 4.31Å; W232-Y277 HydrophobicContact CZ3-CG 4.18Å; F236-Y277 HydrophobicContact CE1-CD1 4.44Å; F236-Y277 HydrophobicContact CZ-CG 4.5Å; L241-Y277 HydrophobicContact CD2-CD2 4.41Å; L241-Y277 HydrophobicContact CD2-CE1 4.34Å; L241-Y277 HydrophobicContact CD2-CE2 3.77Å; T245-Y277 HydrophobicContact CG2-CD2 4.45Å; T245-Y277 HydrophobicContact CG2-CE2 3.82Å; Y277-P300 HydrophobicContact CE2-CB 3.95Å; Y277-K301 WeakPolarHBondContact CA-O 3.42Å; Y277-I302 HydrophobicContact CD2-CB 4.04Å; Y277-I302 HydrophobicContact CD2-CD1 4.06Å; Y277-I302 HydrophobicContact CD2-CG1 4.28Å
278	Q	88.5	Confident	76.2	Confident	110 Å²	110	82.9 Å²	82.9	51%	0.514	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	109.2	174.8	-67.6	176.7	1.4	0	0	107.7	P300 K301	Q278-P300 VanDerWaalsContact O-CA 3.25Å; Q278-P300 WeakPolarHBondContact O-CA 3.31Å; Q278-P300 WeakPolarHBondContact O-CB 3.38Å; Q278-K301 PolarHBondContact N-O 3.16Å; Q278-K301 PolarHBondContact O-N 2.82Å
279	S	80.4	Confident	74.2	Confident	78 Å²	78	88.4 Å²	88.4	55%	0.545	46%	0.457	S	S	.	.			trans	-67.5	146.3	173.2	-168.4	0	0	0	0	109.5	E281	S279-E281 PolarHBondContact O-N 3.06Å
280	S	68.3	Low	72	Confident	38 Å²	38	95 Å²	95	27%	0.266	49%	0.491	S	S	.	.			trans	-69	102	170.9	-162.4	0	0	0	0	107.9	V297 D298	S280-V297 WeakPolarHBondContact OG-CG1 3.24Å; S280-D298 VanDerWaalsContact CB-O 3.23Å; S280-D298 WeakPolarHBondContact CB-O 3.3Å; S280-D298 PolarHBondContact OG-O 2.86Å
281	E	57.2	Low	69.8	Low	170 Å²	170	101.4 Å²	101.4	79%	0.794	52%	0.517	S	S	*	.			trans	-85.9	126.7	167.1	-70	-178.8	179.7	0	0	107.3	S279 K283	S279-E281 PolarHBondContact O-N 3.06Å; E281-K283 PolarHBondContact O-N 3.1Å; E281-K283 VanDerWaalsContact O-N 3.13Å
282	L	51.4	Low	67.9	Low	142 Å²	142	104.9 Å²	104.9	74%	0.743	54%	0.535	S	S	*	.			trans	-60.1	117.2	165.8	-68.6	167	0	0	0	106.4	E284	L282-E284 PolarHBondContact O-N 3.27Å
283	K	51.8	Low	65.9	Low	154 Å²	154	109.9 Å²	109.9	67%	0.67	56%	0.562	S	S	*	*			trans	-60.8	104.3	168.8	-71.3	177.6	-178.5	162	0	106.9	E281 D285 D298	E281-K283 PolarHBondContact O-N 3.1Å; E281-K283 VanDerWaalsContact O-N 3.13Å; K283-D285 PolarHBondContact O-N 3.32Å; K283-D298 IonicContact NZ-OD2 3.92Å
284	E	53.3	Low	63.9	Low	189 Å²	189	121.6 Å²	121.6	88%	0.883	61%	0.606	S	S	*	*	S	Bend	trans	-67.3	-12.7	177.2	-68.9	-169.6	162	0	0	112	L282	L282-E284 PolarHBondContact O-N 3.27Å
285	D	50.7	Low	61.7	Low	157 Å²	157	123.8 Å²	123.8	84%	0.84	63%	0.634	S	S	*	*			trans	-103.9	70.6	177.6	-63.5	-28.9	0	0	0	111.7	K283	K283-D285 PolarHBondContact O-N 3.32Å
286	T	45.8	Very low	59.8	Low	119 Å²	119	129.1 Å²	129.1	73%	0.73	67%	0.667	S	S	*	*			trans	-100.5	105.7	153.4	30.6	0	0	0	0	108.2	E288	T286-E288 PolarHBondContact O-N 2.69Å
287	D	49.8	Very low	58	Low	143 Å²	143	130.7 Å²	130.7	77%	0.765	68%	0.682	S	S	*	*			trans	-43.3	132.2	164.5	-82.9	-39.5	0	0	0	109.6	T289	D287-T289 PolarHBondContact O-N 3.12Å
288	E	54.2	Low	56.7	Low	165 Å²	165	133 Å²	133	77%	0.771	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.7	12.7	-172.8	-63.2	-163.8	137.8	0	0	115.4	T286	T286-E288 PolarHBondContact O-N 2.69Å
289	T	54.6	Low	55.9	Low	118 Å²	118	133.2 Å²	133.2	72%	0.724	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.2	-10.7	-168.1	51.6	0	0	0	0	115	D287	D287-T289 PolarHBondContact O-N 3.12Å
290	N	45.7	Very low	56.1	Low	145 Å²	145	130.5 Å²	130.5	78%	0.775	68%	0.68	S	S	*	*			trans	-122.8	78.5	173.5	-83.1	-21.1	0	0	0	111.2
291	K	48.1	Very low	57.2	Low	165 Å²	165	135.1 Å²	135.1	72%	0.717	70%	0.696	S	S	*	*			trans	-86.8	3.9	-179.5	-91	176.5	176.5	159	0	115.3
292	D	51.9	Low	59	Low	165 Å²	165	127.3 Å²	127.3	88%	0.882	66%	0.659	S	S	*	*	S	Bend	trans	-117.8	6.5	-171	-64.7	-20.3	0	0	0	114.8
293	D	50.1	Low	61.1	Low	128 Å²	128	123.7 Å²	123.7	68%	0.684	64%	0.639	S	S	*	*	S	Bend	trans	-105.6	119.4	172.4	-152	22.4	0	0	0	108	G295	D293-G295 PolarHBondContact O-N 2.68Å
294	W	54.5	Low	63.3	Low	247 Å²	247	116.5 Å²	116.5	94%	0.936	61%	0.607	S	S	*	*			trans	-52.5	112.3	178.4	-84.2	83.2	0	0	0	108.6	V296	W294-V296 PolarHBondContact O-N 2.85Å
295	G	50.7	Low	65.5	Low	68 Å²	68	108.5 Å²	108.5	70%	0.701	57%	0.57	S	S	*	*			trans	-45.3	114	-172.1	0	0	0	0	0	111.7	D293 V297	D293-G295 PolarHBondContact O-N 2.68Å; G295-V297 VanDerWaalsContact C-N 3.26Å; G295-V297 PolarHBondContact O-N 3.22Å
296	V	58.3	Low	67.7	Low	112 Å²	112	101 Å²	101	68%	0.679	53%	0.53	S	S	*	.			trans	-69.5	86.9	-179.6	-175.7	0	0	0	0	107.8	W294 D298	W294-V296 PolarHBondContact O-N 2.85Å; V296-D298 PolarHBondContact O-N 3.09Å; V296-D298 VanDerWaalsContact O-N 3.16Å
297	V	59	Low	70.1	Confident	88 Å²	88	97 Å²	97	53%	0.533	50%	0.504	S	S	.	.			trans	-70.8	104.9	169.1	179.1	0	0	0	0	106.4	S280 G295 M299	S280-V297 WeakPolarHBondContact OG-CG1 3.24Å; G295-V297 VanDerWaalsContact C-N 3.26Å; G295-V297 PolarHBondContact O-N 3.22Å; V297-M299 PolarHBondContact O-N 2.8Å; V297-M299 VanDerWaalsContact O-N 3.07Å
298	D	66.7	Low	72.3	Confident	92 Å²	92	92.6 Å²	92.6	49%	0.492	48%	0.48	S	S	.	.			trans	-59.8	114.6	175.7	-79.1	-37.7	0	0	0	108.7	S280 K283 V296	S280-D298 VanDerWaalsContact CB-O 3.23Å; S280-D298 WeakPolarHBondContact CB-O 3.3Å; S280-D298 PolarHBondContact OG-O 2.86Å; K283-D298 IonicContact NZ-OD2 3.92Å; V296-D298 PolarHBondContact O-N 3.09Å; V296-D298 VanDerWaalsContact O-N 3.16Å
299	M	72.2	Confident	74.3	Confident	114 Å²	114	84.8 Å²	84.8	56%	0.562	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-60.2	136.2	179.5	-75.8	-69.7	-68	0	0	109.5	P244 V297 K301	P244-M299 HydrophobicContact CB-CE 4.01Å; P244-M299 HydrophobicContact CG-CE 4.04Å; V297-M299 PolarHBondContact O-N 2.8Å; V297-M299 VanDerWaalsContact O-N 3.07Å; M299-K301 PolarHBondContact O-N 2.86Å
300	P	84.9	Confident	76.2	Confident	22 Å²	22	79.8 Å²	79.8	14%	0.143	42%	0.415	C	S	.	.	P	Polyproline II helix	trans	-61.1	127.8	-178	21.7	-29	0	0	0	110.3	P242 T245 Y277 Q278	P242-P300 HydrophobicContact CG-CG 4.39Å; T245-P300 WeakPolarHBondContact OG1-CG 3.31Å; T245-P300 PolarHBondContact OG1-O 3.45Å; Y277-P300 HydrophobicContact CE2-CB 3.95Å; Q278-P300 VanDerWaalsContact O-CA 3.25Å; Q278-P300 WeakPolarHBondContact O-CA 3.31Å; Q278-P300 WeakPolarHBondContact O-CB 3.38Å
301	K	90.4	Very high	78.5	Confident	135 Å²	135	74.4 Å²	74.4	59%	0.587	39%	0.386	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.6	137.6	-178	-66.7	-177.3	-178.4	175.6	0	110.3	Y277 Q278 M299	Y277-K301 WeakPolarHBondContact CA-O 3.42Å; Q278-K301 PolarHBondContact N-O 3.16Å; Q278-K301 PolarHBondContact O-N 2.82Å; M299-K301 PolarHBondContact O-N 2.86Å
302	I	94.6	Very high	80.8	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	130.7	176.5	-168.5	154.5	0	0	0	110.1	F236 L241 T245 E248 F249 I275 R276 Y277	F236-I302 HydrophobicContact CE2-CD1 3.98Å; F236-I302 HydrophobicContact CZ-CD1 3.82Å; L241-I302 HydrophobicContact CD1-CD1 4.01Å; T245-I302 HydrophobicContact CG2-CB 4.03Å; T245-I302 HydrophobicContact CG2-CG2 3.73Å; E248-I302 HydrophobicContact CB-CG2 4.05Å; E248-I302 HydrophobicContact CG-CG2 3.89Å; F249-I302 HydrophobicContact CB-CD1 3.9Å; F249-I302 HydrophobicContact CB-CG1 4.4Å; F249-I302 HydrophobicContact CB-CG2 3.99Å; F249-I302 HydrophobicContact CD2-CD1 3.62Å; F249-I302 HydrophobicContact CD2-CG1 3.98Å; F249-I302 HydrophobicContact CE2-CD1 4.32Å; F249-I302 HydrophobicContact CG-CD1 3.76Å; F249-I302 HydrophobicContact CG-CG1 4.45Å; I275-I302 HydrophobicContact CG2-CD1 4Å; I275-I302 HydrophobicContact CG2-CG1 3.91Å; R276-I302 WeakPolarHBondContact O-CA 3.15Å; Y277-I302 HydrophobicContact CD2-CB 4.04Å; Y277-I302 HydrophobicContact CD2-CD1 4.06Å; Y277-I302 HydrophobicContact CD2-CG1 4.28Å
303	E	96.5	Very high	82.9	Confident	67 Å²	67	59.4 Å²	59.4	31%	0.313	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	148.6	180	-67.6	164.8	107.9	0	0	110.2	I275 R276 F305	I275-E303 WeakPolarHBondContact CA-O 3.06Å; R276-E303 HydrophobicContact CB-CB 4.43Å; R276-E303 IonicContact CZ-OE1 3.16Å; R276-E303 IonicContact CZ-OE2 3.51Å; R276-E303 PolarHBondContact N-O 2.88Å; R276-E303 IonicContact NE-OE2 2.92Å; R276-E303 PolarHBondContact NE-OE2 3.14Å; R276-E303 IonicContact NH2-OE1 3.75Å; R276-E303 PolarHBondContact NH2-OE1 3.21Å; R276-E303 IonicContact NH2-OE2 2.73Å; R276-E303 PolarHBondContact NH2-OE2 3.03Å; R276-E303 PolarHBondContact O-N 2.99Å; E303-F305 HydrophobicContact CB-CE2 3.89Å; E303-F305 HydrophobicContact CB-CZ 4.05Å
304	L	97.7	Very high	85.1	Confident	2 Å²	2	53.4 Å²	53.4	1%	0.01	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	135.5	-179.3	-173.7	153.9	0	0	0	110	I166 Q252 L256 W273 L274	I166-L304 HydrophobicContact CB-CD2 4.24Å; I166-L304 HydrophobicContact CD1-CD2 4.39Å; I166-L304 HydrophobicContact CG2-CD2 4.37Å; Q252-L304 HydrophobicContact CB-CB 3.84Å; L256-L304 HydrophobicContact CB-CD1 4.27Å; L256-L304 HydrophobicContact CB-CD2 3.96Å; L256-L304 HydrophobicContact CD1-CD2 4.3Å; L256-L304 HydrophobicContact CD2-CD1 4.22Å; L256-L304 HydrophobicContact CD2-CD2 4.31Å; L256-L304 HydrophobicContact CG-CD2 4.42Å; W273-L304 HydrophobicContact CE3-CD1 3.44Å; W273-L304 VanDerWaalsContact CE3-CD1 3.44Å; W273-L304 HydrophobicContact CE3-CD2 4.41Å; W273-L304 HydrophobicContact CE3-CG 3.8Å; W273-L304 HydrophobicContact CZ3-CD1 3.53Å; W273-L304 HydrophobicContact CZ3-CG 4.3Å; L274-L304 CarbonylContact O-C 3.54Å; L274-L304 WeakPolarHBondContact O-CA 3.32Å
305	F	98.3	Very high	87	Confident	21 Å²	21	44.2 Å²	44.2	9%	0.092	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	119.7	176.6	-58.7	-80.7	0	0	0	112.1	I166 P168 V223 C226 W273 L274 R276 E303 I307	I166-F305 CarbonylContact O-C 3.42Å; I166-F305 VanDerWaalsContact O-CA 3.22Å; I166-F305 WeakPolarHBondContact O-CA 3.34Å; P168-F305 HydrophobicContact CG-CB 4.35Å; P168-F305 HydrophobicContact CG-CD1 4.11Å; V223-F305 HydrophobicContact CB-CD1 4.39Å; V223-F305 HydrophobicContact CB-CE1 4.45Å; V223-F305 HydrophobicContact CB-CG 4.42Å; V223-F305 HydrophobicContact CG1-CD1 3.82Å; V223-F305 HydrophobicContact CG1-CE1 3.82Å; V223-F305 HydrophobicContact CG1-CG 4.32Å; V223-F305 HydrophobicContact CG1-CZ 4.35Å; V223-F305 HydrophobicContact CG2-CB 4.22Å; V223-F305 HydrophobicContact CG2-CD1 4.31Å; V223-F305 HydrophobicContact CG2-CD2 4.22Å; V223-F305 HydrophobicContact CG2-CG 3.97Å; C226-F305 VanDerWaalsContact SG-CD2 3.55Å; W273-F305 CarbonylContact C-O 3.54Å; W273-F305 VanDerWaalsContact CA-O 3.29Å; W273-F305 WeakPolarHBondContact CA-O 3.22Å; L274-F305 HydrophobicContact CB-CB 4.32Å; L274-F305 PolarHBondContact N-O 2.9Å; L274-F305 PolarHBondContact O-N 3.48Å; R276-F305 HydrophobicContact CB-CE2 3.95Å; E303-F305 HydrophobicContact CB-CE2 3.89Å; E303-F305 HydrophobicContact CB-CZ 4.05Å; F305-I307 PolarHBondContact O-N 3.46Å
306	A	98.2	Very high	89	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	102.5	176.9	0	0	0	0	0	110.7	I166 V167 L256 L259 N309	I166-A306 HydrophobicContact CD1-CB 4.11Å; I166-A306 HydrophobicContact CG1-CB 4.24Å; I166-A306 PolarHBondContact O-N 3.05Å; V167-A306 HydrophobicContact CG2-CB 3.99Å; L256-A306 HydrophobicContact CD1-CB 3.81Å; L259-A306 HydrophobicContact CD2-CB 3.94Å; A306-N309 PolarHBondContact O-ND2 3.46Å; A306-N309 VanDerWaalsContact O-ND2 3.12Å
307	I	96.7	Very high	90.6	Very high	36 Å²	36	39.8 Å²	39.8	19%	0.185	20%	0.202	C	C	.	.			trans	-107.9	171	-179	63.3	162.7	0	0	0	111.5	P168 R268 N272 L274 F305 N309	P168-I307 HydrophobicContact CG-CG2 4.39Å; R268-I307 PolarHBondContact NH1-O 2.98Å; N272-I307 WeakPolarHBondContact O-CG1 3.39Å; L274-I307 HydrophobicContact CD1-CD1 3.93Å; L274-I307 HydrophobicContact CD1-CG2 4.25Å; L274-I307 HydrophobicContact CD2-CD1 3.86Å; L274-I307 HydrophobicContact CG-CD1 3.78Å; L274-I307 HydrophobicContact CG-CG1 4.17Å; L274-I307 HydrophobicContact CG-CG2 4.47Å; F305-I307 PolarHBondContact O-N 3.46Å; I307-N309 PolarHBondContact O-N 3.47Å
308	D	95.1	Very high	91.9	Very high	50 Å²	50	36.7 Å²	36.7	27%	0.267	18%	0.183	S	C	.	.			trans	54.1	55.7	175.2	-153.1	26	0	0	0	114.3	K111 E152 G310	K111-D308 IonicContact NZ-OD1 3.56Å; K111-D308 PolarHBondContact NZ-OD1 3.14Å; E152-D308 WeakPolarHBondContact OE1-CA 3.35Å; D308-G310 VanDerWaalsContact C-N 3.29Å; D308-G310 PolarHBondContact O-N 2.76Å
309	N	96.7	Very high	92.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.			trans	-90.5	12.4	-178.2	-51.2	-73.6	0	0	0	112.5	S151 E152 A155 R268 A306 I307 L311 S312	S151-N309 PolarHBondContact OG-O 2.68Å; E152-N309 VanDerWaalsContact CD-N 3.27Å; E152-N309 PolarHBondContact OE1-N 2.83Å; E152-N309 WeakPolarHBondContact OE2-CA 3.25Å; E152-N309 WeakPolarHBondContact OE2-CB 3.34Å; E152-N309 PolarHBondContact OE2-N 2.81Å; A155-N309 HydrophobicContact CB-CB 3.41Å; A155-N309 VanDerWaalsContact CB-CB 3.41Å; R268-N309 PolarHBondContact NH2-OD1 3.25Å; A306-N309 PolarHBondContact O-ND2 3.46Å; A306-N309 VanDerWaalsContact O-ND2 3.12Å; I307-N309 PolarHBondContact O-N 3.47Å; N309-L311 PolarHBondContact O-N 2.77Å; N309-S312 PolarHBondContact O-OG 2.99Å
310	G	94.3	Very high	92.5	Very high	13 Å²	13	35.2 Å²	35.2	13%	0.134	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-1.7	-172.6	0	0	0	0	0	116	G148 E152 D308	G148-G310 VanDerWaalsContact CA-O 3.28Å; G148-G310 WeakPolarHBondContact CA-O 3.47Å; G148-G310 WeakPolarHBondContact O-CA 3.4Å; E152-G310 PolarHBondContact OE1-N 3.14Å; E152-G310 VanDerWaalsContact OE1-N 3.09Å; D308-G310 VanDerWaalsContact C-N 3.29Å; D308-G310 PolarHBondContact O-N 2.76Å
311	L	93.8	Very high	91.1	Very high	32 Å²	32	41.8 Å²	41.8	17%	0.168	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.4	51.9	-176.2	-65.5	161.7	0	0	0	110.9	L143 N265 T266 D267 N309	L143-L311 HydrophobicContact CD1-CB 3.95Å; L143-L311 HydrophobicContact CD1-CD2 3.58Å; L143-L311 HydrophobicContact CD1-CG 4.39Å; N265-L311 PolarHBondContact OD1-O 2.88Å; T266-L311 WeakPolarHBondContact CB-O 3.36Å; T266-L311 PolarHBondContact N-O 2.88Å; T266-L311 PolarHBondContact OG1-O 3.17Å; D267-L311 HydrophobicContact CB-CB 4.02Å; D267-L311 HydrophobicContact CB-CD1 3.84Å; D267-L311 WeakPolarHBondContact OD2-CD1 3.35Å; N309-L311 PolarHBondContact O-N 2.77Å
312	S	96.1	Very high	90.1	Very high	7 Å²	7	38 Å²	38	5%	0.049	18%	0.178	C	C	.	.			trans	-127.8	-173.9	177.7	76.6	0	0	0	0	111.3	L143 S151 N309	L143-S312 WeakPolarHBondContact CD2-O 3.47Å; S151-S312 WeakPolarHBondContact OG-CB 3.49Å; S151-S312 PolarHBondContact OG-N 3.24Å; S151-S312 PolarHBondContact OG-OG 3.21Å; N309-S312 PolarHBondContact O-OG 2.99Å
313	F	97.2	Very high	89.1	Confident	8 Å²	8	40.5 Å²	40.5	4%	0.035	20%	0.199	C	C	.	.			trans	54.8	57.3	-174.1	-55.4	-82.6	0	0	0	113.8	V158 I263 L363 F367 Q381 L385	V158-F313 HydrophobicContact CG2-CE1 4.28Å; V158-F313 HydrophobicContact CG2-CZ 4.06Å; I263-F313 HydrophobicContact CB-CE1 4.11Å; I263-F313 HydrophobicContact CB-CE2 4.19Å; I263-F313 HydrophobicContact CB-CZ 3.93Å; I263-F313 HydrophobicContact CG2-CE1 3.86Å; I263-F313 HydrophobicContact CG2-CE2 4.18Å; I263-F313 HydrophobicContact CG2-CZ 3.54Å; I263-F313 PolarHBondContact O-N 2.69Å; F313-L363 HydrophobicContact CE1-CD1 4.04Å; F313-L363 HydrophobicContact CE1-CD2 4.07Å; F313-L363 HydrophobicContact CZ-CD2 4.13Å; F313-F367 HydrophobicContact CB-CE2 4.19Å; F313-F367 HydrophobicContact CB-CZ 4.19Å; F313-F367 HydrophobicContact CD1-CZ 4.16Å; F313-F367 AromaticContact CD2-CZ 3.87Å; F313-F367 HydrophobicContact CD2-CZ 3.87Å; F313-F367 HydrophobicContact CE2-CZ 4.29Å; F313-F367 HydrophobicContact CG-CE2 4.24Å; F313-F367 AromaticContact CG-CZ 3.81Å; F313-F367 HydrophobicContact CG-CZ 3.81Å; F313-Q381 WeakPolarHBondContact O-CG 3.33Å; F313-Q381 PolarHBondContact O-NE2 3.02Å; F313-L385 HydrophobicContact CE1-CD1 4.2Å
314	P	96	Very high	88.6	Confident	2 Å²	2	39 Å²	39	1%	0.013	19%	0.191	C	C	.	.			trans	-68.8	144.2	176.1	32.4	-36.1	0	0	0	111.7	C142 L143 R264 K316 V384	C142-P314 HydrophobicContact CB-CB 4.09Å; C142-P314 CarbonylContact O-C 3.45Å; C142-P314 WeakPolarHBondContact O-CA 3.48Å; C142-P314 VanDerWaalsContact O-CB 3.27Å; C142-P314 WeakPolarHBondContact O-CB 3.33Å; L143-P314 HydrophobicContact CD2-CB 3.81Å; R264-P314 HydrophobicContact CB-CG 3.85Å; R264-P314 HydrophobicContact CG-CG 3.7Å; P314-K316 VanDerWaalsContact C-N 3.26Å; P314-K316 WeakPolarHBondContact CB-O 3.2Å; P314-K316 PolarHBondContact O-N 3.33Å; P314-V384 HydrophobicContact CG-CG1 4.33Å
315	F	93.4	Very high	88.2	Confident	54 Å²	54	41.3 Å²	41.3	24%	0.237	21%	0.206	C	C	.	.	S	Bend	trans	-81	-7.7	176.8	67.2	-97.3	0	0	0	112.9	S141 C142 V144 T377 K380 Q381	S141-F315 WeakPolarHBondContact O-CE1 3.36Å; S141-F315 WeakPolarHBondContact O-CZ 3.37Å; C142-F315 WeakPolarHBondContact O-CD1 3.2Å; C142-F315 WeakPolarHBondContact O-CE1 3.49Å; C142-F315 PolarHBondContact O-N 3.45Å; V144-F315 HydrophobicContact CG2-CD1 4.11Å; F315-T377 HydrophobicContact CB-CG2 3.91Å; F315-T377 HydrophobicContact CD1-CG2 4.39Å; F315-T377 HydrophobicContact CG-CG2 4.25Å; F315-K380 HydrophobicContact CB-CB 4.1Å; F315-K380 WeakPolarHBondContact O-CB 3.29Å; F315-Q381 HydrophobicContact CB-CG 3.83Å
316	K	93	Very high	88.1	Confident	68 Å²	68	41 Å²	41	30%	0.296	21%	0.205	S	C	.	.	S	Bend	trans	-151.3	156.5	170.7	62.3	169.8	-170.5	154.2	0	109.3	C142 P314 D319	C142-K316 HydrophobicContact CB-CG 3.88Å; C142-K316 WeakPolarHBondContact CB-O 3.33Å; P314-K316 VanDerWaalsContact C-N 3.26Å; P314-K316 WeakPolarHBondContact CB-O 3.2Å; P314-K316 PolarHBondContact O-N 3.33Å; K316-D319 IonicContact NZ-OD1 2.65Å; K316-D319 PolarHBondContact NZ-OD1 2.95Å; K316-D319 IonicContact NZ-OD2 2.72Å; K316-D319 PolarHBondContact NZ-OD2 3.39Å
317	H	91.8	Very high	87.8	Confident	20 Å²	20	47 Å²	47	9%	0.093	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-60.4	147.2	169.2	-70.5	-74.4	0	0	0	110.5	Q388 V410 L411	H317-Q388 PolarHBondContact CE1-NE2 3.17Å; H317-Q388 VanDerWaalsContact CE1-NE2 3.26Å; H317-V410 HydrophobicContact CB-CG2 4.24Å; H317-L411 PolarHBondContact NE2-O 3.2Å
318	P	87.6	Confident	87.8	Confident	22 Å²	22	45.2 Å²	45.2	14%	0.143	22%	0.219	C	C	.	.	P	Polyproline II helix	trans	-58	142.1	177.1	-23.6	34.3	0	0	0	112.2	R322 Y324	P318-R322 WeakPolarHBondContact CB-O 3.29Å; P318-Y324 HydrophobicContact CB-CD2 3.63Å; P318-Y324 HydrophobicContact CB-CE2 4.18Å; P318-Y324 HydrophobicContact CG-CD2 3.68Å
319	D	80.9	Confident	87.9	Confident	56 Å²	56	43.2 Å²	43.2	30%	0.299	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-68.7	143.5	172.1	-53.2	-43.8	0	0	0	108.8	K316 W321 R322	K316-D319 IonicContact NZ-OD1 2.65Å; K316-D319 PolarHBondContact NZ-OD1 2.95Å; K316-D319 IonicContact NZ-OD2 2.72Å; K316-D319 PolarHBondContact NZ-OD2 3.39Å; D319-W321 VanDerWaalsContact C-N 3.29Å; D319-W321 PolarHBondContact O-N 2.91Å; D319-W321 VanDerWaalsContact O-N 3.12Å; D319-R322 CarbonylContact O-C 3.49Å; D319-R322 WeakPolarHBondContact O-CA 3.24Å; D319-R322 PolarHBondContact O-N 3.29Å
320	E	70	Confident	87.7	Confident	120 Å²	120	51 Å²	51	56%	0.561	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-55.5	-36.5	-168	-77.1	165.6	-143.6	0	0	115.7	R322 A323 P576	E320-R322 PolarHBondContact O-N 3.45Å; E320-R322 VanDerWaalsContact O-N 3.07Å; E320-A323 PolarHBondContact O-N 3.08Å; E320-P576 WeakPolarHBondContact OE1-CD 3.35Å; E320-P576 WeakPolarHBondContact OE1-CG 3.23Å; E320-P576 WeakPolarHBondContact OE2-CD 3.4Å; E320-P576 VanDerWaalsContact OE2-CG 3.3Å; E320-P576 WeakPolarHBondContact OE2-CG 3.22Å
321	W	55.5	Low	87.8	Confident	159 Å²	159	51.3 Å²	51.3	60%	0.602	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-64.8	-11	177.4	64.3	-82.2	0	0	0	113.1	D319	D319-W321 VanDerWaalsContact C-N 3.29Å; D319-W321 PolarHBondContact O-N 2.91Å; D319-W321 VanDerWaalsContact O-N 3.12Å
322	R	68.1	Low	87.8	Confident	56 Å²	56	54 Å²	54	21%	0.211	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-137	70.7	170.5	-75.6	-177	172	136.5	17.6	110.2	C136 C137 P318 D319 E320 Y324	C136-R322 PolarHBondContact O-NH1 3.31Å; C137-R322 VanDerWaalsContact CA-NH2 3.31Å; P318-R322 WeakPolarHBondContact CB-O 3.29Å; D319-R322 CarbonylContact O-C 3.49Å; D319-R322 WeakPolarHBondContact O-CA 3.24Å; D319-R322 PolarHBondContact O-N 3.29Å; E320-R322 PolarHBondContact O-N 3.45Å; E320-R322 VanDerWaalsContact O-N 3.07Å; R322-Y324 VanDerWaalsContact C-N 3.27Å; R322-Y324 HydrophobicContact CB-CE1 4.42Å; R322-Y324 HydrophobicContact CB-CE2 4.05Å; R322-Y324 WeakPolarHBondContact CD-OH 3.11Å; R322-Y324 VanDerWaalsContact O-CD2 3.29Å; R322-Y324 WeakPolarHBondContact O-CD2 3.49Å; R322-Y324 WeakPolarHBondContact O-CE2 3.36Å; R322-Y324 PolarHBondContact O-N 3.48Å; R322-Y324 VanDerWaalsContact O-N 3.16Å
323	A	73.9	Confident	87.7	Confident	58 Å²	58	55.3 Å²	55.3	48%	0.479	26%	0.263	S	S	.	.			trans	-66.5	-16.1	-171.7	0	0	0	0	0	116.5	R264 E320	R264-A323 PolarHBondContact NH2-O 3.25Å; E320-A323 PolarHBondContact O-N 3.08Å
324	Y	85.5	Confident	87.6	Confident	35 Å²	35	55 Å²	55	14%	0.137	26%	0.261	C	S	.	.			trans	38.1	68.3	-176.1	-57	-56	0	0	0	112.8	R140 R264 T266 P318 R322	R140-Y324 WeakPolarHBondContact CA-OH 3.48Å; R140-Y324 HydrophobicContact CB-CE2 4.15Å; R140-Y324 HydrophobicContact CG-CE1 3.88Å; R140-Y324 HydrophobicContact CG-CE2 4.11Å; R140-Y324 WeakPolarHBondContact CG-OH 3.47Å; R264-Y324 PolarHBondContact NH1-O 3.46Å; R264-Y324 PolarHBondContact NH2-O 2.97Å; T266-Y324 HydrophobicContact CG2-CD2 4.4Å; P318-Y324 HydrophobicContact CB-CD2 3.63Å; P318-Y324 HydrophobicContact CB-CE2 4.18Å; P318-Y324 HydrophobicContact CG-CD2 3.68Å; R322-Y324 VanDerWaalsContact C-N 3.27Å; R322-Y324 HydrophobicContact CB-CE1 4.42Å; R322-Y324 HydrophobicContact CB-CE2 4.05Å; R322-Y324 WeakPolarHBondContact CD-OH 3.11Å; R322-Y324 VanDerWaalsContact O-CD2 3.29Å; R322-Y324 WeakPolarHBondContact O-CD2 3.49Å; R322-Y324 WeakPolarHBondContact O-CE2 3.36Å; R322-Y324 PolarHBondContact O-N 3.48Å; R322-Y324 VanDerWaalsContact O-N 3.16Å
325	P	91	Very high	87.7	Confident	51 Å²	51	61.2 Å²	61.2	33%	0.331	29%	0.288	S	S	.	.			trans	-72.3	160.9	-172.7	33.1	-37.2	0	0	0	111.8	Y327 W330	P325-Y327 HydrophobicContact CG-CE2 4.42Å; P325-W330 HydrophobicContact CB-CH2 3.39Å; P325-W330 HydrophobicContact CB-CZ3 3.7Å; P325-W330 HydrophobicContact CG-CH2 3.63Å; P325-W330 HydrophobicContact CG-CZ3 3.96Å
326	F	94.6	Very high	87.8	Confident	13 Å²	13	62.5 Å²	62.5	6%	0.057	30%	0.295	C	S	.	.			trans	-82.8	111.5	169.2	-57.6	-74.1	0	0	0	109.2	D260 Y261 R264 N265 W328 A329 W330 V406	D260-F326 HydrophobicContact CB-CD1 4.18Å; D260-F326 HydrophobicContact CB-CE1 4.06Å; D260-F326 WeakPolarHBondContact O-CE1 3.45Å; Y261-F326 HydrophobicContact CD2-CE2 4Å; Y261-F326 HydrophobicContact CD2-CZ 4.2Å; Y261-F326 HydrophobicContact CE2-CE2 4.48Å; R264-F326 VanDerWaalsContact CD-CZ 3.5Å; N265-F326 WeakPolarHBondContact O-CE1 3.08Å; F326-W328 HydrophobicContact CB-CD2 3.9Å; F326-W328 VanDerWaalsContact CB-CE2 3.5Å; F326-W328 HydrophobicContact CB-CE3 4.3Å; F326-W328 HydrophobicContact CB-CG 4.49Å; F326-W328 HydrophobicContact CB-CH2 3.91Å; F326-W328 HydrophobicContact CB-CZ2 3.52Å; F326-W328 HydrophobicContact CB-CZ3 4.3Å; F326-W328 AromaticContact CD1-CZ2 3.67Å; F326-W328 HydrophobicContact CD1-CZ2 3.67Å; F326-W328 HydrophobicContact CD2-CH2 4.17Å; F326-W328 HydrophobicContact CD2-CZ2 4.11Å; F326-W328 HydrophobicContact CE1-CZ2 4.34Å; F326-W328 AromaticContact CG-CE2 3.94Å; F326-W328 AromaticContact CG-CH2 3.98Å; F326-W328 HydrophobicContact CG-CH2 3.98Å; F326-W328 AromaticContact CG-CZ2 3.51Å; F326-W328 HydrophobicContact CG-CZ2 3.51Å; F326-W328 PolarHBondContact O-N 2.88Å; F326-A329 WeakPolarHBondContact O-CB 3.25Å; F326-A329 PolarHBondContact O-N 2.79Å; F326-W330 WeakPolarHBondContact O-CZ3 3.23Å; F326-V406 HydrophobicContact CD2-CB 4.39Å; F326-V406 HydrophobicContact CD2-CG1 3.57Å; F326-V406 HydrophobicContact CE2-CG1 4.05Å; F326-V406 HydrophobicContact CG-CG1 4.5Å
327	Y	93.8	Very high	88	Confident	126 Å²	126	62.6 Å²	62.6	49%	0.494	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-65.4	-27.9	-173.7	-77.4	-107.2	0	0	0	113.2	R268 P325 A329 W330	R268-Y327 VanDerWaalsContact O-CB 3.29Å; R268-Y327 WeakPolarHBondContact O-CB 3.41Å; R268-Y327 VanDerWaalsContact O-CD2 3.25Å; R268-Y327 WeakPolarHBondContact O-CD2 3.33Å; R268-Y327 PolarHBondContact O-N 3.34Å; P325-Y327 HydrophobicContact CG-CE2 4.42Å; Y327-A329 PolarHBondContact O-N 3.47Å; Y327-W330 PolarHBondContact O-N 3.43Å
328	W	96	Very high	88.3	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	30%	0.299	C	S	.	.	G	3₁₀ helix	trans	-64.6	-17.2	174.2	49.2	-112	0	0	0	113.6	F253 V257 D260 F326 W330 L331 A334 P402 V406	F253-W328 HydrophobicContact CE2-CB 3.69Å; F253-W328 HydrophobicContact CE2-CG 4.37Å; F253-W328 HydrophobicContact CZ-CB 4Å; F253-W328 HydrophobicContact CZ-CE3 4.34Å; V257-W328 HydrophobicContact CB-CH2 4.26Å; V257-W328 HydrophobicContact CB-CZ2 4.39Å; V257-W328 HydrophobicContact CB-CZ3 4.45Å; V257-W328 HydrophobicContact CG1-CH2 3.71Å; V257-W328 HydrophobicContact CG1-CZ2 4.24Å; V257-W328 HydrophobicContact CG1-CZ3 4Å; V257-W328 HydrophobicContact CG2-CD2 4.08Å; V257-W328 HydrophobicContact CG2-CE3 3.81Å; V257-W328 HydrophobicContact CG2-CH2 4.1Å; V257-W328 HydrophobicContact CG2-CZ2 4.28Å; V257-W328 HydrophobicContact CG2-CZ3 3.84Å; D260-W328 HydrophobicContact CB-CZ2 4.15Å; D260-W328 PolarHBondContact OD2-NE1 3.12Å; F326-W328 HydrophobicContact CB-CD2 3.9Å; F326-W328 VanDerWaalsContact CB-CE2 3.5Å; F326-W328 HydrophobicContact CB-CE3 4.3Å; F326-W328 HydrophobicContact CB-CG 4.49Å; F326-W328 HydrophobicContact CB-CH2 3.91Å; F326-W328 HydrophobicContact CB-CZ2 3.52Å; F326-W328 HydrophobicContact CB-CZ3 4.3Å; F326-W328 AromaticContact CD1-CZ2 3.67Å; F326-W328 HydrophobicContact CD1-CZ2 3.67Å; F326-W328 HydrophobicContact CD2-CH2 4.17Å; F326-W328 HydrophobicContact CD2-CZ2 4.11Å; F326-W328 HydrophobicContact CE1-CZ2 4.34Å; F326-W328 AromaticContact CG-CE2 3.94Å; F326-W328 AromaticContact CG-CH2 3.98Å; F326-W328 HydrophobicContact CG-CH2 3.98Å; F326-W328 AromaticContact CG-CZ2 3.51Å; F326-W328 HydrophobicContact CG-CZ2 3.51Å; F326-W328 PolarHBondContact O-N 2.88Å; W328-W330 PolarHBondContact O-N 3.19Å; W328-W330 VanDerWaalsContact O-N 3.15Å; W328-L331 HydrophobicContact CB-CD1 3.99Å; W328-L331 WeakPolarHBondContact O-CB 3.5Å; W328-L331 WeakPolarHBondContact O-CG 3.44Å; W328-L331 PolarHBondContact O-N 3.33Å; W328-A334 WeakPolarHBondContact O-CB 3.49Å; W328-P402 HydrophobicContact CZ3-CB 3.96Å; W328-V406 HydrophobicContact CH2-CG1 3.7Å; W328-V406 HydrophobicContact CZ3-CG1 3.96Å
329	A	96	Very high	88.8	Confident	8 Å²	8	61.9 Å²	61.9	7%	0.066	30%	0.3	C	S	.	.	G	3₁₀ helix	trans	-64.4	-19.8	179.8	0	0	0	0	0	113	F326 Y327 Y403 V406	F326-A329 WeakPolarHBondContact O-CB 3.25Å; F326-A329 PolarHBondContact O-N 2.79Å; Y327-A329 PolarHBondContact O-N 3.47Å; A329-Y403 WeakPolarHBondContact O-CD2 3.37Å; A329-V406 HydrophobicContact CB-CG2 4.02Å
330	W	94.2	Very high	89.6	Confident	163 Å²	163	64.3 Å²	64.3	62%	0.617	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-88.7	-6.2	176.6	-71	-87	0	0	0	114	P325 F326 Y327 W328	P325-W330 HydrophobicContact CB-CH2 3.39Å; P325-W330 HydrophobicContact CB-CZ3 3.7Å; P325-W330 HydrophobicContact CG-CH2 3.63Å; P325-W330 HydrophobicContact CG-CZ3 3.96Å; F326-W330 WeakPolarHBondContact O-CZ3 3.23Å; Y327-W330 PolarHBondContact O-N 3.43Å; W328-W330 PolarHBondContact O-N 3.19Å; W328-W330 VanDerWaalsContact O-N 3.15Å
331	L	95.1	Very high	90.9	Very high	20 Å²	20	60.9 Å²	60.9	11%	0.105	31%	0.305	C	S	.	.	S	Bend	trans	-70.8	147.4	178	-62.3	175.7	0	0	0	110.9	L233 F253 W273 W328 M333 A334	L233-L331 HydrophobicContact CD1-CD1 3.96Å; L233-L331 HydrophobicContact CD1-CD2 3.8Å; F253-L331 HydrophobicContact CE2-CD1 3.89Å; F253-L331 HydrophobicContact CZ-CD1 4.46Å; W273-L331 HydrophobicContact CH2-CD1 4.18Å; W273-L331 HydrophobicContact CZ2-CD1 3.86Å; W328-L331 HydrophobicContact CB-CD1 3.99Å; W328-L331 WeakPolarHBondContact O-CB 3.5Å; W328-L331 WeakPolarHBondContact O-CG 3.44Å; W328-L331 PolarHBondContact O-N 3.33Å; L331-M333 PolarHBondContact O-N 2.93Å; L331-A334 WeakPolarHBondContact O-CB 3.37Å; L331-A334 PolarHBondContact O-N 3.37Å
332	P	93.6	Very high	92.9	Very high	88 Å²	88	53.3 Å²	53.3	57%	0.571	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-53.8	-41.7	176.8	-27.2	35.2	0	0	0	113.1	A334 K335	P332-A334 PolarHBondContact O-N 2.97Å; P332-K335 WeakPolarHBondContact O-CB 3.45Å; P332-K335 PolarHBondContact O-N 3.37Å
333	M	93.6	Very high	94.4	Very high	35 Å²	35	52 Å²	52	17%	0.172	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-61.3	-27	178.8	-64.2	173	-76.4	0	0	113.3	L233 F249 F253 L331 K335 E336	L233-M333 HydrophobicContact CD2-CE 3.59Å; F249-M333 HydrophobicContact CD1-CE 4.34Å; F249-M333 HydrophobicContact CD1-SD 3.74Å; F249-M333 HydrophobicContact CE1-CE 3.49Å; F249-M333 VanDerWaalsContact CE1-CE 3.49Å; F249-M333 HydrophobicContact CE1-SD 3.5Å; F249-M333 WeakPolarHBondContact CE1-SD 3.44Å; F249-M333 HydrophobicContact CZ-CE 4.07Å; F249-M333 HydrophobicContact CZ-SD 4.43Å; F253-M333 HydrophobicContact CD1-CB 4.23Å; F253-M333 HydrophobicContact CE1-CB 4.19Å; L331-M333 PolarHBondContact O-N 2.93Å; M333-K335 PolarHBondContact O-N 3.02Å; M333-E336 PolarHBondContact O-N 3.35Å
334	A	96.6	Very high	95.5	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-70.9	-14.7	177.9	0	0	0	0	0	113.2	F253 W328 L331 P332 S401 P402 Y403	F253-A334 HydrophobicContact CE1-CB 4.32Å; F253-A334 HydrophobicContact CZ-CB 4.13Å; W328-A334 WeakPolarHBondContact O-CB 3.49Å; L331-A334 WeakPolarHBondContact O-CB 3.37Å; L331-A334 PolarHBondContact O-N 3.37Å; P332-A334 PolarHBondContact O-N 2.97Å; A334-S401 WeakPolarHBondContact O-CB 3.37Å; A334-P402 HydrophobicContact CB-CB 4.1Å; A334-P402 VanDerWaalsContact O-CD 3.29Å; A334-P402 WeakPolarHBondContact O-CD 3.42Å; A334-Y403 WeakPolarHBondContact O-CB 3.26Å; A334-Y403 PolarHBondContact O-N 3.06Å
335	K	96.7	Very high	96	Very high	134 Å²	134	57 Å²	57	58%	0.583	30%	0.295	S	S	*	.	G	3₁₀ helix	trans	-88.3	-10.8	177.9	-59.7	177	-177.4	173	0	112.7	P332 M333 S401	P332-K335 WeakPolarHBondContact O-CB 3.45Å; P332-K335 PolarHBondContact O-N 3.37Å; M333-K335 PolarHBondContact O-N 3.02Å; K335-S401 WeakPolarHBondContact O-CB 3.34Å
336	E	96.1	Very high	96.4	Very high	81 Å²	81	54.5 Å²	54.5	38%	0.379	28%	0.279	S	S	.	.	S	Bend	trans	-80.1	141.5	175.1	-61.8	-176.3	-171.9	0	0	109.9	R250 M333 S401 P402	R250-E336 WeakPolarHBondContact CD-OE2 3.34Å; R250-E336 IonicContact CZ-OE2 3.69Å; R250-E336 VanDerWaalsContact CZ-OE2 3.26Å; R250-E336 IonicContact NE-OE2 3.67Å; R250-E336 IonicContact NH1-OE2 3.83Å; R250-E336 PolarHBondContact NH1-OE2 3.34Å; M333-E336 PolarHBondContact O-N 3.35Å; E336-S401 WeakPolarHBondContact O-CA 3.41Å; E336-S401 WeakPolarHBondContact O-CB 3.38Å; E336-P402 WeakPolarHBondContact O-CD 3.5Å
337	P	98	Very high	96.5	Very high	70 Å²	70	55.8 Å²	55.8	46%	0.455	29%	0.286	S	S	.	.	P	Polyproline II helix	trans	-52.8	150.2	171.7	-29.3	37.7	0	0	0	112.3	R250 S339 S399	R250-P337 PolarHBondContact NH2-O 3.17Å; P337-S339 PolarHBondContact O-N 3Å; P337-S399 WeakPolarHBondContact CB-O 3.14Å
338	F	98.3	Very high	96.6	Very high	3 Å²	3	53.9 Å²	53.9	1%	0.013	29%	0.289	C	S	.	.	P	Polyproline II helix	trans	-54.7	133.7	170	-74.1	-67.8	0	0	0	111.2	E254 V257 I342 K343 L392 A395 L396 K400 P402 L405	E254-F338 HydrophobicContact CB-CD1 4.4Å; E254-F338 HydrophobicContact CG-CD1 4.11Å; V257-F338 HydrophobicContact CB-CE1 4.39Å; V257-F338 HydrophobicContact CG1-CE1 3.81Å; V257-F338 HydrophobicContact CG1-CZ 3.74Å; F338-I342 HydrophobicContact CB-CG2 3.86Å; F338-I342 HydrophobicContact CD1-CG2 3.93Å; F338-I342 HydrophobicContact CG-CG2 4.31Å; F338-K343 WeakPolarHBondContact O-CE 3.42Å; F338-K343 PolarHBondContact O-NZ 3.04Å; F338-L392 HydrophobicContact CZ-CD1 4.33Å; F338-A395 HydrophobicContact CE2-CB 4.49Å; F338-L396 HydrophobicContact CB-CD2 3.93Å; F338-L396 HydrophobicContact CD1-CD2 4.19Å; F338-L396 HydrophobicContact CD2-CD2 3.75Å; F338-L396 HydrophobicContact CE2-CD2 4.29Å; F338-L396 HydrophobicContact CG-CD2 3.7Å; F338-K400 WeakPolarHBondContact CD2-O 3.47Å; F338-K400 PolarHBondContact N-O 2.92Å; F338-P402 HydrophobicContact CD1-CG 4.28Å; F338-P402 HydrophobicContact CE1-CG 3.75Å; F338-P402 HydrophobicContact CZ-CB 4.35Å; F338-P402 HydrophobicContact CZ-CG 3.9Å; F338-L405 HydrophobicContact CE2-CB 4.45Å; F338-L405 HydrophobicContact CE2-CD2 4.13Å; F338-L405 HydrophobicContact CZ-CD2 3.88Å
339	S	97.5	Very high	96.7	Very high	24 Å²	24	56 Å²	56	17%	0.168	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-62.8	157.7	175.2	74.9	0	0	0	0	112	E254 P337 A341 I342 K343	E254-S339 PolarHBondContact OE1-N 2.94Å; E254-S339 VanDerWaalsContact OE2-CB 3.25Å; E254-S339 WeakPolarHBondContact OE2-CB 3.29Å; E254-S339 PolarHBondContact OE2-OG 3.24Å; P337-S339 PolarHBondContact O-N 3Å; S339-A341 VanDerWaalsContact C-N 3.25Å; S339-A341 PolarHBondContact O-N 3.45Å; S339-I342 VanDerWaalsContact O-CG2 3.25Å; S339-I342 WeakPolarHBondContact O-CG2 3.26Å; S339-I342 PolarHBondContact O-N 3.06Å; S339-I342 PolarHBondContact OG-N 2.91Å; S339-K343 WeakPolarHBondContact O-CG 3.13Å; S339-K343 PolarHBondContact O-N 3.29Å
340	D	97.6	Very high	96.7	Very high	106 Å²	106	55.9 Å²	55.9	57%	0.567	30%	0.299	S	S	*	.	H	α-helix	trans	-67.4	-31.7	174.7	-61	-37	0	0	0	111.3	I342 K343 E344	D340-I342 PolarHBondContact O-N 3.31Å; D340-K343 WeakPolarHBondContact O-CB 3.38Å; D340-K343 PolarHBondContact O-N 3.09Å; D340-K343 IonicContact OD1-NZ 3.28Å; D340-K343 PolarHBondContact OD1-NZ 2.96Å; D340-E344 WeakPolarHBondContact O-CG 3.25Å; D340-E344 PolarHBondContact O-N 3.15Å
341	A	97.3	Very high	96.7	Very high	48 Å²	48	49.4 Å²	49.4	40%	0.397	28%	0.278	S	S	.	.	H	α-helix	trans	-58.4	-44.7	175.8	0	0	0	0	0	112.8	F251 S339 A345	F251-A341 HydrophobicContact CD2-CB 3.85Å; F251-A341 HydrophobicContact CE2-CB 3.82Å; S339-A341 VanDerWaalsContact C-N 3.25Å; S339-A341 PolarHBondContact O-N 3.45Å; A341-A345 WeakPolarHBondContact O-CB 3.43Å; A341-A345 PolarHBondContact O-N 3.11Å; A341-A345 VanDerWaalsContact O-N 3.12Å
342	I	98.1	Very high	96.7	Very high	0 Å²	0	51.6 Å²	51.6	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-71.2	-36.7	177	-168.7	67	0	0	0	111.6	F251 E254 K255 V258 F338 S339 D340 A345 V346	F251-I342 HydrophobicContact CD2-CB 4.38Å; F251-I342 HydrophobicContact CE2-CB 4.27Å; F251-I342 HydrophobicContact CE2-CD1 4.27Å; E254-I342 HydrophobicContact CB-CB 4.04Å; E254-I342 HydrophobicContact CB-CD1 4.39Å; E254-I342 HydrophobicContact CB-CG1 3.97Å; E254-I342 HydrophobicContact CB-CG2 4.08Å; E254-I342 HydrophobicContact CG-CG2 4.36Å; E254-I342 VanDerWaalsContact OE2-CG2 3.26Å; E254-I342 WeakPolarHBondContact OE2-CG2 3.46Å; K255-I342 HydrophobicContact CG-CD1 3.88Å; V258-I342 HydrophobicContact CG2-CD1 4.27Å; V258-I342 HydrophobicContact CG2-CG1 4.08Å; F338-I342 HydrophobicContact CB-CG2 3.86Å; F338-I342 HydrophobicContact CD1-CG2 3.93Å; F338-I342 HydrophobicContact CG-CG2 4.31Å; S339-I342 VanDerWaalsContact O-CG2 3.25Å; S339-I342 WeakPolarHBondContact O-CG2 3.26Å; S339-I342 PolarHBondContact O-N 3.06Å; S339-I342 PolarHBondContact OG-N 2.91Å; D340-I342 PolarHBondContact O-N 3.31Å; I342-A345 PolarHBondContact O-N 3.45Å; I342-V346 HydrophobicContact CD1-CG1 3.85Å; I342-V346 HydrophobicContact CG1-CG1 4.41Å; I342-V346 HydrophobicContact CG1-CG2 4.44Å; I342-V346 WeakPolarHBondContact O-CG2 3.1Å; I342-V346 PolarHBondContact O-N 3.14Å
343	K	98	Very high	96.5	Very high	28 Å²	28	49.7 Å²	49.7	12%	0.122	27%	0.274	C	S	.	.	H	α-helix	trans	-59.9	-50.5	176.3	-66.3	171.8	-150.2	162.8	0	110.4	F338 S339 D340 A345 V346 L347 L396 S399	F338-K343 WeakPolarHBondContact O-CE 3.42Å; F338-K343 PolarHBondContact O-NZ 3.04Å; S339-K343 WeakPolarHBondContact O-CG 3.13Å; S339-K343 PolarHBondContact O-N 3.29Å; D340-K343 WeakPolarHBondContact O-CB 3.38Å; D340-K343 PolarHBondContact O-N 3.09Å; D340-K343 IonicContact OD1-NZ 3.28Å; D340-K343 PolarHBondContact OD1-NZ 2.96Å; K343-A345 VanDerWaalsContact C-N 3.26Å; K343-A345 PolarHBondContact O-N 3.4Å; K343-V346 PolarHBondContact O-N 2.99Å; K343-L347 WeakPolarHBondContact O-CA 3.42Å; K343-L347 WeakPolarHBondContact O-CB 3.27Å; K343-L347 PolarHBondContact O-N 2.85Å; K343-L396 HydrophobicContact CG-CB 4.44Å; K343-L396 HydrophobicContact CG-CD2 4.03Å; K343-S399 PolarHBondContact NZ-OG 2.87Å
344	E	97.4	Very high	96.5	Very high	151 Å²	151	54.6 Å²	54.6	71%	0.706	30%	0.296	S	S	*	.	H	α-helix	trans	-59.5	-37.9	177.8	-71.8	174.9	-175.1	0	0	112.1	D340 P348	D340-E344 WeakPolarHBondContact O-CG 3.25Å; D340-E344 PolarHBondContact O-N 3.15Å; E344-P348 WeakPolarHBondContact O-CD 3.21Å
345	A	97.5	Very high	96.5	Very high	47 Å²	47	55.5 Å²	55.5	39%	0.388	30%	0.3	S	S	.	.	H	α-helix	trans	-69.7	-40.9	-179.1	0	0	0	0	0	113.7	A341 I342 K343	A341-A345 WeakPolarHBondContact O-CB 3.43Å; A341-A345 PolarHBondContact O-N 3.11Å; A341-A345 VanDerWaalsContact O-N 3.12Å; I342-A345 PolarHBondContact O-N 3.45Å; K343-A345 VanDerWaalsContact C-N 3.26Å; K343-A345 PolarHBondContact O-N 3.4Å
346	V	97.8	Very high	96.5	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-114.4	-26.2	-168.3	-49	0	0	0	0	114.6	L164 V258 I342 K343 L349 L350 L396	L164-V346 HydrophobicContact CD2-CG1 4Å; V258-V346 HydrophobicContact CG1-CG1 4.37Å; V258-V346 HydrophobicContact CG2-CG2 4.33Å; I342-V346 HydrophobicContact CD1-CG1 3.85Å; I342-V346 HydrophobicContact CG1-CG1 4.41Å; I342-V346 HydrophobicContact CG1-CG2 4.44Å; I342-V346 WeakPolarHBondContact O-CG2 3.1Å; I342-V346 PolarHBondContact O-N 3.14Å; K343-V346 PolarHBondContact O-N 2.99Å; V346-L349 PolarHBondContact O-N 3.27Å; V346-L350 HydrophobicContact CB-CD1 4.13Å; V346-L350 HydrophobicContact CB-CG 4.49Å; V346-L350 HydrophobicContact CG2-CD1 3.95Å; V346-L350 WeakPolarHBondContact O-CB 3.43Å; V346-L350 WeakPolarHBondContact O-CG 3.45Å; V346-L350 PolarHBondContact O-N 2.99Å; V346-L396 HydrophobicContact CG2-CD1 3.56Å
347	L	96.7	Very high	96.4	Very high	39 Å²	39	47 Å²	47	20%	0.204	26%	0.264	C	S	.	.	H	α-helix	trans	-63.3	-40.4	-174.5	-172.4	64.3	0	0	0	113.4	K343 L349 S351 V393 L396 R397	K343-L347 WeakPolarHBondContact O-CA 3.42Å; K343-L347 WeakPolarHBondContact O-CB 3.27Å; K343-L347 PolarHBondContact O-N 2.85Å; L347-L349 VanDerWaalsContact C-N 3.32Å; L347-L349 PolarHBondContact O-N 3.28Å; L347-S351 VanDerWaalsContact O-CB 3.23Å; L347-S351 WeakPolarHBondContact O-CB 3.3Å; L347-S351 PolarHBondContact O-N 2.9Å; L347-S351 PolarHBondContact O-OG 3.16Å; L347-V393 HydrophobicContact CD1-CG1 4.04Å; L347-L396 HydrophobicContact CD1-CB 4.09Å; L347-L396 HydrophobicContact CD1-CD1 4.37Å; L347-R397 HydrophobicContact CD1-CG 4.07Å; L347-R397 HydrophobicContact CD2-CG 4.15Å
348	P	97.1	Very high	96.2	Very high	86 Å²	86	45.1 Å²	45.1	56%	0.558	25%	0.252	S	S	*	.	H	α-helix	trans	-61.4	-39.8	175.7	-24.2	35.5	0	0	0	112.6	E344 D352	E344-P348 WeakPolarHBondContact O-CD 3.21Å; P348-D352 PolarHBondContact O-N 2.98Å
349	L	97	Very high	96.1	Very high	45 Å²	45	45.2 Å²	45.2	24%	0.236	25%	0.253	C	S	.	.	H	α-helix	trans	-71.5	-46.2	179.8	-60.1	177.1	0	0	0	111.6	L162 V346 L347 S351 D352 F355	L162-L349 HydrophobicContact CD2-CB 4.21Å; L162-L349 HydrophobicContact CD2-CD1 4.2Å; V346-L349 PolarHBondContact O-N 3.27Å; L347-L349 VanDerWaalsContact C-N 3.32Å; L347-L349 PolarHBondContact O-N 3.28Å; L349-S351 VanDerWaalsContact C-N 3.33Å; L349-S351 PolarHBondContact O-N 2.97Å; L349-D352 PolarHBondContact O-N 3.08Å; L349-F355 HydrophobicContact CB-CD1 4.15Å; L349-F355 HydrophobicContact CB-CD2 4.44Å; L349-F355 HydrophobicContact CB-CE1 4.06Å; L349-F355 HydrophobicContact CB-CE2 4.35Å; L349-F355 HydrophobicContact CB-CG 4.35Å; L349-F355 HydrophobicContact CB-CZ 4.16Å; L349-F355 HydrophobicContact CD2-CD2 4.14Å; L349-F355 HydrophobicContact CD2-CE2 4.2Å; L349-F355 WeakPolarHBondContact O-CD1 3.41Å; L349-F355 WeakPolarHBondContact O-CG 3.47Å
350	L	96.6	Very high	96.1	Very high	6 Å²	6	44.8 Å²	44.8	3%	0.031	25%	0.249	C	C	.	.	H	α-helix	trans	-74.5	-23.1	-176.6	-66	178.7	0	0	0	113.4	L162 L262 V346 I356 L392 V393 L396	L162-L350 HydrophobicContact CD2-CD2 3.8Å; L162-L350 HydrophobicContact CD2-CG 4.24Å; L262-L350 HydrophobicContact CD1-CD1 4.41Å; L262-L350 HydrophobicContact CD1-CD2 3.84Å; L262-L350 HydrophobicContact CD2-CD2 4.25Å; V346-L350 HydrophobicContact CB-CD1 4.13Å; V346-L350 HydrophobicContact CB-CG 4.49Å; V346-L350 HydrophobicContact CG2-CD1 3.95Å; V346-L350 WeakPolarHBondContact O-CB 3.43Å; V346-L350 WeakPolarHBondContact O-CG 3.45Å; V346-L350 PolarHBondContact O-N 2.99Å; L350-I356 HydrophobicContact CD2-CD1 4.2Å; L350-L392 HydrophobicContact CD1-CD2 3.55Å; L350-L392 HydrophobicContact CD1-CG 4.06Å; L350-V393 HydrophobicContact CB-CG2 3.69Å; L350-L396 HydrophobicContact CD1-CD1 4.37Å
351	S	94.5	Very high	96	Very high	26 Å²	26	46.4 Å²	46.4	18%	0.182	25%	0.247	C	C	.	.	H	α-helix	trans	-79.9	-18.1	173.6	-57.9	0	0	0	0	112.6	L347 L349 R397 L527	L347-S351 VanDerWaalsContact O-CB 3.23Å; L347-S351 WeakPolarHBondContact O-CB 3.3Å; L347-S351 PolarHBondContact O-N 2.9Å; L347-S351 PolarHBondContact O-OG 3.16Å; L349-S351 VanDerWaalsContact C-N 3.33Å; L349-S351 PolarHBondContact O-N 2.97Å; S351-R397 PolarHBondContact OG-NH2 3.31Å; S351-R397 VanDerWaalsContact OG-NH2 3.12Å; S351-L527 WeakPolarHBondContact O-CD1 3.25Å
352	D	93.9	Very high	95.9	Very high	66 Å²	66	46.3 Å²	46.3	35%	0.353	24%	0.24	S	C	.	.			trans	-84.7	115.9	179.7	174.7	21.5	0	0	0	112	P348 L349 H354 F355 I356	P348-D352 PolarHBondContact O-N 2.98Å; L349-D352 PolarHBondContact O-N 3.08Å; D352-H354 VanDerWaalsContact C-N 3.31Å; D352-H354 PolarHBondContact O-N 3.23Å; D352-H354 WeakPolarHBondContact OD1-CB 3.49Å; D352-H354 IonicContact OD1-CD2 2.8Å; D352-H354 IonicContact OD1-CG 3.89Å; D352-H354 PolarHBondContact OD1-N 2.92Å; D352-F355 HydrophobicContact CB-CB 3.94Å; D352-F355 WeakPolarHBondContact O-CB 3.13Å; D352-F355 PolarHBondContact O-N 2.99Å; D352-F355 WeakPolarHBondContact OD2-CB 3.37Å; D352-F355 PolarHBondContact OD2-N 2.99Å; D352-I356 WeakPolarHBondContact O-CG1 3.12Å; D352-I356 PolarHBondContact O-N 3.38Å; D352-I356 VanDerWaalsContact O-N 3.13Å
353	M	90.4	Very high	95.9	Very high	49 Å²	49	46.3 Å²	46.3	24%	0.241	24%	0.24	C	C	.	.	H	α-helix	trans	-65.5	-33.2	177.9	-169.4	60.1	67.2	0	0	112.5	I356 N357	M353-I356 PolarHBondContact O-N 2.93Å; M353-N357 WeakPolarHBondContact O-CB 3.49Å; M353-N357 PolarHBondContact O-N 3.4Å; M353-N357 PolarHBondContact O-ND2 3.18Å
354	H	93.8	Very high	95.8	Very high	138 Å²	138	47.7 Å²	47.7	64%	0.639	25%	0.247	S	C	*	.	H	α-helix	trans	-66.2	-43	177.2	-65.7	-66.8	0	0	0	110.8	D352 N357 S358	D352-H354 VanDerWaalsContact C-N 3.31Å; D352-H354 PolarHBondContact O-N 3.23Å; D352-H354 WeakPolarHBondContact OD1-CB 3.49Å; D352-H354 IonicContact OD1-CD2 2.8Å; D352-H354 IonicContact OD1-CG 3.89Å; D352-H354 PolarHBondContact OD1-N 2.92Å; H354-N357 PolarHBondContact O-N 3.41Å; H354-S358 VanDerWaalsContact O-CB 3.24Å; H354-S358 WeakPolarHBondContact O-CB 3.1Å; H354-S358 PolarHBondContact O-N 2.9Å
355	F	96.5	Very high	95.7	Very high	19 Å²	19	43.2 Å²	43.2	8%	0.083	23%	0.228	C	C	.	.	H	α-helix	trans	-56.1	-50	171.6	175.3	-93.9	0	0	0	111.9	R161 L162 L349 D352 N357 S358 L359	R161-F355 HydrophobicContact CB-CE2 4.37Å; R161-F355 HydrophobicContact CB-CZ 4.12Å; R161-F355 WeakPolarHBondContact O-CE2 3.38Å; R161-F355 WeakPolarHBondContact O-CZ 3.35Å; L162-F355 HydrophobicContact CD2-CE1 3.71Å; L162-F355 HydrophobicContact CD2-CZ 3.68Å; L162-F355 HydrophobicContact CG-CZ 4.22Å; L349-F355 HydrophobicContact CB-CD1 4.15Å; L349-F355 HydrophobicContact CB-CD2 4.44Å; L349-F355 HydrophobicContact CB-CE1 4.06Å; L349-F355 HydrophobicContact CB-CE2 4.35Å; L349-F355 HydrophobicContact CB-CG 4.35Å; L349-F355 HydrophobicContact CB-CZ 4.16Å; L349-F355 HydrophobicContact CD2-CD2 4.14Å; L349-F355 HydrophobicContact CD2-CE2 4.2Å; L349-F355 WeakPolarHBondContact O-CD1 3.41Å; L349-F355 WeakPolarHBondContact O-CG 3.47Å; D352-F355 HydrophobicContact CB-CB 3.94Å; D352-F355 WeakPolarHBondContact O-CB 3.13Å; D352-F355 PolarHBondContact O-N 2.99Å; D352-F355 WeakPolarHBondContact OD2-CB 3.37Å; D352-F355 PolarHBondContact OD2-N 2.99Å; F355-N357 PolarHBondContact O-N 2.9Å; F355-S358 WeakPolarHBondContact O-CB 3.47Å; F355-S358 PolarHBondContact O-N 2.96Å; F355-L359 PolarHBondContact O-N 2.87Å
356	I	95.8	Very high	95.6	Very high	6 Å²	6	41.9 Å²	41.9	3%	0.031	21%	0.214	C	C	.	.	H	α-helix	trans	-61.7	-44.5	-179.9	-63.5	-60	0	0	0	111.7	L350 D352 M353 S358 L359 V360 R386 V389	L350-I356 HydrophobicContact CD2-CD1 4.2Å; D352-I356 WeakPolarHBondContact O-CG1 3.12Å; D352-I356 PolarHBondContact O-N 3.38Å; D352-I356 VanDerWaalsContact O-N 3.13Å; M353-I356 PolarHBondContact O-N 2.93Å; I356-S358 VanDerWaalsContact C-N 3.3Å; I356-S358 PolarHBondContact O-N 3.42Å; I356-L359 PolarHBondContact O-N 3.03Å; I356-V360 WeakPolarHBondContact O-CG2 3.22Å; I356-V360 PolarHBondContact O-N 2.71Å; I356-R386 HydrophobicContact CG2-CG 4.3Å; I356-V389 HydrophobicContact CD1-CG1 3.92Å; I356-V389 HydrophobicContact CD1-CG2 3.87Å; I356-V389 HydrophobicContact CG1-CG1 4.26Å
357	N	93.8	Very high	95.5	Very high	30 Å²	30	42 Å²	42	16%	0.16	21%	0.214	C	C	.	.	H	α-helix	trans	-65.4	-34.8	177.1	-76.1	-28.3	0	0	0	112.2	M353 H354 F355 V360 R361	M353-N357 WeakPolarHBondContact O-CB 3.49Å; M353-N357 PolarHBondContact O-N 3.4Å; M353-N357 PolarHBondContact O-ND2 3.18Å; H354-N357 PolarHBondContact O-N 3.41Å; F355-N357 PolarHBondContact O-N 2.9Å; N357-V360 PolarHBondContact O-N 3.24Å; N357-R361 PolarHBondContact O-N 2.73Å
358	S	95.4	Very high	95.4	Very high	31 Å²	31	45.4 Å²	45.4	22%	0.217	23%	0.227	C	C	.	.	H	α-helix	trans	-65.2	-45.1	173.3	-161.7	0	0	0	0	111.9	R161 H354 F355 I356 V360 R361 D362	R161-S358 PolarHBondContact NH2-OG 2.91Å; H354-S358 VanDerWaalsContact O-CB 3.24Å; H354-S358 WeakPolarHBondContact O-CB 3.1Å; H354-S358 PolarHBondContact O-N 2.9Å; F355-S358 WeakPolarHBondContact O-CB 3.47Å; F355-S358 PolarHBondContact O-N 2.96Å; I356-S358 VanDerWaalsContact C-N 3.3Å; I356-S358 PolarHBondContact O-N 3.42Å; S358-V360 PolarHBondContact O-N 3.21Å; S358-R361 WeakPolarHBondContact O-CB 3.21Å; S358-R361 PolarHBondContact O-N 3.46Å; S358-D362 PolarHBondContact O-N 3.42Å; S358-D362 VanDerWaalsContact O-N 3.1Å
359	L	96.5	Very high	95.2	Very high	4 Å²	4	42.9 Å²	42.9	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-43.4	174.4	176.3	63.4	0	0	0	112.1	L157 V158 R161 F355 I356 R361 D362 L363	L157-L359 HydrophobicContact CD2-CD1 3.57Å; V158-L359 HydrophobicContact CG2-CD1 4.11Å; V158-L359 HydrophobicContact CG2-CD2 4.5Å; R161-L359 HydrophobicContact CB-CD1 3.99Å; R161-L359 HydrophobicContact CG-CD1 3.87Å; F355-L359 PolarHBondContact O-N 2.87Å; I356-L359 PolarHBondContact O-N 3.03Å; L359-R361 VanDerWaalsContact C-N 3.32Å; L359-R361 PolarHBondContact O-N 2.75Å; L359-D362 PolarHBondContact O-N 3.01Å; L359-L363 HydrophobicContact CG-CD1 4.3Å; L359-L363 WeakPolarHBondContact O-CG 3.38Å; L359-L363 PolarHBondContact O-N 3.22Å
360	V	96.5	Very high	94.9	Very high	15 Å²	15	41.2 Å²	41.2	9%	0.091	20%	0.201	C	C	.	.	H	α-helix	trans	-62.1	-39.3	176.8	169.1	0	0	0	0	111.4	I356 N357 S358 D362 L363 H364 F378 M382	I356-V360 WeakPolarHBondContact O-CG2 3.22Å; I356-V360 PolarHBondContact O-N 2.71Å; N357-V360 PolarHBondContact O-N 3.24Å; S358-V360 PolarHBondContact O-N 3.21Å; V360-D362 VanDerWaalsContact C-N 3.34Å; V360-L363 PolarHBondContact O-N 2.68Å; V360-H364 WeakPolarHBondContact O-CB 2.97Å; V360-H364 PolarHBondContact O-N 3.33Å; V360-F378 HydrophobicContact CG1-CE1 4.32Å; V360-F378 HydrophobicContact CG1-CZ 4.34Å; V360-M382 HydrophobicContact CB-SD 4.34Å; V360-M382 HydrophobicContact CG1-CB 4.37Å; V360-M382 HydrophobicContact CG1-CG 3.84Å; V360-M382 HydrophobicContact CG1-SD 3.98Å; V360-M382 HydrophobicContact CG2-CG 4.44Å; V360-M382 HydrophobicContact CG2-SD 3.95Å
361	R	95.9	Very high	94.6	Very high	141 Å²	141	46.8 Å²	46.8	53%	0.532	24%	0.237	S	C	.	.	H	α-helix	trans	-63.4	-40.3	176.1	-169.3	-175.2	-57	105.4	0.5	111.9	N357 S358 L359 H364 N365	N357-R361 PolarHBondContact O-N 2.73Å; S358-R361 WeakPolarHBondContact O-CB 3.21Å; S358-R361 PolarHBondContact O-N 3.46Å; L359-R361 VanDerWaalsContact C-N 3.32Å; L359-R361 PolarHBondContact O-N 2.75Å; R361-H364 WeakPolarHBondContact O-CB 3.37Å; R361-H364 PolarHBondContact O-N 3.11Å; R361-N365 PolarHBondContact O-N 2.87Å; R361-N365 PolarHBondContact O-ND2 3.05Å
362	D	95.8	Very high	94.2	Very high	46 Å²	46	47.9 Å²	47.9	25%	0.246	25%	0.253	C	S	.	.	H	α-helix	trans	-67.7	-43.5	177.5	-70.6	-2.7	0	0	0	112	L157 R161 S358 L359 V360 H364 N365 L366	L157-D362 HydrophobicContact CD1-CB 4.06Å; L157-D362 HydrophobicContact CD2-CB 3.93Å; R161-D362 IonicContact CZ-OD2 3.3Å; R161-D362 IonicContact NE-OD2 2.75Å; R161-D362 PolarHBondContact NE-OD2 3.19Å; R161-D362 IonicContact NH2-OD1 3.95Å; R161-D362 IonicContact NH2-OD2 2.71Å; R161-D362 PolarHBondContact NH2-OD2 3.26Å; S358-D362 PolarHBondContact O-N 3.42Å; S358-D362 VanDerWaalsContact O-N 3.1Å; L359-D362 PolarHBondContact O-N 3.01Å; V360-D362 VanDerWaalsContact C-N 3.34Å; D362-H364 VanDerWaalsContact C-N 3.29Å; D362-H364 PolarHBondContact O-N 3.38Å; D362-N365 PolarHBondContact O-N 3.41Å; D362-L366 PolarHBondContact O-N 3.31Å
363	L	96.9	Very high	94.1	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-61.2	-38.6	173	-72.4	172	0	0	0	111.6	L157 V158 F313 L359 V360 L366 F367 F378 M382 L385	L157-L363 HydrophobicContact CD2-CD2 4.15Å; L157-L363 HydrophobicContact CD2-CG 4.26Å; V158-L363 HydrophobicContact CG2-CD1 4.41Å; V158-L363 HydrophobicContact CG2-CD2 4.38Å; F313-L363 HydrophobicContact CE1-CD1 4.04Å; F313-L363 HydrophobicContact CE1-CD2 4.07Å; F313-L363 HydrophobicContact CZ-CD2 4.13Å; L359-L363 HydrophobicContact CG-CD1 4.3Å; L359-L363 WeakPolarHBondContact O-CG 3.38Å; L359-L363 PolarHBondContact O-N 3.22Å; V360-L363 PolarHBondContact O-N 2.68Å; L363-L366 PolarHBondContact O-N 3.26Å; L363-F367 HydrophobicContact CD2-CE1 4.28Å; L363-F367 HydrophobicContact CD2-CZ 4.48Å; L363-F367 WeakPolarHBondContact O-CB 3.34Å; L363-F367 WeakPolarHBondContact O-CD1 3.25Å; L363-F367 WeakPolarHBondContact O-CG 3.29Å; L363-F367 PolarHBondContact O-N 3.37Å; L363-F378 HydrophobicContact CB-CE2 4.3Å; L363-F378 HydrophobicContact CB-CZ 4.4Å; L363-M382 HydrophobicContact CB-SD 4.37Å; L363-M382 HydrophobicContact CD1-CE 4.17Å; L363-M382 HydrophobicContact CD1-SD 4.02Å; L363-L385 HydrophobicContact CD1-CD1 3.82Å
364	H	96.4	Very high	94.2	Very high	56 Å²	56	48.6 Å²	48.6	26%	0.259	26%	0.255	S	S	.	.	H	α-helix	trans	-61.2	-45.7	173.8	178.8	-100.9	0	0	0	111.3	V360 R361 D362 L366 F367 K368 F373 F378	V360-H364 WeakPolarHBondContact O-CB 2.97Å; V360-H364 PolarHBondContact O-N 3.33Å; R361-H364 WeakPolarHBondContact O-CB 3.37Å; R361-H364 PolarHBondContact O-N 3.11Å; D362-H364 VanDerWaalsContact C-N 3.29Å; D362-H364 PolarHBondContact O-N 3.38Å; H364-L366 VanDerWaalsContact C-N 3.27Å; H364-L366 PolarHBondContact O-N 3.37Å; H364-F367 PolarHBondContact O-N 3.45Å; H364-K368 VanDerWaalsContact O-CB 3.31Å; H364-K368 WeakPolarHBondContact O-CB 3.35Å; H364-K368 WeakPolarHBondContact O-CG 3.31Å; H364-K368 PolarHBondContact O-N 3.26Å; H364-F373 AromaticContact CD2-CZ 3.72Å; H364-F373 AromaticContact NE2-CZ 3.85Å; H364-F378 VanDerWaalsContact CA-CZ 3.4Å; H364-F378 HydrophobicContact CB-CE1 3.71Å; H364-F378 HydrophobicContact CB-CE2 4.22Å; H364-F378 HydrophobicContact CB-CZ 3.47Å; H364-F378 VanDerWaalsContact CB-CZ 3.47Å; H364-F378 AromaticContact CD2-CD1 3.87Å; H364-F378 AromaticContact CD2-CE1 3.73Å
365	N	95.1	Very high	94.2	Very high	58 Å²	58	45.9 Å²	45.9	31%	0.31	25%	0.245	S	C	.	.	H	α-helix	trans	-63.7	-31.5	177.4	-74.1	-28.3	0	0	0	113.3	R361 D362 K368	R361-N365 PolarHBondContact O-N 2.87Å; R361-N365 PolarHBondContact O-ND2 3.05Å; D362-N365 PolarHBondContact O-N 3.41Å; N365-K368 WeakPolarHBondContact O-CG 3.38Å; N365-K368 PolarHBondContact OD1-NZ 3.13Å
366	L	95.3	Very high	94.1	Very high	18 Å²	18	48 Å²	48	9%	0.094	26%	0.262	C	S	.	.	H	α-helix	trans	-75.2	-47.8	173.8	178.9	63.7	0	0	0	111.9	L150 A153 L157 V172 D362 L363 H364 I369	L150-L366 HydrophobicContact CD2-CD1 4.29Å; L150-L366 HydrophobicContact CD2-CG 4.28Å; L150-L366 WeakPolarHBondContact CD2-O 3.49Å; A153-L366 HydrophobicContact CB-CD1 4.08Å; A153-L366 HydrophobicContact CB-CD2 3.96Å; L157-L366 HydrophobicContact CD1-CB 4.42Å; L157-L366 HydrophobicContact CD1-CD2 4.16Å; V172-L366 HydrophobicContact CG2-CD1 3.83Å; D362-L366 PolarHBondContact O-N 3.31Å; L363-L366 PolarHBondContact O-N 3.26Å; H364-L366 VanDerWaalsContact C-N 3.27Å; H364-L366 PolarHBondContact O-N 3.37Å; L366-I369 HydrophobicContact CD1-CD1 3.97Å; L366-I369 WeakPolarHBondContact O-CB 3.33Å; L366-I369 VanDerWaalsContact O-CD1 3.23Å; L366-I369 WeakPolarHBondContact O-CD1 3.47Å; L366-I369 WeakPolarHBondContact O-CG1 3.35Å; L366-I369 PolarHBondContact O-N 3.39Å
367	F	95.6	Very high	94	Very high	3 Å²	3	49.2 Å²	49.2	1%	0.013	27%	0.269	C	S	.	.	H	α-helix	trans	-75.4	-29.2	-171.3	-74.5	18	0	0	0	112.2	L150 F313 L363 H364 I369 D370 F373 F378	L150-F367 HydrophobicContact CB-CD1 4.06Å; L150-F367 HydrophobicContact CB-CE1 4.11Å; L150-F367 HydrophobicContact CD1-CB 4.36Å; L150-F367 HydrophobicContact CD1-CD1 4.36Å; L150-F367 HydrophobicContact CD1-CG 4.42Å; F313-F367 HydrophobicContact CB-CE2 4.19Å; F313-F367 HydrophobicContact CB-CZ 4.19Å; F313-F367 HydrophobicContact CD1-CZ 4.16Å; F313-F367 AromaticContact CD2-CZ 3.87Å; F313-F367 HydrophobicContact CD2-CZ 3.87Å; F313-F367 HydrophobicContact CE2-CZ 4.29Å; F313-F367 HydrophobicContact CG-CE2 4.24Å; F313-F367 AromaticContact CG-CZ 3.81Å; F313-F367 HydrophobicContact CG-CZ 3.81Å; L363-F367 HydrophobicContact CD2-CE1 4.28Å; L363-F367 HydrophobicContact CD2-CZ 4.48Å; L363-F367 WeakPolarHBondContact O-CB 3.34Å; L363-F367 WeakPolarHBondContact O-CD1 3.25Å; L363-F367 WeakPolarHBondContact O-CG 3.29Å; L363-F367 PolarHBondContact O-N 3.37Å; H364-F367 PolarHBondContact O-N 3.45Å; F367-I369 PolarHBondContact O-N 3.48Å; F367-I369 VanDerWaalsContact O-N 3.11Å; F367-D370 PolarHBondContact O-N 3.02Å; F367-D370 VanDerWaalsContact O-N 3.15Å; F367-F373 VanDerWaalsContact C-CD2 3.45Å; F367-F373 HydrophobicContact CB-CD2 3.99Å; F367-F373 HydrophobicContact CB-CE2 3.82Å; F367-F373 VanDerWaalsContact O-CD2 3.29Å; F367-F373 WeakPolarHBondContact O-CD2 3.44Å; F367-F378 HydrophobicContact CB-CD2 4.18Å; F367-F378 HydrophobicContact CB-CE2 4.31Å; F367-F378 AromaticContact CD2-CD2 3.79Å; F367-F378 HydrophobicContact CD2-CD2 3.79Å; F367-F378 AromaticContact CD2-CE2 3.96Å; F367-F378 HydrophobicContact CD2-CE2 3.96Å; F367-F378 HydrophobicContact CG-CD2 4.34Å; F367-F378 HydrophobicContact CG-CE2 4.31Å
368	K	94.6	Very high	94.1	Very high	110 Å²	110	48 Å²	48	48%	0.478	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.6	175.6	77.4	-175	-173.1	-172.3	0	114.3	H364 N365 D370 F373	H364-K368 VanDerWaalsContact O-CB 3.31Å; H364-K368 WeakPolarHBondContact O-CB 3.35Å; H364-K368 WeakPolarHBondContact O-CG 3.31Å; H364-K368 PolarHBondContact O-N 3.26Å; N365-K368 WeakPolarHBondContact O-CG 3.38Å; N365-K368 PolarHBondContact OD1-NZ 3.13Å; K368-D370 PolarHBondContact O-N 3.48Å; K368-F373 HydrophobicContact CB-CD1 4.21Å; K368-F373 HydrophobicContact CB-CE1 4.25Å; K368-F373 HydrophobicContact CB-CG 4.37Å; K368-F373 HydrophobicContact CB-CZ 4.43Å
369	I	92.1	Very high	94	Very high	34 Å²	34	50.2 Å²	50.2	17%	0.174	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-30.3	173.7	-61	170.2	0	0	0	110.6	V60 N61 I216 L366 F367 P371	V60-I369 HydrophobicContact CG1-CD1 4.31Å; V60-I369 HydrophobicContact CG1-CG2 3.57Å; N61-I369 WeakPolarHBondContact ND2-CD1 3.49Å; I216-I369 HydrophobicContact CD1-CG2 4.13Å; L366-I369 HydrophobicContact CD1-CD1 3.97Å; L366-I369 WeakPolarHBondContact O-CB 3.33Å; L366-I369 VanDerWaalsContact O-CD1 3.23Å; L366-I369 WeakPolarHBondContact O-CD1 3.47Å; L366-I369 WeakPolarHBondContact O-CG1 3.35Å; L366-I369 PolarHBondContact O-N 3.39Å; F367-I369 PolarHBondContact O-N 3.48Å; F367-I369 VanDerWaalsContact O-N 3.11Å; I369-P371 WeakPolarHBondContact O-CD 3.39Å
370	D	91.5	Very high	94	Very high	10 Å²	10	55 Å²	55	5%	0.053	29%	0.29	C	S	.	.	S	Bend	trans	-72.4	131.2	-176.9	-159.6	-92.1	0	0	0	111.7	K113 Y149 L150 F367 K368 G372 F373	K113-D370 WeakPolarHBondContact CE-OD2 3.47Å; K113-D370 IonicContact NZ-OD1 3.1Å; K113-D370 PolarHBondContact NZ-OD1 2.79Å; K113-D370 IonicContact NZ-OD2 3.17Å; K113-D370 PolarHBondContact NZ-OD2 2.96Å; Y149-D370 WeakPolarHBondContact CE1-OD2 3.33Å; Y149-D370 PolarHBondContact OH-OD2 2.91Å; L150-D370 HydrophobicContact CD1-CB 3.72Å; F367-D370 PolarHBondContact O-N 3.02Å; F367-D370 VanDerWaalsContact O-N 3.15Å; K368-D370 PolarHBondContact O-N 3.48Å; D370-G372 PolarHBondContact O-N 3.1Å; D370-G372 VanDerWaalsContact O-N 3.13Å; D370-G372 WeakPolarHBondContact OD1-CA 3.07Å; D370-G372 PolarHBondContact OD1-N 3.12Å; D370-F373 WeakPolarHBondContact O-CB 3.39Å; D370-F373 PolarHBondContact O-N 3.45Å
371	P	89.7	Confident	94	Very high	122 Å²	122	54.8 Å²	54.8	79%	0.792	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.3	174.1	-26.3	34.5	0	0	0	114.3	I369 F373	I369-P371 WeakPolarHBondContact O-CD 3.39Å; P371-F373 VanDerWaalsContact C-N 3.34Å
372	G	87.2	Confident	94	Very high	50 Å²	50	48.1 Å²	48.1	52%	0.515	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.4	18.3	175.8	0	0	0	0	0	113.8	D370 D374	D370-G372 PolarHBondContact O-N 3.1Å; D370-G372 VanDerWaalsContact O-N 3.13Å; D370-G372 WeakPolarHBondContact OD1-CA 3.07Å; D370-G372 PolarHBondContact OD1-N 3.12Å; G372-D374 PolarHBondContact O-N 2.7Å
373	F	92.2	Very high	94	Very high	53 Å²	53	46.5 Å²	46.5	23%	0.232	26%	0.255	C	S	.	.			trans	-63.6	126.5	178.5	178.6	-102	0	0	0	111.6	H364 F367 K368 D370 P371 L375 F378	H364-F373 AromaticContact CD2-CZ 3.72Å; H364-F373 AromaticContact NE2-CZ 3.85Å; F367-F373 VanDerWaalsContact C-CD2 3.45Å; F367-F373 HydrophobicContact CB-CD2 3.99Å; F367-F373 HydrophobicContact CB-CE2 3.82Å; F367-F373 VanDerWaalsContact O-CD2 3.29Å; F367-F373 WeakPolarHBondContact O-CD2 3.44Å; K368-F373 HydrophobicContact CB-CD1 4.21Å; K368-F373 HydrophobicContact CB-CE1 4.25Å; K368-F373 HydrophobicContact CB-CG 4.37Å; K368-F373 HydrophobicContact CB-CZ 4.43Å; D370-F373 WeakPolarHBondContact O-CB 3.39Å; D370-F373 PolarHBondContact O-N 3.45Å; P371-F373 VanDerWaalsContact C-N 3.34Å; F373-L375 HydrophobicContact CE1-CB 4.16Å; F373-L375 HydrophobicContact CE1-CD1 4.23Å; F373-L375 HydrophobicContact CZ-CD1 4.19Å; F373-F378 HydrophobicContact CE2-CB 3.68Å; F373-F378 AromaticContact CE2-CD2 3.88Å; F373-F378 HydrophobicContact CE2-CD2 3.88Å; F373-F378 AromaticContact CE2-CG 3.85Å; F373-F378 HydrophobicContact CE2-CG 3.85Å; F373-F378 HydrophobicContact CZ-CB 3.76Å; F373-F378 HydrophobicContact CZ-CD1 4.43Å; F373-F378 HydrophobicContact CZ-CD2 4.33Å; F373-F378 AromaticContact CZ-CG 3.91Å; F373-F378 HydrophobicContact CZ-CG 3.91Å
374	D	92.6	Very high	94	Very high	76 Å²	76	46.7 Å²	46.7	41%	0.406	26%	0.256	S	S	.	.			trans	-118.2	117.9	171.9	170	44.7	0	0	0	109.8	G372 S376 T377 F378	G372-D374 PolarHBondContact O-N 2.7Å; D374-S376 VanDerWaalsContact C-N 3.28Å; D374-S376 PolarHBondContact O-N 2.97Å; D374-S376 PolarHBondContact OD1-N 3.34Å; D374-T377 PolarHBondContact O-N 3.37Å; D374-T377 WeakPolarHBondContact OD2-CB 3.44Å; D374-T377 PolarHBondContact OD2-N 2.98Å; D374-T377 PolarHBondContact OD2-OG1 3.21Å; D374-F378 PolarHBondContact O-N 3.37Å
375	L	93.7	Very high	94	Very high	82 Å²	82	44.3 Å²	44.3	43%	0.429	25%	0.246	S	C	.	.	H	α-helix	trans	-61.7	-36	-177.5	-177.3	61.9	0	0	0	112.2	F373 F378 H379	F373-L375 HydrophobicContact CE1-CB 4.16Å; F373-L375 HydrophobicContact CE1-CD1 4.23Å; F373-L375 HydrophobicContact CZ-CD1 4.19Å; L375-F378 HydrophobicContact CD1-CD1 4.4Å; L375-F378 WeakPolarHBondContact O-CB 3.22Å; L375-F378 PolarHBondContact O-N 2.9Å; L375-H379 PolarHBondContact O-CD2 3.5Å; L375-H379 PolarHBondContact O-N 3.19Å
376	S	93.6	Very high	94	Very high	63 Å²	63	42.3 Å²	42.3	44%	0.441	23%	0.234	S	C	.	.	H	α-helix	trans	-64.3	-45.9	177.8	157.5	0	0	0	0	111.4	D374 H379 K380	D374-S376 VanDerWaalsContact C-N 3.28Å; D374-S376 PolarHBondContact O-N 2.97Å; D374-S376 PolarHBondContact OD1-N 3.34Å; S376-H379 PolarHBondContact O-N 3.28Å; S376-K380 WeakPolarHBondContact O-CG 3.3Å; S376-K380 PolarHBondContact O-N 2.8Å
377	T	93.2	Very high	94	Very high	31 Å²	31	41.5 Å²	41.5	19%	0.19	23%	0.229	C	C	.	.	H	α-helix	trans	-64.3	-40.6	175.5	-61.4	0	0	0	0	111.4	V144 F315 D374 H379 K380 Q381	V144-T377 HydrophobicContact CG2-CG2 3.45Å; V144-T377 VanDerWaalsContact CG2-CG2 3.45Å; F315-T377 HydrophobicContact CB-CG2 3.91Å; F315-T377 HydrophobicContact CD1-CG2 4.39Å; F315-T377 HydrophobicContact CG-CG2 4.25Å; D374-T377 PolarHBondContact O-N 3.37Å; D374-T377 WeakPolarHBondContact OD2-CB 3.44Å; D374-T377 PolarHBondContact OD2-N 2.98Å; D374-T377 PolarHBondContact OD2-OG1 3.21Å; T377-H379 PolarHBondContact O-N 3.24Å; T377-K380 WeakPolarHBondContact O-CB 3.32Å; T377-K380 PolarHBondContact O-N 2.84Å; T377-K380 VanDerWaalsContact O-N 3.13Å; T377-Q381 WeakPolarHBondContact O-CG 3.14Å; T377-Q381 PolarHBondContact O-N 3.17Å
378	F	95.6	Very high	94.1	Very high	4 Å²	4	41.5 Å²	41.5	2%	0.018	23%	0.23	C	C	.	.	H	α-helix	trans	-57.3	-47	173.4	177.8	-98	0	0	0	112.1	V360 L363 H364 F367 F373 D374 L375 K380 Q381 M382	V360-F378 HydrophobicContact CG1-CE1 4.32Å; V360-F378 HydrophobicContact CG1-CZ 4.34Å; L363-F378 HydrophobicContact CB-CE2 4.3Å; L363-F378 HydrophobicContact CB-CZ 4.4Å; H364-F378 VanDerWaalsContact CA-CZ 3.4Å; H364-F378 HydrophobicContact CB-CE1 3.71Å; H364-F378 HydrophobicContact CB-CE2 4.22Å; H364-F378 HydrophobicContact CB-CZ 3.47Å; H364-F378 VanDerWaalsContact CB-CZ 3.47Å; H364-F378 AromaticContact CD2-CD1 3.87Å; H364-F378 AromaticContact CD2-CE1 3.73Å; F367-F378 HydrophobicContact CB-CD2 4.18Å; F367-F378 HydrophobicContact CB-CE2 4.31Å; F367-F378 AromaticContact CD2-CD2 3.79Å; F367-F378 HydrophobicContact CD2-CD2 3.79Å; F367-F378 AromaticContact CD2-CE2 3.96Å; F367-F378 HydrophobicContact CD2-CE2 3.96Å; F367-F378 HydrophobicContact CG-CD2 4.34Å; F367-F378 HydrophobicContact CG-CE2 4.31Å; F373-F378 HydrophobicContact CE2-CB 3.68Å; F373-F378 AromaticContact CE2-CD2 3.88Å; F373-F378 HydrophobicContact CE2-CD2 3.88Å; F373-F378 AromaticContact CE2-CG 3.85Å; F373-F378 HydrophobicContact CE2-CG 3.85Å; F373-F378 HydrophobicContact CZ-CB 3.76Å; F373-F378 HydrophobicContact CZ-CD1 4.43Å; F373-F378 HydrophobicContact CZ-CD2 4.33Å; F373-F378 AromaticContact CZ-CG 3.91Å; F373-F378 HydrophobicContact CZ-CG 3.91Å; D374-F378 PolarHBondContact O-N 3.37Å; L375-F378 HydrophobicContact CD1-CD1 4.4Å; L375-F378 WeakPolarHBondContact O-CB 3.22Å; L375-F378 PolarHBondContact O-N 2.9Å; F378-K380 PolarHBondContact O-N 3.05Å; F378-Q381 WeakPolarHBondContact O-CB 3.48Å; F378-Q381 PolarHBondContact O-N 3.22Å; F378-Q381 VanDerWaalsContact O-N 3.1Å; F378-M382 HydrophobicContact CD1-CG 4.07Å; F378-M382 HydrophobicContact CD2-CE 4.21Å; F378-M382 HydrophobicContact CD2-CG 4.46Å; F378-M382 HydrophobicContact CE1-CG 3.53Å; F378-M382 HydrophobicContact CE1-SD 4.31Å; F378-M382 HydrophobicContact CE2-CE 3.68Å; F378-M382 HydrophobicContact CE2-CG 4Å; F378-M382 HydrophobicContact CE2-SD 3.93Å; F378-M382 HydrophobicContact CG-CG 4.49Å; F378-M382 HydrophobicContact CZ-CE 4.04Å; F378-M382 HydrophobicContact CZ-CG 3.48Å; F378-M382 VanDerWaalsContact CZ-CG 3.48Å; F378-M382 HydrophobicContact CZ-SD 3.64Å; F378-M382 WeakPolarHBondContact O-CG 3.29Å; F378-M382 PolarHBondContact O-N 2.84Å
379	H	94.9	Very high	94.2	Very high	79 Å²	79	36.8 Å²	36.8	37%	0.366	21%	0.21	S	C	.	.	H	α-helix	trans	-58.8	-36.4	176.4	-74.6	-55.4	0	0	0	112.8	L375 S376 T377 M382 S383	L375-H379 PolarHBondContact O-CD2 3.5Å; L375-H379 PolarHBondContact O-N 3.19Å; S376-H379 PolarHBondContact O-N 3.28Å; T377-H379 PolarHBondContact O-N 3.24Å; H379-M382 PolarHBondContact O-N 3.08Å; H379-S383 WeakPolarHBondContact O-CB 3.38Å; H379-S383 PolarHBondContact O-N 3.05Å; H379-S383 PolarHBondContact O-OG 3.05Å
380	K	95.1	Very high	94.4	Very high	105 Å²	105	36.6 Å²	36.6	46%	0.457	21%	0.21	S	C	.	.	H	α-helix	trans	-67.7	-42	174.5	-65.3	175.4	-176.6	172	0	112.2	F315 S376 T377 F378 M382 S383 V384	F315-K380 HydrophobicContact CB-CB 4.1Å; F315-K380 WeakPolarHBondContact O-CB 3.29Å; S376-K380 WeakPolarHBondContact O-CG 3.3Å; S376-K380 PolarHBondContact O-N 2.8Å; T377-K380 WeakPolarHBondContact O-CB 3.32Å; T377-K380 PolarHBondContact O-N 2.84Å; T377-K380 VanDerWaalsContact O-N 3.13Å; F378-K380 PolarHBondContact O-N 3.05Å; K380-M382 VanDerWaalsContact C-N 3.32Å; K380-M382 PolarHBondContact O-N 2.68Å; K380-S383 WeakPolarHBondContact O-CB 3.29Å; K380-S383 PolarHBondContact O-N 3.48Å; K380-S383 VanDerWaalsContact O-N 3.15Å; K380-V384 PolarHBondContact O-N 3.15Å; K380-V384 VanDerWaalsContact O-N 3.1Å
381	Q	96.3	Very high	94.6	Very high	10 Å²	10	36.5 Å²	36.5	5%	0.047	21%	0.21	C	C	.	.	H	α-helix	trans	-56.9	-46.5	172.7	-65.7	174.7	-66.7	0	0	111.1	F313 F315 T377 F378 S383 V384 L385	F313-Q381 WeakPolarHBondContact O-CG 3.33Å; F313-Q381 PolarHBondContact O-NE2 3.02Å; F315-Q381 HydrophobicContact CB-CG 3.83Å; T377-Q381 WeakPolarHBondContact O-CG 3.14Å; T377-Q381 PolarHBondContact O-N 3.17Å; F378-Q381 WeakPolarHBondContact O-CB 3.48Å; F378-Q381 PolarHBondContact O-N 3.22Å; F378-Q381 VanDerWaalsContact O-N 3.1Å; Q381-S383 VanDerWaalsContact C-N 3.29Å; Q381-S383 PolarHBondContact O-N 2.81Å; Q381-V384 PolarHBondContact O-N 3.44Å; Q381-L385 PolarHBondContact O-N 2.99Å
382	M	96.8	Very high	95	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.7	-28.5	179.1	-59.7	-56.9	104	0	0	112.5	V360 L363 F378 H379 K380 L385 R386	V360-M382 HydrophobicContact CB-SD 4.34Å; V360-M382 HydrophobicContact CG1-CB 4.37Å; V360-M382 HydrophobicContact CG1-CG 3.84Å; V360-M382 HydrophobicContact CG1-SD 3.98Å; V360-M382 HydrophobicContact CG2-CG 4.44Å; V360-M382 HydrophobicContact CG2-SD 3.95Å; L363-M382 HydrophobicContact CB-SD 4.37Å; L363-M382 HydrophobicContact CD1-CE 4.17Å; L363-M382 HydrophobicContact CD1-SD 4.02Å; F378-M382 HydrophobicContact CD1-CG 4.07Å; F378-M382 HydrophobicContact CD2-CE 4.21Å; F378-M382 HydrophobicContact CD2-CG 4.46Å; F378-M382 HydrophobicContact CE1-CG 3.53Å; F378-M382 HydrophobicContact CE1-SD 4.31Å; F378-M382 HydrophobicContact CE2-CE 3.68Å; F378-M382 HydrophobicContact CE2-CG 4Å; F378-M382 HydrophobicContact CE2-SD 3.93Å; F378-M382 HydrophobicContact CG-CG 4.49Å; F378-M382 HydrophobicContact CZ-CE 4.04Å; F378-M382 HydrophobicContact CZ-CG 3.48Å; F378-M382 VanDerWaalsContact CZ-CG 3.48Å; F378-M382 HydrophobicContact CZ-SD 3.64Å; F378-M382 WeakPolarHBondContact O-CG 3.29Å; F378-M382 PolarHBondContact O-N 2.84Å; H379-M382 PolarHBondContact O-N 3.08Å; K380-M382 VanDerWaalsContact C-N 3.32Å; K380-M382 PolarHBondContact O-N 2.68Å; M382-L385 PolarHBondContact O-N 2.91Å; M382-R386 WeakPolarHBondContact O-CB 3.32Å; M382-R386 WeakPolarHBondContact O-CG 3.49Å; M382-R386 PolarHBondContact O-N 3.34Å
383	S	95.7	Very high	95.5	Very high	12 Å²	12	28.9 Å²	28.9	8%	0.084	15%	0.151	C	C	.	.	H	α-helix	trans	-67.5	-36.8	174.1	-56.4	0	0	0	0	111.8	H379 K380 Q381 G387 T412 L413	H379-S383 WeakPolarHBondContact O-CB 3.38Å; H379-S383 PolarHBondContact O-N 3.05Å; H379-S383 PolarHBondContact O-OG 3.05Å; K380-S383 WeakPolarHBondContact O-CB 3.29Å; K380-S383 PolarHBondContact O-N 3.48Å; K380-S383 VanDerWaalsContact O-N 3.15Å; Q381-S383 VanDerWaalsContact C-N 3.29Å; Q381-S383 PolarHBondContact O-N 2.81Å; S383-G387 PolarHBondContact O-N 3.35Å; S383-T412 WeakPolarHBondContact O-CA 3.5Å; S383-L413 VanDerWaalsContact CA-O 3.29Å; S383-L413 WeakPolarHBondContact CA-O 3.37Å; S383-L413 WeakPolarHBondContact CB-O 3.5Å; S383-L413 PolarHBondContact O-N 2.74Å; S383-L413 PolarHBondContact OG-O 3.37Å
384	V	96.1	Very high	95.7	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.024	15%	0.147	C	C	.	.	H	α-helix	trans	-66.2	-50	171.5	175.3	0	0	0	0	110.4	P314 K380 Q381 R386 G387 Q388 T412	P314-V384 HydrophobicContact CG-CG1 4.33Å; K380-V384 PolarHBondContact O-N 3.15Å; K380-V384 VanDerWaalsContact O-N 3.1Å; Q381-V384 PolarHBondContact O-N 3.44Å; V384-R386 PolarHBondContact O-N 2.65Å; V384-G387 WeakPolarHBondContact O-CA 3.29Å; V384-G387 PolarHBondContact O-N 3.27Å; V384-Q388 HydrophobicContact CG1-CG 4.48Å; V384-Q388 WeakPolarHBondContact O-CG 3.43Å; V384-Q388 PolarHBondContact O-N 3.33Å; V384-T412 HydrophobicContact CG2-CG2 4.11Å
385	L	97	Very high	95.9	Very high	7 Å²	7	23.6 Å²	23.6	4%	0.037	13%	0.128	C	C	.	.	H	α-helix	trans	-55.3	-48.8	179.4	-176.9	153	0	0	0	111.5	F313 L363 Q381 M382 G387 Q388 V389	F313-L385 HydrophobicContact CE1-CD1 4.2Å; L363-L385 HydrophobicContact CD1-CD1 3.82Å; Q381-L385 PolarHBondContact O-N 2.99Å; M382-L385 PolarHBondContact O-N 2.91Å; L385-G387 VanDerWaalsContact C-N 3.29Å; L385-G387 PolarHBondContact O-N 3.12Å; L385-Q388 WeakPolarHBondContact O-CB 3.19Å; L385-Q388 PolarHBondContact O-N 2.99Å; L385-Q388 VanDerWaalsContact O-N 3.07Å; L385-V389 HydrophobicContact CD2-CG2 4Å; L385-V389 WeakPolarHBondContact O-CG2 3.05Å; L385-V389 PolarHBondContact O-N 3.4Å
386	R	95.9	Very high	96.1	Very high	16 Å²	16	19.7 Å²	19.7	6%	0.06	11%	0.107	C	C	.	.	H	α-helix	trans	-61.1	-37.8	176.9	-71.7	-175.3	-175.5	101.3	-7.3	112.4	I356 M382 V384 Q388 V389 V390 L413	I356-R386 HydrophobicContact CG2-CG 4.3Å; M382-R386 WeakPolarHBondContact O-CB 3.32Å; M382-R386 WeakPolarHBondContact O-CG 3.49Å; M382-R386 PolarHBondContact O-N 3.34Å; V384-R386 PolarHBondContact O-N 2.65Å; R386-Q388 VanDerWaalsContact C-N 3.34Å; R386-Q388 PolarHBondContact O-N 2.72Å; R386-V389 WeakPolarHBondContact O-CB 3.36Å; R386-V389 PolarHBondContact O-N 2.98Å; R386-V390 WeakPolarHBondContact O-CG2 3.36Å; R386-V390 PolarHBondContact O-N 3.45Å; R386-V390 VanDerWaalsContact O-N 3.09Å; R386-L413 HydrophobicContact CB-CB 3.95Å; R386-L413 HydrophobicContact CB-CD2 4.07Å
387	G	95.3	Very high	96.3	Very high	0 Å²	0	22.8 Å²	22.8	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-61.9	-38.9	172.8	0	0	0	0	0	113.3	S383 V384 L385 N391 L411	S383-G387 PolarHBondContact O-N 3.35Å; V384-G387 WeakPolarHBondContact O-CA 3.29Å; V384-G387 PolarHBondContact O-N 3.27Å; L385-G387 VanDerWaalsContact C-N 3.29Å; L385-G387 PolarHBondContact O-N 3.12Å; G387-N391 PolarHBondContact O-N 3.24Å; G387-L411 WeakPolarHBondContact CA-O 3.44Å
388	Q	96.6	Very high	96.4	Very high	4 Å²	4	26 Å²	26	2%	0.019	13%	0.125	C	C	.	.	H	α-helix	trans	-65.6	-41.9	173.5	-60.1	-67.1	7.8	0	0	111.6	Y261 R264 H317 V384 L385 R386 V390 N391 L392	Y261-Q388 HydrophobicContact CD1-CB 4.01Å; Y261-Q388 HydrophobicContact CE1-CB 4.01Å; Y261-Q388 WeakPolarHBondContact CE1-O 3.5Å; Y261-Q388 VanDerWaalsContact O-CG 3.25Å; Y261-Q388 WeakPolarHBondContact O-CG 3.38Å; Y261-Q388 PolarHBondContact OH-OE1 3.31Å; R264-Q388 HydrophobicContact CB-CG 4.41Å; H317-Q388 PolarHBondContact CE1-NE2 3.17Å; H317-Q388 VanDerWaalsContact CE1-NE2 3.26Å; V384-Q388 HydrophobicContact CG1-CG 4.48Å; V384-Q388 WeakPolarHBondContact O-CG 3.43Å; V384-Q388 PolarHBondContact O-N 3.33Å; L385-Q388 WeakPolarHBondContact O-CB 3.19Å; L385-Q388 PolarHBondContact O-N 2.99Å; L385-Q388 VanDerWaalsContact O-N 3.07Å; R386-Q388 VanDerWaalsContact C-N 3.34Å; R386-Q388 PolarHBondContact O-N 2.72Å; Q388-V390 VanDerWaalsContact C-N 3.34Å; Q388-V390 PolarHBondContact O-N 3.25Å; Q388-N391 PolarHBondContact O-N 2.93Å; Q388-L392 WeakPolarHBondContact O-CB 3.36Å; Q388-L392 PolarHBondContact O-N 2.89Å
389	V	96.9	Very high	96.4	Very high	11 Å²	11	28.4 Å²	28.4	7%	0.067	14%	0.143	C	C	.	.	H	α-helix	trans	-56.3	-49.2	176	173.5	0	0	0	0	110.7	L262 I356 L385 R386 N391 L392 V393	L262-V389 HydrophobicContact CD2-CB 4.31Å; L262-V389 HydrophobicContact CD2-CG2 3.52Å; I356-V389 HydrophobicContact CD1-CG1 3.92Å; I356-V389 HydrophobicContact CD1-CG2 3.87Å; I356-V389 HydrophobicContact CG1-CG1 4.26Å; L385-V389 HydrophobicContact CD2-CG2 4Å; L385-V389 WeakPolarHBondContact O-CG2 3.05Å; L385-V389 PolarHBondContact O-N 3.4Å; R386-V389 WeakPolarHBondContact O-CB 3.36Å; R386-V389 PolarHBondContact O-N 2.98Å; V389-N391 PolarHBondContact O-N 3.22Å; V389-L392 PolarHBondContact O-N 3.48Å; V389-V393 HydrophobicContact CG1-CG2 4.2Å; V389-V393 WeakPolarHBondContact O-CB 3.49Å; V389-V393 WeakPolarHBondContact O-CG2 3.36Å; V389-V393 PolarHBondContact O-N 2.89Å
390	V	95.9	Very high	96.6	Very high	30 Å²	30	27.6 Å²	27.6	18%	0.182	14%	0.138	C	C	.	.	H	α-helix	trans	-57.7	-47.1	179.9	172.9	0	0	0	0	111.6	R386 Q388 A394 L411 L413 L530	R386-V390 WeakPolarHBondContact O-CG2 3.36Å; R386-V390 PolarHBondContact O-N 3.45Å; R386-V390 VanDerWaalsContact O-N 3.09Å; Q388-V390 VanDerWaalsContact C-N 3.34Å; Q388-V390 PolarHBondContact O-N 3.25Å; V390-A394 WeakPolarHBondContact O-CB 3.25Å; V390-A394 PolarHBondContact O-N 2.54Å; V390-A394 VanDerWaalsContact O-N 3.11Å; V390-L411 HydrophobicContact CB-CD1 4.25Å; V390-L411 HydrophobicContact CG1-CD1 3.76Å; V390-L413 HydrophobicContact CG2-CD1 3.97Å; V390-L530 HydrophobicContact CG1-CD1 4.29Å
391	N	96.6	Very high	96.7	Very high	7 Å²	7	22.8 Å²	22.8	4%	0.037	12%	0.117	C	C	.	.	H	α-helix	trans	-64.5	-42.8	178.1	-85.4	-13	0	0	0	112.5	Y261 G387 Q388 V389 A394 A395 L405 M408 P409 L411	Y261-N391 HydrophobicContact CE1-CB 3.91Å; Y261-N391 VanDerWaalsContact OH-CB 3.22Å; Y261-N391 WeakPolarHBondContact OH-CB 3.26Å; Y261-N391 PolarHBondContact OH-ND2 2.77Å; G387-N391 PolarHBondContact O-N 3.24Å; Q388-N391 PolarHBondContact O-N 2.93Å; V389-N391 PolarHBondContact O-N 3.22Å; N391-A394 PolarHBondContact O-N 2.96Å; N391-A395 WeakPolarHBondContact O-CB 3.33Å; N391-A395 PolarHBondContact O-N 3.46Å; N391-L405 HydrophobicContact CB-CD1 4.37Å; N391-M408 HydrophobicContact CB-CE 4.18Å; N391-P409 PolarHBondContact ND2-O 3.07Å; N391-L411 WeakPolarHBondContact OD1-CD1 3.36Å; N391-L411 WeakPolarHBondContact OD1-CG 3.48Å
392	L	97.7	Very high	96.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-65.6	-44.8	-179.2	-179.9	58.5	0	0	0	111.4	V258 Y261 L262 F338 L350 Q388 V389 A394 A395 L396 L405	V258-L392 HydrophobicContact CB-CD2 4.44Å; V258-L392 HydrophobicContact CG1-CD2 4.02Å; V258-L392 HydrophobicContact CG2-CD2 4.32Å; Y261-L392 HydrophobicContact CD1-CB 4.02Å; Y261-L392 HydrophobicContact CE1-CB 4.19Å; L262-L392 HydrophobicContact CD1-CD2 4.15Å; L262-L392 HydrophobicContact CD2-CD2 3.84Å; L262-L392 HydrophobicContact CG-CD2 3.79Å; F338-L392 HydrophobicContact CZ-CD1 4.33Å; L350-L392 HydrophobicContact CD1-CD2 3.55Å; L350-L392 HydrophobicContact CD1-CG 4.06Å; Q388-L392 WeakPolarHBondContact O-CB 3.36Å; Q388-L392 PolarHBondContact O-N 2.89Å; V389-L392 PolarHBondContact O-N 3.48Å; L392-A394 VanDerWaalsContact C-N 3.34Å; L392-A394 PolarHBondContact O-N 3.34Å; L392-A395 PolarHBondContact O-N 3.49Å; L392-L396 HydrophobicContact CD1-CD1 4.08Å; L392-L396 HydrophobicContact CD1-CG 4.1Å; L392-L396 HydrophobicContact CG-CD1 3.94Å; L392-L396 HydrophobicContact CG-CG 4.43Å; L392-L396 WeakPolarHBondContact O-CB 3.43Å; L392-L396 VanDerWaalsContact O-CG 3.27Å; L392-L396 WeakPolarHBondContact O-CG 3.25Å; L392-L396 PolarHBondContact O-N 3.36Å; L392-L405 HydrophobicContact CD1-CD1 4.47Å; L392-L405 HydrophobicContact CD1-CD2 3.65Å
393	V	97.6	Very high	96.8	Very high	12 Å²	12	26.6 Å²	26.6	7%	0.073	13%	0.132	C	C	.	.	H	α-helix	trans	-59.2	-45.8	175.6	170.2	0	0	0	0	110.8	L347 L350 V389 A395 L396 R397	L347-V393 HydrophobicContact CD1-CG1 4.04Å; L350-V393 HydrophobicContact CB-CG2 3.69Å; V389-V393 HydrophobicContact CG1-CG2 4.2Å; V389-V393 WeakPolarHBondContact O-CB 3.49Å; V389-V393 WeakPolarHBondContact O-CG2 3.36Å; V389-V393 PolarHBondContact O-N 2.89Å; V393-A395 PolarHBondContact O-N 3.33Å; V393-L396 PolarHBondContact O-N 2.82Å; V393-R397 WeakPolarHBondContact O-CG 3.32Å; V393-R397 PolarHBondContact O-N 2.7Å
394	A	96.6	Very high	96.9	Very high	18 Å²	18	28.9 Å²	28.9	15%	0.149	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-43	176.7	0	0	0	0	0	112	V390 N391 L392 R397 D398 M408 L530	V390-A394 WeakPolarHBondContact O-CB 3.25Å; V390-A394 PolarHBondContact O-N 2.54Å; V390-A394 VanDerWaalsContact O-N 3.11Å; N391-A394 PolarHBondContact O-N 2.96Å; L392-A394 VanDerWaalsContact C-N 3.34Å; L392-A394 PolarHBondContact O-N 3.34Å; A394-R397 PolarHBondContact O-N 3.39Å; A394-D398 WeakPolarHBondContact O-CB 3.46Å; A394-D398 PolarHBondContact O-N 2.65Å; A394-M408 HydrophobicContact CB-CE 4.17Å; A394-L530 HydrophobicContact CB-CD1 4.39Å
395	A	97.6	Very high	96.9	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-39.2	178	0	0	0	0	0	113.4	F338 N391 L392 V393 S399 K400 L405 M408	F338-A395 HydrophobicContact CE2-CB 4.49Å; N391-A395 WeakPolarHBondContact O-CB 3.33Å; N391-A395 PolarHBondContact O-N 3.46Å; L392-A395 PolarHBondContact O-N 3.49Å; V393-A395 PolarHBondContact O-N 3.33Å; A395-S399 PolarHBondContact O-N 3.33Å; A395-K400 HydrophobicContact CB-CB 4.06Å; A395-K400 HydrophobicContact CB-CD 4.3Å; A395-K400 PolarHBondContact O-N 2.86Å; A395-L405 HydrophobicContact CB-CB 4.18Å; A395-L405 HydrophobicContact CB-CD1 3.64Å; A395-L405 HydrophobicContact CB-CG 4.42Å; A395-M408 HydrophobicContact CB-SD 3.99Å
396	L	97.7	Very high	96.8	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	15%	0.147	C	C	.	.	H	α-helix	trans	-66.2	-44.5	177	-71.5	168.4	0	0	0	111.4	F338 K343 V346 L347 L350 L392 V393 S399	F338-L396 HydrophobicContact CB-CD2 3.93Å; F338-L396 HydrophobicContact CD1-CD2 4.19Å; F338-L396 HydrophobicContact CD2-CD2 3.75Å; F338-L396 HydrophobicContact CE2-CD2 4.29Å; F338-L396 HydrophobicContact CG-CD2 3.7Å; K343-L396 HydrophobicContact CG-CB 4.44Å; K343-L396 HydrophobicContact CG-CD2 4.03Å; V346-L396 HydrophobicContact CG2-CD1 3.56Å; L347-L396 HydrophobicContact CD1-CB 4.09Å; L347-L396 HydrophobicContact CD1-CD1 4.37Å; L350-L396 HydrophobicContact CD1-CD1 4.37Å; L392-L396 HydrophobicContact CD1-CD1 4.08Å; L392-L396 HydrophobicContact CD1-CG 4.1Å; L392-L396 HydrophobicContact CG-CD1 3.94Å; L392-L396 HydrophobicContact CG-CG 4.43Å; L392-L396 WeakPolarHBondContact O-CB 3.43Å; L392-L396 VanDerWaalsContact O-CG 3.27Å; L392-L396 WeakPolarHBondContact O-CG 3.25Å; L392-L396 PolarHBondContact O-N 3.36Å; V393-L396 PolarHBondContact O-N 2.82Å; L396-S399 PolarHBondContact O-N 2.69Å
397	R	96.8	Very high	96.7	Very high	128 Å²	128	35.2 Å²	35.2	48%	0.483	17%	0.169	S	C	.	.	H	α-helix	trans	-63.1	-42.1	176.5	-71.5	179.2	-176.7	-177.9	2.5	112.1	L347 S351 V393 A394 S399	L347-R397 HydrophobicContact CD1-CG 4.07Å; L347-R397 HydrophobicContact CD2-CG 4.15Å; S351-R397 PolarHBondContact OG-NH2 3.31Å; S351-R397 VanDerWaalsContact OG-NH2 3.12Å; V393-R397 WeakPolarHBondContact O-CG 3.32Å; V393-R397 PolarHBondContact O-N 2.7Å; A394-R397 PolarHBondContact O-N 3.39Å; R397-S399 PolarHBondContact O-N 3.21Å
398	D	96.4	Very high	96.6	Very high	98 Å²	98	36.6 Å²	36.6	52%	0.524	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.6	1.8	178.6	-66.9	-14.3	0	0	0	113.5	A394 K400	A394-D398 WeakPolarHBondContact O-CB 3.46Å; A394-D398 PolarHBondContact O-N 2.65Å; D398-K400 HydrophobicContact CB-CD 4.26Å; D398-K400 HydrophobicContact CB-CG 3.98Å; D398-K400 PolarHBondContact O-N 3.16Å; D398-K400 IonicContact OD2-NZ 2.98Å; D398-K400 PolarHBondContact OD2-NZ 2.89Å
399	S	95.8	Very high	96.4	Very high	55 Å²	55	39.6 Å²	39.6	39%	0.385	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	42.2	-174.3	-60.9	0	0	0	0	113.3	P337 K343 A395 L396 R397	P337-S399 WeakPolarHBondContact CB-O 3.14Å; K343-S399 PolarHBondContact NZ-OG 2.87Å; A395-S399 PolarHBondContact O-N 3.33Å; L396-S399 PolarHBondContact O-N 2.69Å; R397-S399 PolarHBondContact O-N 3.21Å
400	K	97.5	Very high	96.1	Very high	62 Å²	62	40.4 Å²	40.4	27%	0.27	20%	0.201	S	C	.	.			trans	-74.2	162.6	175.1	-75.3	179.3	-180	134	0	111.4	F338 A395 D398 D404 M408	F338-K400 WeakPolarHBondContact CD2-O 3.47Å; F338-K400 PolarHBondContact N-O 2.92Å; A395-K400 HydrophobicContact CB-CB 4.06Å; A395-K400 HydrophobicContact CB-CD 4.3Å; A395-K400 PolarHBondContact O-N 2.86Å; D398-K400 HydrophobicContact CB-CD 4.26Å; D398-K400 HydrophobicContact CB-CG 3.98Å; D398-K400 PolarHBondContact O-N 3.16Å; D398-K400 IonicContact OD2-NZ 2.98Å; D398-K400 PolarHBondContact OD2-NZ 2.89Å; K400-D404 HydrophobicContact CB-CB 4.02Å; K400-D404 HydrophobicContact CD-CB 4.37Å; K400-D404 HydrophobicContact CG-CB 4.31Å; K400-M408 HydrophobicContact CD-SD 4.3Å
401	S	98.1	Very high	95.8	Very high	3 Å²	3	39.3 Å²	39.3	2%	0.021	19%	0.193	C	C	.	.			trans	-83.7	159.5	171	68.4	0	0	0	0	111.9	A334 K335 E336 Y403 D404 L405	A334-S401 WeakPolarHBondContact O-CB 3.37Å; K335-S401 WeakPolarHBondContact O-CB 3.34Å; E336-S401 WeakPolarHBondContact O-CA 3.41Å; E336-S401 WeakPolarHBondContact O-CB 3.38Å; S401-Y403 PolarHBondContact O-N 3.01Å; S401-Y403 PolarHBondContact OG-N 3.29Å; S401-D404 PolarHBondContact N-OD2 3.11Å; S401-D404 PolarHBondContact O-N 2.82Å; S401-D404 PolarHBondContact OG-N 3.27Å; S401-D404 PolarHBondContact OG-OD2 3.22Å; S401-L405 PolarHBondContact O-N 3.03Å
402	P	98.2	Very high	95.4	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-49.9	-37.5	166.4	-29.5	35.4	0	0	0	113.5	F253 V257 W328 A334 E336 F338 L405 V406	F253-P402 HydrophobicContact CE1-CG 4.43Å; V257-P402 HydrophobicContact CG1-CB 3.88Å; V257-P402 HydrophobicContact CG1-CG 4.17Å; V257-P402 HydrophobicContact CG2-CB 4.05Å; V257-P402 HydrophobicContact CG2-CG 4.16Å; W328-P402 HydrophobicContact CZ3-CB 3.96Å; A334-P402 HydrophobicContact CB-CB 4.1Å; A334-P402 VanDerWaalsContact O-CD 3.29Å; A334-P402 WeakPolarHBondContact O-CD 3.42Å; E336-P402 WeakPolarHBondContact O-CD 3.5Å; F338-P402 HydrophobicContact CD1-CG 4.28Å; F338-P402 HydrophobicContact CE1-CG 3.75Å; F338-P402 HydrophobicContact CZ-CB 4.35Å; F338-P402 HydrophobicContact CZ-CG 3.9Å; P402-L405 WeakPolarHBondContact O-CB 3.36Å; P402-L405 PolarHBondContact O-N 3.26Å; P402-V406 PolarHBondContact O-N 3.49Å
403	Y	97.2	Very high	94.9	Very high	90 Å²	90	39.7 Å²	39.7	35%	0.353	20%	0.196	S	C	.	.	H	α-helix	trans	-65.1	-39.6	176.7	-178.4	-100.5	0	0	0	112.4	A329 A334 S401 V406 R407	A329-Y403 WeakPolarHBondContact O-CD2 3.37Å; A334-Y403 WeakPolarHBondContact O-CB 3.26Å; A334-Y403 PolarHBondContact O-N 3.06Å; S401-Y403 PolarHBondContact O-N 3.01Å; S401-Y403 PolarHBondContact OG-N 3.29Å; Y403-V406 WeakPolarHBondContact O-CG2 3.21Å; Y403-R407 WeakPolarHBondContact O-CD 3.39Å; Y403-R407 WeakPolarHBondContact O-CG 3.39Å
404	D	96.9	Very high	94.3	Very high	59 Å²	59	41.7 Å²	41.7	32%	0.316	20%	0.204	S	C	.	.	H	α-helix	trans	-71.4	-38.7	175.7	-65	-47.9	0	0	0	111.9	K400 S401 V406 R407 M408	K400-D404 HydrophobicContact CB-CB 4.02Å; K400-D404 HydrophobicContact CD-CB 4.37Å; K400-D404 HydrophobicContact CG-CB 4.31Å; S401-D404 PolarHBondContact N-OD2 3.11Å; S401-D404 PolarHBondContact O-N 2.82Å; S401-D404 PolarHBondContact OG-N 3.27Å; S401-D404 PolarHBondContact OG-OD2 3.22Å; D404-V406 PolarHBondContact O-N 3.34Å; D404-R407 WeakPolarHBondContact O-CB 3.38Å; D404-R407 PolarHBondContact O-N 3.48Å; D404-R407 VanDerWaalsContact O-N 3.11Å; D404-R407 IonicContact OD1-NH1 3.72Å; D404-M408 PolarHBondContact O-N 2.82Å
405	L	97.2	Very high	93.3	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-55.7	-47.4	176.4	171.1	64.9	0	0	0	112.1	V257 Y261 F338 N391 L392 A395 S401 P402 R407 M408	V257-L405 HydrophobicContact CG1-CD2 4.36Å; Y261-L405 HydrophobicContact CD1-CD1 4.23Å; Y261-L405 HydrophobicContact CD1-CD2 4.08Å; Y261-L405 HydrophobicContact CD1-CG 4.39Å; Y261-L405 HydrophobicContact CD2-CD1 4.43Å; Y261-L405 HydrophobicContact CD2-CD2 3.79Å; Y261-L405 HydrophobicContact CD2-CG 3.87Å; Y261-L405 HydrophobicContact CE1-CD1 3.61Å; Y261-L405 HydrophobicContact CE1-CD2 4.28Å; Y261-L405 HydrophobicContact CE1-CG 4.11Å; Y261-L405 HydrophobicContact CE2-CD1 3.85Å; Y261-L405 HydrophobicContact CE2-CD2 4.01Å; Y261-L405 HydrophobicContact CE2-CG 3.55Å; Y261-L405 HydrophobicContact CG-CD2 3.82Å; Y261-L405 HydrophobicContact CG-CG 4.27Å; Y261-L405 WeakPolarHBondContact OH-CD1 3.39Å; Y261-L405 PolarHBondContact OH-O 2.89Å; F338-L405 HydrophobicContact CE2-CB 4.45Å; F338-L405 HydrophobicContact CE2-CD2 4.13Å; F338-L405 HydrophobicContact CZ-CD2 3.88Å; N391-L405 HydrophobicContact CB-CD1 4.37Å; L392-L405 HydrophobicContact CD1-CD1 4.47Å; L392-L405 HydrophobicContact CD1-CD2 3.65Å; A395-L405 HydrophobicContact CB-CB 4.18Å; A395-L405 HydrophobicContact CB-CD1 3.64Å; A395-L405 HydrophobicContact CB-CG 4.42Å; S401-L405 PolarHBondContact O-N 3.03Å; P402-L405 WeakPolarHBondContact O-CB 3.36Å; P402-L405 PolarHBondContact O-N 3.26Å; L405-R407 PolarHBondContact O-N 2.98Å; L405-M408 HydrophobicContact CD1-SD 4.07Å; L405-M408 WeakPolarHBondContact O-CB 3.5Å; L405-M408 PolarHBondContact O-N 3.29Å
406	V	95	Very high	91.9	Very high	24 Å²	24	44.9 Å²	44.9	15%	0.145	22%	0.221	C	C	.	.	H	α-helix	trans	-70.1	-16.3	-178.9	-60.5	0	0	0	0	113.3	Y261 F326 W328 A329 P402 Y403 D404 K575	Y261-V406 HydrophobicContact CD2-CG1 4.47Å; Y261-V406 HydrophobicContact CE2-CG1 4.48Å; F326-V406 HydrophobicContact CD2-CB 4.39Å; F326-V406 HydrophobicContact CD2-CG1 3.57Å; F326-V406 HydrophobicContact CE2-CG1 4.05Å; F326-V406 HydrophobicContact CG-CG1 4.5Å; W328-V406 HydrophobicContact CH2-CG1 3.7Å; W328-V406 HydrophobicContact CZ3-CG1 3.96Å; A329-V406 HydrophobicContact CB-CG2 4.02Å; P402-V406 PolarHBondContact O-N 3.49Å; Y403-V406 WeakPolarHBondContact O-CG2 3.21Å; D404-V406 PolarHBondContact O-N 3.34Å; V406-K575 PolarHBondContact O-NZ 2.94Å
407	R	93.3	Very high	90	Very high	137 Å²	137	51 Å²	51	52%	0.517	26%	0.259	S	S	.	.	H	α-helix	trans	-89.5	-12.4	176.2	-68.1	173.3	66	-133.2	0.8	113.1	Y403 D404 L405	Y403-R407 WeakPolarHBondContact O-CD 3.39Å; Y403-R407 WeakPolarHBondContact O-CG 3.39Å; D404-R407 WeakPolarHBondContact O-CB 3.38Å; D404-R407 PolarHBondContact O-N 3.48Å; D404-R407 VanDerWaalsContact O-N 3.11Å; D404-R407 IonicContact OD1-NH1 3.72Å; L405-R407 PolarHBondContact O-N 2.98Å
408	M	93.5	Very high	87.7	Confident	29 Å²	29	52.2 Å²	52.2	14%	0.143	27%	0.267	C	S	.	.	S	Bend	trans	-58.5	149	174	-66.1	179.7	63.2	0	0	111.1	N391 A394 A395 K400 D404 L405	N391-M408 HydrophobicContact CB-CE 4.18Å; A394-M408 HydrophobicContact CB-CE 4.17Å; A395-M408 HydrophobicContact CB-SD 3.99Å; K400-M408 HydrophobicContact CD-SD 4.3Å; D404-M408 PolarHBondContact O-N 2.82Å; L405-M408 HydrophobicContact CD1-SD 4.07Å; L405-M408 WeakPolarHBondContact O-CB 3.5Å; L405-M408 PolarHBondContact O-N 3.29Å
409	P	91.5	Very high	85.1	Confident	67 Å²	67	57 Å²	57	44%	0.435	28%	0.283	S	S	.	.	P	Polyproline II helix	trans	-55.6	141.2	172.4	-23.4	34	0	0	0	110.9	N391	N391-P409 PolarHBondContact ND2-O 3.07Å
410	V	90.4	Very high	82.3	Confident	28 Å²	28	64.9 Å²	64.9	17%	0.17	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	134.2	-179.3	-56.6	0	0	0	0	109.7	H317 Y573	H317-V410 HydrophobicContact CB-CG2 4.24Å; V410-Y573 HydrophobicContact CG2-CD2 4.32Å; V410-Y573 HydrophobicContact CG2-CG 4.31Å; V410-Y573 PolarHBondContact N-O 3.23Å; V410-Y573 PolarHBondContact O-N 2.81Å
411	L	90	Very high	79.3	Confident	6 Å²	6	66.2 Å²	66.2	3%	0.031	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	148.9	-177.3	-54.1	-175.5	0	0	0	110.3	H317 G387 V390 N391 L570 R571 Y572	H317-L411 PolarHBondContact NE2-O 3.2Å; G387-L411 WeakPolarHBondContact CA-O 3.44Å; V390-L411 HydrophobicContact CB-CD1 4.25Å; V390-L411 HydrophobicContact CG1-CD1 3.76Å; N391-L411 WeakPolarHBondContact OD1-CD1 3.36Å; N391-L411 WeakPolarHBondContact OD1-CG 3.48Å; L411-L570 HydrophobicContact CB-CD1 4.23Å; L411-L570 HydrophobicContact CD1-CD1 4.34Å; L411-R571 WeakPolarHBondContact CA-O 3.34Å; L411-Y572 HydrophobicContact CD1-CE1 4.38Å; L411-Y572 HydrophobicContact CD2-CD1 3.04Å; L411-Y572 HydrophobicContact CD2-CE1 3.34Å; L411-Y572 HydrophobicContact CD2-CG 3.78Å; L411-Y572 HydrophobicContact CG-CD1 4.48Å
412	T	88.8	Confident	76.4	Confident	9 Å²	9	72.2 Å²	72.2	6%	0.055	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	137.8	161.8	58.3	0	0	0	0	108.6	S383 V384 R571 Y573	S383-T412 WeakPolarHBondContact O-CA 3.5Å; V384-T412 HydrophobicContact CG2-CG2 4.11Å; T412-R571 PolarHBondContact N-O 3.16Å; T412-R571 PolarHBondContact O-N 2.63Å; T412-R571 WeakPolarHBondContact OG1-CB 3.47Å; T412-Y573 HydrophobicContact CG2-CE2 4.05Å
413	L	86.8	Confident	73.2	Confident	6 Å²	6	82.6 Å²	82.6	3%	0.031	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	98.2	-178.1	-172	152.6	0	0	0	108.1	S383 R386 V390 L552 F568 L570	S383-L413 VanDerWaalsContact CA-O 3.29Å; S383-L413 WeakPolarHBondContact CA-O 3.37Å; S383-L413 WeakPolarHBondContact CB-O 3.5Å; S383-L413 PolarHBondContact O-N 2.74Å; S383-L413 PolarHBondContact OG-O 3.37Å; R386-L413 HydrophobicContact CB-CB 3.95Å; R386-L413 HydrophobicContact CB-CD2 4.07Å; V390-L413 HydrophobicContact CG2-CD1 3.97Å; L413-L552 HydrophobicContact CD1-CD1 4.26Å; L413-F568 HydrophobicContact CD2-CB 3.45Å; L413-F568 VanDerWaalsContact CD2-CB 3.45Å; L413-F568 HydrophobicContact CD2-CD1 3.11Å; L413-F568 HydrophobicContact CD2-CD2 4.24Å; L413-F568 HydrophobicContact CD2-CE1 3.79Å; L413-F568 HydrophobicContact CD2-CG 3.35Å; L413-F568 HydrophobicContact CG-CB 3.96Å; L413-F568 HydrophobicContact CG-CD1 4.38Å; L413-F568 HydrophobicContact CG-CG 4.37Å; L413-L570 HydrophobicContact CB-CD1 4.23Å; L413-L570 HydrophobicContact CD1-CD1 4.31Å
414	E	84.6	Confident	70.2	Confident	54 Å²	54	86.5 Å²	86.5	25%	0.252	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	146.5	-174.7	-65.4	-177.8	173.8	0	0	110.8	S416 F568 N569 R571	E414-S416 PolarHBondContact O-N 3.38Å; E414-F568 CarbonylContact O-C 3.54Å; E414-F568 VanDerWaalsContact O-CA 3.32Å; E414-F568 WeakPolarHBondContact O-CA 3.38Å; E414-N569 PolarHBondContact N-O 3.07Å; E414-N569 PolarHBondContact O-N 3.22Å; E414-R571 IonicContact OE1-CZ 2.75Å; E414-R571 IonicContact OE1-NE 2.9Å; E414-R571 IonicContact OE1-NH1 3.22Å; E414-R571 PolarHBondContact OE1-NH1 3.13Å; E414-R571 IonicContact OE1-NH2 3.4Å; E414-R571 IonicContact OE2-CZ 2.83Å; E414-R571 IonicContact OE2-NE 3.56Å; E414-R571 PolarHBondContact OE2-NE 3.46Å; E414-R571 IonicContact OE2-NH1 3.9Å; E414-R571 PolarHBondContact OE2-NH1 3.15Å; E414-R571 IonicContact OE2-NH2 3.69Å; E414-R571 PolarHBondContact OE2-NH2 3Å
415	L	75.5	Confident	67.3	Low	58 Å²	58	92.4 Å²	92.4	30%	0.304	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	129.3	170.7	-78.8	159.6	0	0	0	110.3	T417 Q566 F568	L415-T417 PolarHBondContact O-N 3.34Å; L415-T417 VanDerWaalsContact O-N 3.17Å; L415-Q566 HydrophobicContact CD2-CB 4.2Å; L415-F568 HydrophobicContact CD2-CD1 3.64Å; L415-F568 HydrophobicContact CD2-CE1 3.22Å; L415-F568 HydrophobicContact CD2-CZ 3.74Å; L415-F568 HydrophobicContact CG-CD1 4Å; L415-F568 HydrophobicContact CG-CE1 3.71Å
416	S	69.7	Low	64	Low	28 Å²	28	102.9 Å²	102.9	20%	0.196	48%	0.484	C	S	.	.			trans	-75.7	101.9	175.8	-167.4	0	0	0	0	109.3	E414 K418 R567 N569	E414-S416 PolarHBondContact O-N 3.38Å; S416-K418 PolarHBondContact O-N 2.92Å; S416-K418 VanDerWaalsContact O-N 3.09Å; S416-R567 VanDerWaalsContact CB-O 3.24Å; S416-R567 WeakPolarHBondContact CB-O 3.35Å; S416-R567 PolarHBondContact N-O 3.08Å; S416-N569 PolarHBondContact OG-ND2 3.37Å
417	T	57.1	Low	61	Low	129 Å²	129	107 Å²	107	79%	0.791	51%	0.511	S	S	*	.			trans	-80.6	86.3	172.1	50.4	0	0	0	0	109.2	L415 K419	L415-T417 PolarHBondContact O-N 3.34Å; L415-T417 VanDerWaalsContact O-N 3.17Å; T417-K419 PolarHBondContact O-N 2.67Å
418	K	48.8	Very low	58.3	Low	154 Å²	154	109.1 Å²	109.1	67%	0.67	53%	0.527	S	S	*	.			trans	-63.8	106	160.9	-86.3	-176.2	179.7	169	0	107.1	S416 R420 R567	S416-K418 PolarHBondContact O-N 2.92Å; S416-K418 VanDerWaalsContact O-N 3.09Å; K418-R420 PolarHBondContact O-N 2.96Å; K418-R567 VanDerWaalsContact CE-NH1 3.29Å
419	K	40.7	Very low	55.8	Low	198 Å²	198	117.2 Å²	117.2	86%	0.861	56%	0.564	S	S	*	*			trans	-52.8	111.3	160.2	-83.7	-179.3	175.5	177	0	106.3	T417 S421	T417-K419 PolarHBondContact O-N 2.67Å; K419-S421 VanDerWaalsContact C-N 3.34Å; K419-S421 PolarHBondContact O-N 3.43Å
420	R	36.6	Very low	53.1	Low	220 Å²	220	125.5 Å²	125.5	83%	0.83	59%	0.587	S	S	*	*			trans	-50.9	104.6	166.1	-107	179.1	156.6	171.7	-3.2	106.5	K418 T422	K418-R420 PolarHBondContact O-N 2.96Å; R420-T422 VanDerWaalsContact C-N 3.3Å; R420-T422 PolarHBondContact O-N 2.87Å
421	S	35.6	Very low	50.5	Low	90 Å²	90	132.5 Å²	132.5	63%	0.629	62%	0.622	S	S	*	*			trans	-68.5	94.9	173.4	-178	0	0	0	0	106.6	K419 R423	K419-S421 VanDerWaalsContact C-N 3.34Å; K419-S421 PolarHBondContact O-N 3.43Å; S421-R423 PolarHBondContact O-N 2.99Å
422	T	36.4	Very low	48	Very low	130 Å²	130	137.1 Å²	137.1	80%	0.798	66%	0.661	S	S	*	*			trans	-72.2	73.1	164.3	46.2	0	0	0	0	108	R420	R420-T422 VanDerWaalsContact C-N 3.3Å; R420-T422 PolarHBondContact O-N 2.87Å
423	R	31.2	Very low	45.5	Very low	218 Å²	218	142 Å²	142	82%	0.823	70%	0.702	S	S	*	*			trans	-167.4	66.3	167.5	-110.4	177.5	-113.4	-169.8	-3	111.4	S421	S421-R423 PolarHBondContact O-N 2.99Å
424	H	34.4	Very low	43	Very low	173 Å²	173	144.2 Å²	144.2	80%	0.801	73%	0.727	S	S	*	*			trans	-106.8	78.3	148	-74.1	-70.6	0	0	0	107.9
425	H	35.6	Very low	40.8	Very low	182 Å²	182	151.9 Å²	151.9	84%	0.843	76%	0.76	S	S	*	*			trans	-95.8	105.8	157.3	-161.3	70.3	0	0	0	106.6
426	W	27.6	Very low	39.1	Very low	220 Å²	220	153 Å²	153	83%	0.833	78%	0.777	S	S	*	*			trans	-56.1	133.6	-179.7	-70.6	82.4	0	0	0	112.2
427	P	32.1	Very low	37.8	Very low	111 Å²	111	159.9 Å²	159.9	72%	0.721	81%	0.806	S	S	*	*			trans	-111	99.8	157.6	31.1	-17	0	0	0	108
428	H	38.3	Very low	37.1	Very low	182 Å²	182	161.6 Å²	161.6	84%	0.843	81%	0.805	S	S	*	*			trans	164.4	81.4	148.6	-90	-70.3	0	0	0	110
429	Q	39.1	Very low	36.7	Very low	199 Å²	199	159.7 Å²	159.7	93%	0.93	80%	0.802	S	S	*	*			trans	-155.5	68.1	150.4	-108.8	173.2	33.4	0	0	108.3
430	R	35.6	Very low	36.6	Very low	241 Å²	241	156.4 Å²	156.4	91%	0.909	79%	0.794	S	S	*	*			trans	-96.3	103.3	149.3	-110.4	-172.8	-96.3	-156.9	-6.1	104.6
431	L	36.1	Very low	36.7	Very low	174 Å²	174	152.1 Å²	152.1	91%	0.911	79%	0.793	S	S	*	*			trans	163.4	82.3	155.2	-88.9	164.9	0	0	0	109.1
432	A	37.3	Very low	36.8	Very low	103 Å²	103	153.3 Å²	153.3	85%	0.851	80%	0.798	S	S	*	*			trans	-167.8	88.5	148	0	0	0	0	0	106.9
433	A	35.9	Very low	36.9	Very low	112 Å²	112	155.8 Å²	155.8	93%	0.926	80%	0.8	S	S	*	*			trans	-66.3	140.1	162.7	0	0	0	0	0	108.9
434	G	35.4	Very low	37.2	Very low	52 Å²	52	150.2 Å²	150.2	54%	0.536	80%	0.795	S	S	.	*			trans	157.3	99.5	161.2	0	0	0	0	0	114.1
435	F	37	Very low	37.3	Very low	216 Å²	216	146.2 Å²	146.2	95%	0.947	79%	0.786	S	S	*	*			trans	62.9	118.2	146.4	-45.2	-79.4	0	0	0	115.7
436	A	40.8	Very low	37.3	Very low	82 Å²	82	147.2 Å²	147.2	68%	0.678	78%	0.783	S	S	*	*			cis	-170.8	144.7	44.1	0	0	0	0	0	111.2
437	Q	42.9	Very low	37.5	Very low	172 Å²	172	145.9 Å²	145.9	80%	0.804	78%	0.779	S	S	*	*			trans	67.1	106.5	140.9	-66.1	170.9	-5.9	0	0	118.4
438	H	41.8	Very low	37.4	Very low	165 Å²	165	151 Å²	151	76%	0.764	78%	0.784	S	S	*	*				70.2	123.6	86.2	-87.8	-78.8	0	0	0	110.7
439	D	39.9	Very low	37.3	Very low	114 Å²	114	149.2 Å²	149.2	61%	0.61	78%	0.78	S	S	*	*			cis	-165.9	145	38	-100.4	-44.3	0	0	0	112.5
440	N	39.6	Very low	37	Very low	128 Å²	128	146.5 Å²	146.5	68%	0.684	77%	0.773	S	S	*	*			trans	53.6	131.8	134.8	-51.4	-28.8	0	0	0	120
441	T	38	Very low	36.9	Very low	131 Å²	131	145.2 Å²	145.2	80%	0.804	77%	0.769	S	S	*	*			cis	-169.8	144.6	24.9	-9.2	0	0	0	0	109.3
442	P	38.6	Very low	37	Very low	114 Å²	114	142.9 Å²	142.9	74%	0.74	76%	0.758	S	S	*	*			trans	-115.3	163.6	174.9	39.4	-28.5	0	0	0	113.2
443	E	38.3	Very low	36.8	Very low	182 Å²	182	144.6 Å²	144.6	85%	0.85	75%	0.753	S	S	*	*			trans	175.3	119	139.3	-100.3	179.6	-179.6	0	0	110
444	S	37.7	Very low	36.7	Very low	102 Å²	102	146.7 Å²	146.7	71%	0.713	75%	0.747	S	S	*	*				68.9	138.9	99	143.5	0	0	0	0	114
445	S	35.8	Very low	36.4	Very low	88 Å²	88	149.8 Å²	149.8	62%	0.615	76%	0.756	S	S	*	*			cis	-177.1	156.5	-14.2	51.6	0	0	0	0	105.8
446	R	34.4	Very low	36.3	Very low	203 Å²	203	147.2 Å²	147.2	77%	0.766	75%	0.751	S	S	*	*			trans	84	132.8	143.9	-81.2	168.9	-177	-165.6	7.4	122.8
447	Y	33	Very low	35.8	Very low	192 Å²	192	151 Å²	151	75%	0.753	76%	0.759	S	S	*	*			trans	90.3	98.7	146.8	-68.6	-64.1	0	0	0	121.6
448	R	30.8	Very low	35.5	Very low	219 Å²	219	149.3 Å²	149.3	83%	0.826	76%	0.761	S	S	*	*				22.3	117.4	120.8	-105.6	-179.8	180	155.4	-0.2	118.1
449	N	35.7	Very low	35	Very low	144 Å²	144	148.5 Å²	148.5	77%	0.77	76%	0.762	S	S	*	*				171.3	149.8	101.5	-90.1	-19	0	0	0	112.1
450	N	32.1	Very low	35	Very low	143 Å²	143	147.5 Å²	147.5	77%	0.765	76%	0.762	S	S	*	*			trans	-24.9	144.4	171	-70.5	-15.5	0	0	0	117.3
451	Y	34.1	Very low	34.6	Very low	213 Å²	213	147.2 Å²	147.2	84%	0.835	76%	0.764	S	S	*	*				-177.4	127.9	121.6	-93.8	-70.2	0	0	0	110.3
452	N	37.2	Very low	34.5	Very low	126 Å²	126	148.7 Å²	148.7	67%	0.674	77%	0.768	S	S	*	*			trans	42.2	131.6	137.4	-66.7	-4.4	0	0	0	122.6
453	N	33.8	Very low	34.2	Very low	139 Å²	139	148.1 Å²	148.1	74%	0.743	77%	0.766	S	S	*	*			trans	85.6	142.5	131.9	-71.1	-6.1	0	0	0	120.9
454	L	34	Very low	34	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	76%	0.764	S	S	*	*			trans	103.3	93.7	151.1	-66.1	133.5	0	0	0	118
455	T	28.7	Very low	33.8	Very low	118 Å²	118	149.1 Å²	149.1	72%	0.724	77%	0.768	S	S	*	*				8.6	139	122.8	48.4	0	0	0	0	118.4
456	I	35.2	Very low	33.7	Very low	162 Å²	162	152.4 Å²	152.4	83%	0.831	78%	0.778	S	S	*	*				-164.6	125.8	128.8	-88.2	142	0	0	0	108.9	V458	I456-V458 HydrophobicContact CG2-CG2 4.25Å
457	D	30.1	Very low	33.4	Very low	161 Å²	161	149 Å²	149	86%	0.861	77%	0.774	S	S	*	*			trans	-71.5	143.4	164.5	-70.7	-53.8	0	0	0	111.3
458	V	36.7	Very low	33.5	Very low	137 Å²	137	147.9 Å²	147.9	83%	0.83	78%	0.776	S	S	*	*			trans	-149.2	117.5	149.3	-174.2	0	0	0	0	109.8	I456	I456-V458 HydrophobicContact CG2-CG2 4.25Å
459	D	31.1	Very low	33.6	Very low	148 Å²	148	143 Å²	143	79%	0.791	77%	0.766	S	S	*	*			trans	-119.8	172.4	157.2	-130.6	-2.9	0	0	0	105.3
460	P	40.4	Very low	33.3	Very low	93 Å²	93	142.7 Å²	142.7	60%	0.604	76%	0.763	S	S	*	*			cis	-135.8	-168.3	-21.2	32.5	-9.9	0	0	0	112.1
461	T	31.9	Very low	33.3	Very low	121 Å²	121	141.5 Å²	141.5	74%	0.742	76%	0.761	S	S	*	*			trans	75.9	113.7	157.6	60.6	0	0	0	0	120.3
462	N	34.8	Very low	33	Very low	163 Å²	163	136.9 Å²	136.9	87%	0.872	76%	0.76	S	S	*	*				-165.2	139.3	121.8	-102.9	-24.9	0	0	0	113.1
463	S	32.9	Very low	32.8	Very low	101 Å²	101	136.9 Å²	136.9	71%	0.706	76%	0.764	S	S	*	*			trans	-58.9	144.8	179.2	46.9	0	0	0	0	115.7
464	V	33.6	Very low	32.5	Very low	135 Å²	135	138.8 Å²	138.8	82%	0.818	77%	0.769	S	S	*	*			trans	-142.2	110.5	138.7	-178.5	0	0	0	0	109	I466	V464-I466 HydrophobicContact CG1-CG1 4.15Å
465	Q	34	Very low	32.6	Very low	171 Å²	171	139.2 Å²	139.2	80%	0.799	77%	0.772	S	S	*	*			trans	-81.1	137.2	160.8	-76.6	175	-49.1	0	0	108.7
466	I	34.1	Very low	32.5	Very low	157 Å²	157	141.7 Å²	141.7	81%	0.805	78%	0.775	S	S	*	*			trans	-127.1	105.9	155.1	-59.9	178.9	0	0	0	106.1	V464	V464-I466 HydrophobicContact CG1-CG1 4.15Å
467	N	27.8	Very low	32.5	Very low	131 Å²	131	140.3 Å²	140.3	70%	0.701	77%	0.774	S	S	*	*			trans	-100.9	168.7	163.5	-93.2	-23	0	0	0	108.2
468	Q	34.7	Very low	32.6	Very low	168 Å²	168	139 Å²	139	79%	0.785	77%	0.767	S	S	*	*			trans	89.8	133.3	167.4	-58.7	179.3	-23.1	0	0	113.9
469	D	32.4	Very low	32.5	Very low	116 Å²	116	140.3 Å²	140.3	62%	0.62	77%	0.77	S	S	*	*			cis	-174	147.8	2.7	-106.9	-22.5	0	0	0	107.6
470	I	30	Very low	32.4	Very low	139 Å²	139	140.2 Å²	140.2	71%	0.713	77%	0.769	S	S	*	*			trans	57.4	123	135.4	-47.3	164.1	0	0	0	118.7
471	V	31.9	Very low	32	Very low	118 Å²	118	142.5 Å²	142.5	72%	0.715	78%	0.78	S	S	*	*				165.8	110.3	115	166.9	0	0	0	0	108.9	T473	V471-T473 HydrophobicContact CG1-CG2 4.37Å
472	S	27	Very low	31.8	Very low	115 Å²	115	142.5 Å²	142.5	80%	0.804	78%	0.776	S	S	*	*			trans	-68.7	132.6	158.1	43.3	0	0	0	0	110.8
473	T	33.1	Very low	31.5	Very low	126 Å²	126	140.6 Å²	140.6	77%	0.773	77%	0.774	S	S	*	*			trans	-138.7	117.6	156.2	30	0	0	0	0	109	V471	V471-T473 HydrophobicContact CG1-CG2 4.37Å
474	E	29.1	Very low	31.2	Very low	179 Å²	179	142 Å²	142	84%	0.836	77%	0.774	S	S	*	*			trans	-67.9	140.1	161.9	-64.2	171.6	143.9	0	0	108.4
475	D	34.4	Very low	31.1	Very low	164 Å²	164	142.5 Å²	142.5	88%	0.877	77%	0.772	S	S	*	*			trans	-138.6	107.7	152.8	-106	-24.9	0	0	0	109.4
476	Q	28.2	Very low	31	Very low	171 Å²	171	141 Å²	141	80%	0.799	77%	0.768	S	S	*	*			trans	-78.4	123.5	161.9	-68.9	176.1	-6.3	0	0	108.2
477	T	35.4	Very low	31	Very low	132 Å²	132	140.7 Å²	140.7	81%	0.81	77%	0.766	S	S	*	*			trans	-143.3	106.1	149.2	53.7	0	0	0	0	111.5
478	N	31.4	Very low	30.9	Very low	133 Å²	133	141.4 Å²	141.4	71%	0.711	77%	0.77	S	S	*	*			trans	-18.9	137.1	150.2	-60.5	-44.7	0	0	0	115.8
479	N	34.3	Very low	30.7	Very low	166 Å²	166	141.5 Å²	141.5	89%	0.888	78%	0.775	S	S	*	*				-160.2	117	118.5	-93.9	-27.7	0	0	0	111.7
480	L	28.4	Very low	30.5	Very low	146 Å²	146	143.1 Å²	143.1	76%	0.764	78%	0.784	S	S	*	*			trans	-60.1	140.9	166.6	-70.8	118.1	0	0	0	111.6
481	V	32	Very low	30.3	Very low	140 Å²	140	141.4 Å²	141.4	85%	0.848	78%	0.784	S	S	*	*				-145.3	120.1	124.9	-179.3	0	0	0	0	108.9
482	N	27.9	Very low	30.2	Very low	121 Å²	121	142 Å²	142	65%	0.647	79%	0.792	S	S	*	*			trans	-95.5	137	176.8	179.2	9.8	0	0	0	108.5	D484	N482-D484 PolarHBondContact OD1-N 3.35Å
483	C	29.5	Very low	30.3	Very low	123 Å²	123	145.2 Å²	145.2	83%	0.831	79%	0.794	S	S	*	*			trans	-150.4	66.5	165.8	-77.8	0	0	0	0	110.5
484	D	25.8	Very low	30.4	Very low	131 Å²	131	143.9 Å²	143.9	70%	0.701	79%	0.788	S	S	*	*			trans	-94	131.2	143.9	-78.7	-36.6	0	0	0	107.7	N482	N482-D484 PolarHBondContact OD1-N 3.35Å
485	N	31.3	Very low	30.4	Very low	146 Å²	146	141.4 Å²	141.4	78%	0.781	78%	0.781	S	S	*	*			trans	155.1	145.4	141.8	-82.3	-36.2	0	0	0	114.3
486	I	32.1	Very low	30.4	Very low	140 Å²	140	139.8 Å²	139.8	72%	0.718	77%	0.771	S	S	*	*			trans	91.4	94.3	152.6	-60.5	140.1	0	0	0	115.5
487	I	33.5	Very low	30.4	Very low	150 Å²	150	138.5 Å²	138.5	77%	0.769	77%	0.77	S	S	*	*				96.9	126.8	76.1	-74.2	157.4	0	0	0	112.6
488	N	26.5	Very low	30.2	Very low	145 Å²	145	138.1 Å²	138.1	78%	0.775	77%	0.772	S	S	*	*			trans	-25.2	144	160.5	-73.1	-28.8	0	0	0	116.5
489	L	29.9	Very low	30	Very low	170 Å²	170	140.9 Å²	140.9	89%	0.89	78%	0.778	S	S	*	*				-165	131.2	115.7	-133.9	68.5	0	0	0	112.7
490	D	28	Very low	29.9	Very low	150 Å²	150	141.7 Å²	141.7	80%	0.802	78%	0.776	S	S	*	*			trans	-55.7	166.5	166.3	-102.2	-41.5	0	0	0	114.4
491	S	27.2	Very low	29.7	Very low	104 Å²	104	140.2 Å²	140.2	73%	0.727	77%	0.773	S	S	*	*			trans	80.1	108.6	149.2	65.9	0	0	0	0	119.1
492	C	30.3	Very low	29.6	Very low	131 Å²	131	142.5 Å²	142.5	89%	0.885	77%	0.774	S	S	*	*				-179.4	98.2	128.9	-90.6	0	0	0	0	110.8
493	Q	27.6	Very low	29.4	Very low	181 Å²	181	144.7 Å²	144.7	85%	0.846	78%	0.781	S	S	*	*			trans	-80.2	160.6	141.6	-81.9	-119.2	-61	0	0	107.3
494	P	34.8	Very low	29.4	Very low	99 Å²	99	146.3 Å²	146.3	64%	0.643	78%	0.779	S	S	*	*			cis	-156.2	-176.3	48.8	41.2	-17.3	0	0	0	118.4
495	D	30.4	Very low	29.3	Very low	127 Å²	127	146.5 Å²	146.5	68%	0.679	78%	0.781	S	S	*	*			trans	98.3	111.5	138.2	-76.1	-17.2	0	0	0	123.9
496	L	34.1	Very low	29.3	Very low	130 Å²	130	147.3 Å²	147.3	68%	0.681	78%	0.783	S	S	*	*				83.8	117.9	121.9	-68.9	163.3	0	0	0	122.3
497	N	28.2	Very low	29	Very low	144 Å²	144	146.7 Å²	146.7	77%	0.77	79%	0.786	S	S	*	*			trans	66.7	115.4	137	-73.9	-21.3	0	0	0	120.4
498	S	32	Very low	28.7	Very low	123 Å²	123	144.4 Å²	144.4	86%	0.86	78%	0.783	S	S	*	*				-176	151.6	95.6	67	0	0	0	0	113.3
499	K	27.3	Very low	28.7	Very low	191 Å²	191	142 Å²	142	83%	0.83	78%	0.783	S	S	*	*			trans	-69.2	148	-178.3	-66	160.4	169.1	174.7	0	112.8
500	H	31.1	Very low	28.7	Very low	183 Å²	183	138.5 Å²	138.5	85%	0.847	78%	0.779	S	S	*	*				-164.8	127.1	121.8	-108.5	-64	0	0	0	112.7
501	T	24.6	Very low	28.7	Very low	115 Å²	115	138.3 Å²	138.3	71%	0.706	78%	0.783	S	S	*	*			trans	-74.3	148.8	170.4	46.7	0	0	0	0	111.9
502	H	30.4	Very low	28.9	Very low	189 Å²	189	137.1 Å²	137.1	88%	0.875	79%	0.787	S	S	*	*			trans	-161.9	128.7	134.8	-96.8	-65.5	0	0	0	111.5
503	E	23.5	Very low	28.9	Very low	167 Å²	167	137.1 Å²	137.1	78%	0.78	79%	0.789	S	S	*	*			trans	-106.7	136.3	179.8	175.1	-176	-144.2	0	0	107.6
504	I	29.4	Very low	29.1	Very low	156 Å²	156	132.1 Å²	132.1	80%	0.8	79%	0.786	S	S	*	*			trans	-146	111.4	160.7	-58.3	-177	0	0	0	109.3	I506	I504-I506 HydrophobicContact CG2-CG1 4.33Å
505	D	23.9	Very low	28.8	Very low	136 Å²	136	135.2 Å²	135.2	73%	0.727	80%	0.797	S	S	*	*			trans	-76.3	140.5	161.8	-85.1	-36.5	0	0	0	111.2
506	I	30.3	Very low	29	Very low	163 Å²	163	134.8 Å²	134.8	84%	0.836	80%	0.799	S	S	*	*			trans	-140.5	130.5	151.4	-59.6	-175.5	0	0	0	110.5	I504	I504-I506 HydrophobicContact CG2-CG1 4.33Å
507	V	25.8	Very low	28.9	Very low	127 Å²	127	135.1 Å²	135.1	77%	0.77	80%	0.801	S	S	*	*			trans	-97.4	158.3	-175.4	179.1	0	0	0	0	110.9
508	S	27.1	Very low	29.3	Very low	102 Å²	102	136 Å²	136	71%	0.713	81%	0.806	S	S	*	*			trans	89.4	107.2	149.5	168.5	0	0	0	0	120.4
509	A	26.1	Very low	29.2	Very low	93 Å²	93	137.1 Å²	137.1	77%	0.769	80%	0.802	S	S	*	*				41.1	122.1	122	0	0	0	0	0	120.5
510	A	31.7	Very low	29.6	Very low	98 Å²	98	135.1 Å²	135.1	81%	0.81	80%	0.801	S	S	*	*				-174.9	134.1	120.7	0	0	0	0	0	112.2
511	T	27.9	Very low	29.7	Very low	146 Å²	146	133.5 Å²	133.5	90%	0.896	80%	0.798	S	S	*	*			trans	-46.5	139.2	157.3	48	0	0	0	0	114.1
512	G	31.2	Very low	30	Very low	79 Å²	79	132.9 Å²	132.9	81%	0.814	81%	0.805	S	S	*	*			trans	176.8	104.1	166.2	0	0	0	0	0	113.1
513	S	30	Very low	29.9	Very low	131 Å²	131	132.6 Å²	132.6	92%	0.916	81%	0.809	S	S	*	*			trans	-64.2	144.9	172.1	50.3	0	0	0	0	113.5
514	G	31.3	Very low	30.4	Very low	76 Å²	76	132.9 Å²	132.9	78%	0.784	81%	0.81	S	S	*	*			trans	164.3	109.7	162	0	0	0	0	0	112.5
515	D	28.7	Very low	30.7	Very low	163 Å²	163	133.8 Å²	133.8	87%	0.872	81%	0.811	S	S	*	*			trans	-60.2	155.7	177.8	-59.5	-59	0	0	0	114.2
516	V	35.4	Very low	30.8	Very low	119 Å²	119	131.3 Å²	131.3	72%	0.721	82%	0.817	S	S	*	*				145.2	108.4	129.6	173.8	0	0	0	0	110.7
517	D	31.2	Very low	31	Very low	137 Å²	137	127.3 Å²	127.3	73%	0.733	80%	0.797	S	S	*	*			trans	34.9	121.8	138.4	-47	-31.1	0	0	0	120.3
518	D	36	Very low	31.3	Very low	163 Å²	163	126.3 Å²	126.3	87%	0.872	79%	0.791	S	S	*	*				-170.4	140.8	118.5	-90.7	-30.9	0	0	0	110.3
519	D	31	Very low	31.4	Very low	145 Å²	145	125.8 Å²	125.8	78%	0.775	79%	0.792	S	S	*	*			trans	-58.9	144.6	-175.5	-62.1	-63.1	0	0	0	114
520	D	35.8	Very low	31.8	Very low	149 Å²	149	125 Å²	125	80%	0.797	78%	0.775	S	S	*	*			trans	179	132.2	134.6	-89.1	-26.7	0	0	0	112.1
521	D	32.1	Very low	31.6	Very low	150 Å²	150	124.4 Å²	124.4	80%	0.802	76%	0.763	S	S	*	*			trans	58.7	105.8	146.6	-62	-26.9	0	0	0	121.5
522	A	31.9	Very low	31.7	Very low	101 Å²	101	123.6 Å²	123.6	84%	0.835	76%	0.758	S	S	*	*				167.4	119.4	110.3	0	0	0	0	0	112.2	E524	A522-E524 PolarHBondContact O-N 3.03Å
523	L	28.2	Very low	31.7	Very low	184 Å²	184	128.5 Å²	128.5	96%	0.963	76%	0.757	S	S	*	*			trans	-57.8	116.6	165.4	-81.2	140.9	0	0	0	111.2
524	E	33.8	Very low	31.6	Very low	172 Å²	172	131.1 Å²	131.1	80%	0.804	75%	0.752	S	S	*	*			trans	-146.9	103.2	160.2	-149.8	167.7	-159.9	0	0	112.1	A522	A522-E524 PolarHBondContact O-N 3.03Å
525	H	36.4	Very low	31.4	Very low	176 Å²	176	135.3 Å²	135.3	82%	0.815	76%	0.756	S	S	*	*			trans	51.1	101.4	156.9	-60.8	-60.1	0	0	0	119.8	L527	H525-L527 PolarHBondContact O-N 3.46Å
526	G	26.1	Very low	31.5	Very low	83 Å²	83	136.7 Å²	136.7	86%	0.856	76%	0.755	S	S	*	*			trans	-63.6	115.8	171.6	0	0	0	0	0	114.2
527	L	33.3	Very low	31.3	Very low	79 Å²	79	139.7 Å²	139.7	41%	0.414	76%	0.761	S	S	.	*			trans	-141.2	124.2	130.2	-97.4	175.3	0	0	0	107	S351 H525 A529	S351-L527 WeakPolarHBondContact O-CD1 3.25Å; H525-L527 PolarHBondContact O-N 3.46Å; L527-A529 PolarHBondContact O-N 2.89Å
528	V	31.7	Very low	31.1	Very low	106 Å²	106	141.3 Å²	141.3	64%	0.642	77%	0.768	S	S	*	*			trans	-44.3	127	178.5	177.5	0	0	0	0	110.6	L530	V528-L530 PolarHBondContact O-N 3.22Å
529	A	29.4	Very low	30.8	Very low	91 Å²	91	140.4 Å²	140.4	75%	0.752	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-51.8	122.8	179.3	0	0	0	0	0	111.3	L527	L527-A529 PolarHBondContact O-N 2.89Å
530	L	34.6	Very low	30.6	Very low	77 Å²	77	138 Å²	138	40%	0.403	76%	0.756	S	S	.	*	P	Polyproline II helix	trans	-62.1	141.2	168.2	-71.7	171.8	0	0	0	109	V390 A394 V528 T532	V390-L530 HydrophobicContact CG1-CD1 4.29Å; A394-L530 HydrophobicContact CB-CD1 4.39Å; V528-L530 PolarHBondContact O-N 3.22Å; L530-T532 PolarHBondContact O-N 2.86Å; L530-T532 VanDerWaalsContact O-N 3.15Å
531	P	28.7	Very low	30.4	Very low	86 Å²	86	138 Å²	138	56%	0.558	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-57.8	123.5	-178.9	-19.3	28.9	0	0	0	110.8	F533	P531-F533 PolarHBondContact O-N 2.99Å
532	T	29.8	Very low	30.3	Very low	128 Å²	128	138.4 Å²	138.4	79%	0.785	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-69.8	117.7	168.8	46.5	0	0	0	0	108.7	L530 K534	L530-T532 PolarHBondContact O-N 2.86Å; L530-T532 VanDerWaalsContact O-N 3.15Å; T532-K534 PolarHBondContact O-N 3.37Å; T532-K534 VanDerWaalsContact O-N 3.08Å
533	F	31.1	Very low	30.3	Very low	182 Å²	182	140.7 Å²	140.7	80%	0.798	76%	0.756	S	S	*	*			trans	-70.6	103.3	174.7	-89.7	-89.8	0	0	0	109.6	P531	P531-F533 PolarHBondContact O-N 2.99Å
534	K	26.9	Very low	30.6	Very low	186 Å²	186	139.4 Å²	139.4	81%	0.809	75%	0.75	S	S	*	*			trans	-88.8	120.9	159.7	-77.1	-178.1	177.2	174.2	0	108.7	T532 K536	T532-K534 PolarHBondContact O-N 3.37Å; T532-K534 VanDerWaalsContact O-N 3.08Å; K534-K536 PolarHBondContact O-N 2.94Å
535	D	27.4	Very low	30.7	Very low	164 Å²	164	135.3 Å²	135.3	88%	0.877	74%	0.741	S	S	*	*			trans	-56.7	102.6	172.7	-78.9	-38.2	0	0	0	111
536	K	31.1	Very low	30.8	Very low	192 Å²	192	134.8 Å²	134.8	84%	0.835	74%	0.736	S	S	*	*			trans	-140.5	115.4	163.6	-79.9	-168.6	177	177.6	0	112.3	K534	K534-K536 PolarHBondContact O-N 2.94Å
537	Q	30	Very low	31.3	Very low	182 Å²	182	137.8 Å²	137.8	85%	0.85	73%	0.728	S	S	*	*			trans	50.7	102.7	156.8	-68.9	-173.1	-13.6	0	0	118.4	I539	Q537-I539 PolarHBondContact O-N 3.28Å
538	I	27.5	Very low	31.6	Very low	172 Å²	172	137.6 Å²	137.6	88%	0.882	73%	0.73	S	S	*	*			trans	-59.2	108.8	163.2	-61	166.3	0	0	0	108.9
539	I	29.6	Very low	31.6	Very low	144 Å²	144	138.8 Å²	138.8	74%	0.738	73%	0.729	S	S	*	*			trans	-99.5	116.9	154.5	-62.1	178.1	0	0	0	106.4	Q537 N541	Q537-I539 PolarHBondContact O-N 3.28Å; I539-N541 PolarHBondContact O-N 3.44Å
540	S	27.8	Very low	32.2	Very low	93 Å²	93	136.1 Å²	136.1	65%	0.65	70%	0.703	S	S	*	*			trans	-66	115.9	178	58.7	0	0	0	0	110.4
541	N	30.3	Very low	32	Very low	150 Å²	150	136.7 Å²	136.7	80%	0.802	71%	0.706	S	S	*	*			trans	-132.5	114.1	151.5	-92.2	-17	0	0	0	106.9	I539 N543	I539-N541 PolarHBondContact O-N 3.44Å; N541-N543 PolarHBondContact O-N 2.93Å; N541-N543 VanDerWaalsContact O-N 3.13Å
542	N	30	Very low	32.5	Very low	159 Å²	159	134.4 Å²	134.4	85%	0.85	69%	0.689	S	S	*	*			trans	-65.3	104.3	172.9	-77.9	-17.1	0	0	0	108.4
543	N	33.6	Very low	32.7	Very low	149 Å²	149	132.3 Å²	132.3	80%	0.797	69%	0.685	S	S	*	*			trans	-163.3	114.2	149.1	-91.3	-22.5	0	0	0	106.7	N541	N541-N543 PolarHBondContact O-N 2.93Å; N541-N543 VanDerWaalsContact O-N 3.13Å
544	D	33.9	Very low	32.9	Very low	157 Å²	157	128.3 Å²	128.3	84%	0.84	67%	0.672	S	S	*	*	S	Bend	trans	-62	136.6	175.9	-72.4	-45.9	0	0	0	110
545	S	34.7	Very low	33.2	Very low	86 Å²	86	125.1 Å²	125.1	60%	0.601	67%	0.673	S	S	*	*			trans	83.3	95.3	-166.7	74.7	0	0	0	0	115.6
546	K	40.3	Very low	33.5	Very low	164 Å²	164	120.8 Å²	120.8	71%	0.713	66%	0.66	S	S	*	*			trans	-87.6	112.5	160.3	-76.8	-173.1	177.2	-174.9	0	108.1
547	Q	35.8	Very low	33.5	Very low	146 Å²	146	114.5 Å²	114.5	68%	0.682	65%	0.649	S	S	*	*	B	Isolated β-bridge	trans	-81.5	127.3	166.1	-70.1	177.8	-5.8	0	0	108.2
548	T	39.8	Very low	33.6	Very low	75 Å²	75	114 Å²	114	46%	0.46	65%	0.652	S	S	.	*			trans	-123.1	108.9	171.2	-31.4	0	0	0	0	106.8	V550	T548-V550 PolarHBondContact O-N 3.36Å
549	E	31.6	Very low	34.1	Very low	132 Å²	132	113.8 Å²	113.8	62%	0.617	65%	0.653	S	S	*	*			trans	-73	119.4	176.3	-160.7	171.6	-178.2	0	0	108
550	V	41.2	Very low	34.3	Very low	35 Å²	35	110.4 Å²	110.4	21%	0.212	65%	0.647	C	S	.	*			trans	-117.3	114	175.1	-175.5	0	0	0	0	107.1	T548 L552 L570	T548-V550 PolarHBondContact O-N 3.36Å; V550-L552 PolarHBondContact O-N 3.49Å; V550-L570 HydrophobicContact CB-CB 4.34Å; V550-L570 HydrophobicContact CG2-CB 4.35Å; V550-L570 HydrophobicContact CG2-CD2 4.2Å
551	D	31.6	Very low	34.6	Very low	88 Å²	88	114 Å²	114	47%	0.471	66%	0.658	S	S	.	*			trans	-76.8	100.2	176.4	-78.6	-20.1	0	0	0	109.9	R567	D551-R567 IonicContact OD1-CZ 3.04Å; D551-R567 IonicContact OD1-NE 3.62Å; D551-R567 PolarHBondContact OD1-NE 3Å; D551-R567 IonicContact OD1-NH2 2.67Å; D551-R567 PolarHBondContact OD1-NH2 3.02Å; D551-R567 IonicContact OD2-CZ 3.61Å; D551-R567 IonicContact OD2-NE 3.12Å; D551-R567 IonicContact OD2-NH2 2.68Å; D551-R567 PolarHBondContact OD2-NH2 3.44Å
552	L	39.6	Very low	34.6	Very low	38 Å²	38	115.8 Å²	115.8	20%	0.199	66%	0.662	C	S	.	*			trans	-90.4	101.1	163.2	-77	150.7	0	0	0	107.1	L413 V550	L413-L552 HydrophobicContact CD1-CD1 4.26Å; V550-L552 PolarHBondContact O-N 3.49Å
553	A	33.3	Very low	34.6	Very low	84 Å²	84	114.4 Å²	114.4	69%	0.694	66%	0.655	S	S	*	*			trans	-97.9	136.2	172.5	0	0	0	0	0	109.8
554	D	35.3	Very low	34.8	Very low	98 Å²	98	114 Å²	114	52%	0.524	65%	0.653	S	S	.	*			trans	-79.5	135	174.7	-116.5	-17.3	0	0	0	109.8	A556	D554-A556 PolarHBondContact O-N 3.25Å
555	S	34	Very low	35.3	Very low	119 Å²	119	115.3 Å²	115.3	83%	0.832	65%	0.654	S	S	*	*			trans	-92.5	79.8	161.6	176.4	0	0	0	0	107.2	G557	S555-G557 PolarHBondContact O-N 3.3Å
556	A	33.3	Very low	36.2	Very low	74 Å²	74	115.3 Å²	115.3	61%	0.612	64%	0.644	S	S	*	*			trans	-68	121.4	172.3	0	0	0	0	0	109.2	D554	D554-A556 PolarHBondContact O-N 3.25Å
557	G	30.8	Very low	37.1	Very low	59 Å²	59	110.9 Å²	110.9	61%	0.608	62%	0.623	S	S	*	*			trans	-63.3	154.7	171.7	0	0	0	0	0	112	S555 D559	S555-G557 PolarHBondContact O-N 3.3Å; G557-D559 PolarHBondContact O-N 3.26Å
558	D	32.3	Very low	38.6	Very low	171 Å²	171	104.5 Å²	104.5	91%	0.914	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.3	7.2	-163.1	-91.5	-24.6	0	0	0	119.5
559	D	37.2	Very low	39.9	Very low	169 Å²	169	102.7 Å²	102.7	90%	0.904	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.3	16.3	-175.9	-72	-46.5	0	0	0	114.8	G557	G557-D559 PolarHBondContact O-N 3.26Å
560	A	33.6	Very low	41.7	Very low	72 Å²	72	96.7 Å²	96.7	60%	0.595	55%	0.553	S	S	*	*	S	Bend	trans	-97.8	122.3	174.3	0	0	0	0	0	111.4	E562	A560-E562 PolarHBondContact O-N 3.08Å
561	D	34.4	Very low	43.2	Very low	168 Å²	168	98.8 Å²	98.8	90%	0.898	56%	0.557	S	S	*	*			trans	-33.9	122.1	171.8	-87.8	-39.8	0	0	0	112.3	N563	D561-N563 PolarHBondContact O-N 3.34Å
562	E	29.8	Very low	44.6	Very low	188 Å²	188	97.2 Å²	97.2	88%	0.879	55%	0.545	S	S	*	.	S	Bend	trans	-55.9	91.7	171.5	-71.5	-178.8	149.4	0	0	110.5	A560	A560-E562 PolarHBondContact O-N 3.08Å
563	N	31.7	Very low	45.7	Very low	131 Å²	131	99.9 Å²	99.9	70%	0.701	55%	0.553	S	S	*	*			trans	163.4	83.3	149.8	-88.4	-51.1	0	0	0	110.9	D561	D561-N563 PolarHBondContact O-N 3.34Å
564	D	37.7	Very low	46.5	Very low	141 Å²	141	104.5 Å²	104.5	75%	0.754	56%	0.557	S	S	*	*			trans	174	75	138.4	-85.8	-19.2	0	0	0	110.6	Q566	D564-Q566 PolarHBondContact O-N 2.88Å
565	E	43.6	Very low	47.2	Very low	183 Å²	183	104.5 Å²	104.5	86%	0.855	55%	0.552	S	S	*	*			trans	-63.2	98.8	160.5	-81	-175.4	171.6	0	0	108.8	R567	E565-R567 PolarHBondContact O-N 3.45Å; E565-R567 VanDerWaalsContact O-N 3.14Å
566	Q	54.8	Low	47.4	Very low	86 Å²	86	101.6 Å²	101.6	40%	0.402	53%	0.53	S	S	.	.			trans	-78.6	97.6	176.1	-67.3	-173.2	15.1	0	0	109.9	L415 D564 F568	L415-Q566 HydrophobicContact CD2-CB 4.2Å; D564-Q566 PolarHBondContact O-N 2.88Å; Q566-F568 HydrophobicContact CB-CE2 4.06Å; Q566-F568 HydrophobicContact CB-CZ 4.21Å; Q566-F568 WeakPolarHBondContact O-CD2 3.36Å; Q566-F568 WeakPolarHBondContact O-CE2 3.43Å
567	R	57.5	Low	47.5	Very low	72 Å²	72	106.5 Å²	106.5	27%	0.272	54%	0.538	S	S	.	.			trans	-82	138.3	174.3	-166	175.4	-174.7	-168.6	12.6	110.5	S416 K418 D551 E565	S416-R567 VanDerWaalsContact CB-O 3.24Å; S416-R567 WeakPolarHBondContact CB-O 3.35Å; S416-R567 PolarHBondContact N-O 3.08Å; K418-R567 VanDerWaalsContact CE-NH1 3.29Å; D551-R567 IonicContact OD1-CZ 3.04Å; D551-R567 IonicContact OD1-NE 3.62Å; D551-R567 PolarHBondContact OD1-NE 3Å; D551-R567 IonicContact OD1-NH2 2.67Å; D551-R567 PolarHBondContact OD1-NH2 3.02Å; D551-R567 IonicContact OD2-CZ 3.61Å; D551-R567 IonicContact OD2-NE 3.12Å; D551-R567 IonicContact OD2-NH2 2.68Å; D551-R567 PolarHBondContact OD2-NH2 3.44Å; E565-R567 PolarHBondContact O-N 3.45Å; E565-R567 VanDerWaalsContact O-N 3.14Å
568	F	68.5	Low	47.9	Very low	11 Å²	11	111.5 Å²	111.5	5%	0.048	54%	0.544	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	145.4	179.9	-63.5	-84	0	0	0	112.2	L413 E414 L415 Q566	L413-F568 HydrophobicContact CD2-CB 3.45Å; L413-F568 VanDerWaalsContact CD2-CB 3.45Å; L413-F568 HydrophobicContact CD2-CD1 3.11Å; L413-F568 HydrophobicContact CD2-CD2 4.24Å; L413-F568 HydrophobicContact CD2-CE1 3.79Å; L413-F568 HydrophobicContact CD2-CG 3.35Å; L413-F568 HydrophobicContact CG-CB 3.96Å; L413-F568 HydrophobicContact CG-CD1 4.38Å; L413-F568 HydrophobicContact CG-CG 4.37Å; E414-F568 CarbonylContact O-C 3.54Å; E414-F568 VanDerWaalsContact O-CA 3.32Å; E414-F568 WeakPolarHBondContact O-CA 3.38Å; L415-F568 HydrophobicContact CD2-CD1 3.64Å; L415-F568 HydrophobicContact CD2-CE1 3.22Å; L415-F568 HydrophobicContact CD2-CZ 3.74Å; L415-F568 HydrophobicContact CG-CD1 4Å; L415-F568 HydrophobicContact CG-CE1 3.71Å; Q566-F568 HydrophobicContact CB-CE2 4.06Å; Q566-F568 HydrophobicContact CB-CZ 4.21Å; Q566-F568 WeakPolarHBondContact O-CD2 3.36Å; Q566-F568 WeakPolarHBondContact O-CE2 3.43Å
569	N	66.6	Low	47.8	Very low	37 Å²	37	108.3 Å²	108.3	20%	0.198	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	113.3	174.9	-65.7	-27	0	0	0	109	E414 S416	E414-N569 PolarHBondContact N-O 3.07Å; E414-N569 PolarHBondContact O-N 3.22Å; S416-N569 PolarHBondContact OG-ND2 3.37Å
570	L	70.2	Confident	47.5	Very low	6 Å²	6	111.6 Å²	111.6	3%	0.031	53%	0.53	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	126.9	174.8	-170.6	55.9	0	0	0	110.5	L411 L413 V550 Y572	L411-L570 HydrophobicContact CB-CD1 4.23Å; L411-L570 HydrophobicContact CD1-CD1 4.34Å; L413-L570 HydrophobicContact CB-CD1 4.23Å; L413-L570 HydrophobicContact CD1-CD1 4.31Å; V550-L570 HydrophobicContact CB-CB 4.34Å; V550-L570 HydrophobicContact CG2-CB 4.35Å; V550-L570 HydrophobicContact CG2-CD2 4.2Å; L570-Y572 HydrophobicContact CB-CE2 4.37Å; L570-Y572 HydrophobicContact CD2-CE1 4.34Å; L570-Y572 HydrophobicContact CD2-CE2 3.64Å; L570-Y572 VanDerWaalsContact CD2-CZ 3.42Å; L570-Y572 WeakPolarHBondContact CD2-OH 3.44Å; L570-Y572 HydrophobicContact CG-CD2 4.3Å; L570-Y572 HydrophobicContact CG-CE2 3.64Å
571	R	71.4	Confident	47.4	Very low	80 Å²	80	120.3 Å²	120.3	30%	0.302	56%	0.555	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-116.7	132.3	173.3	-69.9	-173.6	177.8	171.8	10.2	110.3	L411 T412 E414 Y573	L411-R571 WeakPolarHBondContact CA-O 3.34Å; T412-R571 PolarHBondContact N-O 3.16Å; T412-R571 PolarHBondContact O-N 2.63Å; T412-R571 WeakPolarHBondContact OG1-CB 3.47Å; E414-R571 IonicContact OE1-CZ 2.75Å; E414-R571 IonicContact OE1-NE 2.9Å; E414-R571 IonicContact OE1-NH1 3.22Å; E414-R571 PolarHBondContact OE1-NH1 3.13Å; E414-R571 IonicContact OE1-NH2 3.4Å; E414-R571 IonicContact OE2-CZ 2.83Å; E414-R571 IonicContact OE2-NE 3.56Å; E414-R571 PolarHBondContact OE2-NE 3.46Å; E414-R571 IonicContact OE2-NH1 3.9Å; E414-R571 PolarHBondContact OE2-NH1 3.15Å; E414-R571 IonicContact OE2-NH2 3.69Å; E414-R571 PolarHBondContact OE2-NH2 3Å; R571-Y573 HydrophobicContact CB-CE2 4.2Å
572	Y	61.4	Low	48	Very low	55 Å²	55	118 Å²	118	22%	0.216	54%	0.538	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	133.9	179	-65.3	-96.4	0	0	0	110	L411 L570	L411-Y572 HydrophobicContact CD1-CE1 4.38Å; L411-Y572 HydrophobicContact CD2-CD1 3.04Å; L411-Y572 HydrophobicContact CD2-CE1 3.34Å; L411-Y572 HydrophobicContact CD2-CG 3.78Å; L411-Y572 HydrophobicContact CG-CD1 4.48Å; L570-Y572 HydrophobicContact CB-CE2 4.37Å; L570-Y572 HydrophobicContact CD2-CE1 4.34Å; L570-Y572 HydrophobicContact CD2-CE2 3.64Å; L570-Y572 VanDerWaalsContact CD2-CZ 3.42Å; L570-Y572 WeakPolarHBondContact CD2-OH 3.44Å; L570-Y572 HydrophobicContact CG-CD2 4.3Å; L570-Y572 HydrophobicContact CG-CE2 3.64Å
573	Y	62.1	Low	49	Very low	94 Å²	94	114.3 Å²	114.3	37%	0.369	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	113	168.5	-57.9	-93.9	0	0	0	108.2	V410 T412 R571 K575	V410-Y573 HydrophobicContact CG2-CD2 4.32Å; V410-Y573 HydrophobicContact CG2-CG 4.31Å; V410-Y573 PolarHBondContact N-O 3.23Å; V410-Y573 PolarHBondContact O-N 2.81Å; T412-Y573 HydrophobicContact CG2-CE2 4.05Å; R571-Y573 HydrophobicContact CB-CE2 4.2Å; Y573-K575 PolarHBondContact O-N 2.9Å
574	K	49.7	Very low	50	Low	181 Å²	181	113.3 Å²	113.3	79%	0.787	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-73.4	121	174.5	-169.6	178.2	-177.5	-177.9	0	107.8	P576	K574-P576 WeakPolarHBondContact O-CD 3.25Å
575	K	50.9	Low	50.7	Low	98 Å²	98	111.7 Å²	111.7	43%	0.426	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-63.4	122.9	166.9	-69.5	-176.5	-178.9	178.7	0	108	V406 Y573 F577	V406-K575 PolarHBondContact O-NZ 2.94Å; Y573-K575 PolarHBondContact O-N 2.9Å; K575-F577 PolarHBondContact O-N 3.37Å
576	P	37.9	Very low	51.1	Low	57 Å²	57	107.3 Å²	107.3	37%	0.37	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-58.4	128.6	164.4	-20.4	34.4	0	0	0	108.1	E320 K574 F578	E320-P576 WeakPolarHBondContact OE1-CD 3.35Å; E320-P576 WeakPolarHBondContact OE1-CG 3.23Å; E320-P576 WeakPolarHBondContact OE2-CD 3.4Å; E320-P576 VanDerWaalsContact OE2-CG 3.3Å; E320-P576 WeakPolarHBondContact OE2-CG 3.22Å; K574-P576 WeakPolarHBondContact O-CD 3.25Å; P576-F578 VanDerWaalsContact C-N 3.34Å; P576-F578 HydrophobicContact CB-CD2 4.29Å; P576-F578 PolarHBondContact O-N 2.99Å
577	F	36.5	Very low	50.9	Low	177 Å²	177	108.7 Å²	108.7	78%	0.776	48%	0.478	S	S	*	.			trans	-69	93.7	171.8	-97.6	-96.7	0	0	0	108.2	K575	K575-F577 PolarHBondContact O-N 3.37Å
578	F	37.8	Very low	50.4	Low	164 Å²	164	111.3 Å²	111.3	72%	0.719	49%	0.493	S	S	*	.			trans	-101.6	106.2	156.8	-86.7	-80.4	0	0	0	108.2	P576 W580	P576-F578 VanDerWaalsContact C-N 3.34Å; P576-F578 HydrophobicContact CB-CD2 4.29Å; P576-F578 PolarHBondContact O-N 2.99Å; F578-W580 VanDerWaalsContact C-N 3.27Å; F578-W580 PolarHBondContact O-N 2.73Å
579	T	30.3	Very low	49	Very low	104 Å²	104	119 Å²	119	64%	0.638	53%	0.527	S	S	*	.			trans	-68.9	87.9	164	50.4	0	0	0	0	107.9
580	W	31.8	Very low	47.6	Very low	238 Å²	238	125.8 Å²	125.8	90%	0.902	56%	0.555	S	S	*	*			trans	-88.9	105.6	154.2	-97.5	69	0	0	0	106.5	F578	F578-W580 VanDerWaalsContact C-N 3.27Å; F578-W580 PolarHBondContact O-N 2.73Å
581	F	30.7	Very low	45.5	Very low	256 Å²	256	136.7 Å²	136.7	100%	1.123	60%	0.602	S	S	*	*			trans	-62	0	169.8	-81.1	-87.4	0	0	0	111.4

Retrieved 581 of 581 residues in 156.3 ms (Link to these results)

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