M10L1_HUMAN Loading...

RNA helicase Mov10l1

ATP-dependent RNA helicase required during spermatogenesis to repress transposable elements and prevent their mobilization, which is essential for germline integrity. Acts via the piRNA metabolic process, which mediates the repression of transposable elements during meiosis by forming complexes composed of piRNAs and Piwi proteins and governs the methylation and subsequent repression of transposons. Involved in the primary piRNA metabolic process. Specifically binds to piRNA precursors and promotes the generation of intermediate piRNA processing fragments that are subsequently loaded to Piwi proteins. Acts via its ATP-dependent RNA helicase activity: displays 5'-3' RNA unwinding activity and probably mediates unwinding and funneling of single-stranded piRNA precursor transcripts to the endonuclease that catalyzes the first cleavage step of piRNA processing to generate piRNA intermediate fragments that are subsequently loaded to Piwi proteins.

AlphaFold DB , UniProt , Accession Q9BXT6, Species HUMAN (Homo sapiens, Human), Gene MOV10L1, Length 1,211 aa.

						>M10L1_HUMAN|Q9BXT6|MOV10L1
MLSLAAKLVAFFWRTADTPREEAGQLEPELAEGDTKLKTVRGVVTRYCSDYGMIDDMIYFSSDAVTSRVLLNVGQEVIAVVEENKVSNGLKAIRVEAVSDKWEDDSRNHGSPSDCGPRVLIGCVTSLVEGAGCISQTTYFSLESVCEGFEPCKGDWVEAEYRIRPGTWSSEATSVKPLRYKRVDKVCISSLCGRNGVLEESIFFTLDSLKLPDGYTPRRGDVVNAVVVESSQSCYVWRALCMTLVKRRDAAPVHEATHFYGTILLKNKGDIEVTQVTHFGTLKEGRSKTMVIWIENKGDIPQNLVSCKLAGWDKSKQFRFQMLDKDQMCPVVSFVSVPEKENSSDENINSLNSHTKNKTSQMSESSLVNNRGISPGDCTCKGENGEKDNILSRKQMTEPEPGGLVPPGGKTFIVVICDGKNPGRCKELLLLCFSDFLIGRYLEVNVISGEESLIAAREPFSWKKLKSSQALTSAKTTVVVTAQKRNSRRQLPSFLPQYPIPDRLRKCVEQKIDILTFQPLLAELLNMSNYKEKFSTLLWLEEIYAEMELKEYNMSGIILRRNGDLLVLEVPGLAEGRPSLYAGDKLILKTQEYNGHAIEYISYVTEIHEEDVTLKINPEFEQAYNFEPMDVEFTYNRTTSRRCHFALEHVIHLGVKVLFPEEIILQSPQVTGNWNHAQDTKSSGQSTSKKNRKTMTDQAEHGTEERRVGDKDLPVLAPFTAEMSDWVDEIQTPKARKMEFFNPVLNENQKLAVKRILSGDCRPLPYILFGPPGTGKTVTIIEAVLQVHFALPDSRILVCAPSNSAADLVCLRLHESKVLQPATMVRVNATCRFEEIVIDAVKPYCRDGEDIWKASRFRIIITTCSSSGLFYQIGVRVGHFTHVFVDEAGQASEPECLIPLGLMSDISGQIVLAGDPMQLGPVIKSRLAMAYGLNVSFLERLMSRPAYQRDENAFGACGAHNPLLVTKLVKNYRSHEALLMLPSRLFYHRELEVCADPTVVTSLLGWEKLPKKGFPLIFHGVRGSEAREGKSPSWFNPAEAVQVLRYCCLLAHSISSQVSASDIGVITPYRKQVEKIRILLRNVDLMDIKVGSVEEFQGQEYLVIIISTVRSNEDRFEDDRYFLGFLSNSKRFNVAITRPKALLIVLGNPHVLVRDPCFGALLEYSITNGVYMGCDLPPALQSLQNCGEGVADPSYPVVPESTGPEKHQEPS
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	32.5	Very low	42.9	Very low	207 Å²	207	117.6 Å²	117.6	100%	1.02	66%	0.661	S	S	*	*				0	-62.9	0	-74.2	-69.7	-110.7	0	0	111.8	S3 L4 A5	M1-S3 PolarHBondContact O-N 3.29Å; M1-L4 WeakPolarHBondContact O-CB 3.28Å; M1-L4 PolarHBondContact O-N 3.14Å; M1-L4 VanDerWaalsContact O-N 3.09Å; M1-A5 PolarHBondContact O-N 3.02Å
2	L	44.1	Very low	42	Very low	162 Å²	162	122.7 Å²	122.7	85%	0.848	67%	0.671	S	S	*	*	H	α-helix	trans	-63	-33.9	178.1	-80.1	143	0	0	0	114.6	L4 A5 A6	L2-L4 VanDerWaalsContact C-N 3.31Å; L2-L4 PolarHBondContact O-N 3.26Å; L2-A5 PolarHBondContact O-N 2.69Å; L2-A6 PolarHBondContact O-N 2.94Å
3	S	41.5	Very low	41.2	Very low	85 Å²	85	130.1 Å²	130.1	59%	0.594	68%	0.683	S	S	*	*	H	α-helix	trans	-67.1	-27.6	172.6	166.8	0	0	0	0	113.8	M1 K7	M1-S3 PolarHBondContact O-N 3.29Å; S3-K7 PolarHBondContact O-N 3.23Å
4	L	47.3	Very low	40	Very low	119 Å²	119	136.1 Å²	136.1	62%	0.623	69%	0.692	S	S	*	*	H	α-helix	trans	-77.3	-33.6	177.6	-117.3	109.4	0	0	0	111.5	M1 L2 K7 L8	M1-L4 WeakPolarHBondContact O-CB 3.28Å; M1-L4 PolarHBondContact O-N 3.14Å; M1-L4 VanDerWaalsContact O-N 3.09Å; L2-L4 VanDerWaalsContact C-N 3.31Å; L2-L4 PolarHBondContact O-N 3.26Å; L4-K7 PolarHBondContact O-N 2.79Å; L4-L8 PolarHBondContact O-N 3Å; L4-L8 VanDerWaalsContact O-N 3.16Å
5	A	50.3	Low	39.2	Very low	57 Å²	57	135.1 Å²	135.1	47%	0.471	70%	0.695	S	S	.	*	H	α-helix	trans	-65.7	-37.8	174.7	0	0	0	0	0	112	M1 L2 K7 L8 V9	M1-A5 PolarHBondContact O-N 3.02Å; L2-A5 PolarHBondContact O-N 2.69Å; A5-K7 PolarHBondContact O-N 2.79Å; A5-L8 PolarHBondContact O-N 3.44Å; A5-V9 WeakPolarHBondContact O-CG2 3.45Å; A5-V9 PolarHBondContact O-N 3.05Å
6	A	51.3	Low	38.4	Very low	69 Å²	69	133.1 Å²	133.1	57%	0.57	71%	0.705	S	S	*	*	H	α-helix	trans	-66.2	-35.3	175.1	0	0	0	0	0	112.8	L2 A10	L2-A6 PolarHBondContact O-N 2.94Å; A6-A10 PolarHBondContact O-N 3.17Å
7	K	45.3	Very low	37.6	Very low	159 Å²	159	133.4 Å²	133.4	69%	0.691	71%	0.707	S	S	*	*	H	α-helix	trans	-72.5	-28.8	176.9	-76.1	-176	175.3	-177.6	0	113.6	S3 L4 A5	S3-K7 PolarHBondContact O-N 3.23Å; L4-K7 PolarHBondContact O-N 2.79Å; A5-K7 PolarHBondContact O-N 2.79Å
8	L	39.3	Very low	37	Very low	119 Å²	119	133.8 Å²	133.8	62%	0.623	72%	0.716	S	S	*	*	H	α-helix	trans	-73.7	-29.3	176.7	-88.3	158.5	0	0	0	113	L4 A5	L4-L8 PolarHBondContact O-N 3Å; L4-L8 VanDerWaalsContact O-N 3.16Å; A5-L8 PolarHBondContact O-N 3.44Å
9	V	44.8	Very low	36.8	Very low	95 Å²	95	132.9 Å²	132.9	58%	0.576	72%	0.718	S	S	*	*	H	α-helix	trans	-82.3	-26.3	179	-178.2	0	0	0	0	112.1	A5 F11 F12	A5-V9 WeakPolarHBondContact O-CG2 3.45Å; A5-V9 PolarHBondContact O-N 3.05Å; V9-F11 PolarHBondContact O-N 2.79Å; V9-F12 PolarHBondContact O-N 2.95Å
10	A	40.2	Very low	36.2	Very low	72 Å²	72	137.4 Å²	137.4	60%	0.595	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-65	-18	175.6	0	0	0	0	0	113.9	A6 F12	A6-A10 PolarHBondContact O-N 3.17Å; A10-F12 VanDerWaalsContact C-N 3.31Å; A10-F12 PolarHBondContact O-N 3.23Å
11	F	34.9	Very low	35.6	Very low	150 Å²	150	138.1 Å²	138.1	66%	0.658	72%	0.724	S	S	*	*	G	3₁₀ helix	trans	-74.5	-20.5	179.1	-150	-92.6	0	0	0	113.3	V9	V9-F11 PolarHBondContact O-N 2.79Å
12	F	33.1	Very low	35.2	Very low	178 Å²	178	136.4 Å²	136.4	78%	0.781	71%	0.713	S	S	*	*	G	3₁₀ helix	trans	-88.2	3.7	-176.4	-78.8	-79.1	0	0	0	114.8	V9 A10	V9-F12 PolarHBondContact O-N 2.95Å; A10-F12 VanDerWaalsContact C-N 3.31Å; A10-F12 PolarHBondContact O-N 3.23Å
13	W	30.6	Very low	34.3	Very low	219 Å²	219	133.8 Å²	133.8	83%	0.83	72%	0.715	S	S	*	*			trans	-113.6	37.1	179	-71.5	74.9	0	0	0	112.7	T15	W13-T15 PolarHBondContact O-N 2.99Å
14	R	24.9	Very low	33.5	Very low	214 Å²	214	133.2 Å²	133.2	81%	0.808	72%	0.722	S	S	*	*			trans	-75.9	99.1	162.7	-92	-174.8	174.1	178.7	-1.7	109.3
15	T	27.4	Very low	32.4	Very low	121 Å²	121	136.3 Å²	136.3	74%	0.742	73%	0.733	S	S	*	*			trans	-54.5	131.7	158.8	5.5	0	0	0	0	109.8	W13 D17	W13-T15 PolarHBondContact O-N 2.99Å; T15-D17 PolarHBondContact O-N 2.69Å
16	A	27.4	Very low	31.1	Very low	103 Å²	103	140.2 Å²	140.2	85%	0.851	75%	0.746	S	S	*	*			trans	-78.9	102.2	168.2	0	0	0	0	0	108.3
17	D	24.6	Very low	29.8	Very low	139 Å²	139	145.2 Å²	145.2	74%	0.743	76%	0.757	S	S	*	*			trans	-70.4	139.5	164.1	-69.6	-42.5	0	0	0	110.2	T15	T15-D17 PolarHBondContact O-N 2.69Å
18	T	27.1	Very low	29.5	Very low	141 Å²	141	143.2 Å²	143.2	87%	0.865	76%	0.761	S	S	*	*			trans	-171.9	152	138.6	26.5	0	0	0	0	111.2
19	P	33.3	Very low	28.7	Very low	116 Å²	116	146 Å²	146	75%	0.753	77%	0.77	S	S	*	*				-121.8	167	-121.4	40.6	-31	0	0	0	114.5
20	R	23.7	Very low	27.8	Very low	223 Å²	223	150.2 Å²	150.2	84%	0.842	79%	0.789	S	S	*	*			trans	-166.3	118.9	141.6	-109.4	169.4	176.3	176.4	-0.1	112
21	E	24.3	Very low	27.3	Very low	152 Å²	152	151 Å²	151	71%	0.71	80%	0.795	S	S	*	*			trans	47.4	137.1	135	-63.9	166.9	175.6	0	0	119.1
22	E	24.6	Very low	27	Very low	172 Å²	172	152.5 Å²	152.5	80%	0.804	80%	0.804	S	S	*	*			cis	-172.1	148.2	8.3	-113.7	175	-178	0	0	109.7
23	A	24.4	Very low	27	Very low	106 Å²	106	146.5 Å²	146.5	88%	0.876	79%	0.792	S	S	*	*			trans	61.7	120.6	144.2	0	0	0	0	0	124.7
24	G	23.7	Very low	27.5	Very low	73 Å²	73	143 Å²	143	75%	0.753	79%	0.79	S	S	*	*				133.7	98.1	122.1	0	0	0	0	0	122.4
25	Q	24.7	Very low	28.5	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	77%	0.767	S	S	*	*			trans	80.3	114.7	133.4	-64.4	-175.5	-15.1	0	0	125.7
26	L	22.8	Very low	29.8	Very low	140 Å²	140	137.1 Å²	137.1	73%	0.733	77%	0.765	S	S	*	*				67.2	115.9	120.5	-70.5	155.9	0	0	0	125.6
27	E	25.5	Very low	31.9	Very low	173 Å²	173	137 Å²	137	81%	0.808	75%	0.749	S	S	*	*			trans	42.8	166.1	134.6	-73.5	-169.9	173.5	0	0	124.2
28	P	38.6	Very low	34.4	Very low	118 Å²	118	136.6 Å²	136.6	77%	0.766	74%	0.741	S	S	*	*			cis	-135.8	171.5	-36.8	37.7	-19	0	0	0	115.5
29	E	21.6	Very low	37	Very low	177 Å²	177	134.8 Å²	134.8	83%	0.827	73%	0.73	S	S	*	*			trans	-99.9	149.5	-174.3	-64.3	170.3	142.1	0	0	115
30	L	26.9	Very low	39.3	Very low	184 Å²	184	131.5 Å²	131.5	96%	0.963	71%	0.707	S	S	*	*			trans	-143.7	157.3	160.8	-90.3	173.4	0	0	0	111.5
31	A	28.5	Very low	42.1	Very low	87 Å²	87	129.1 Å²	129.1	72%	0.719	70%	0.698	S	S	*	*			trans	-88.2	165.8	-157.3	0	0	0	0	0	119.1
32	E	28.2	Very low	44.8	Very low	183 Å²	183	122.3 Å²	122.3	86%	0.855	67%	0.668	S	S	*	*			trans	34	94.7	149	-67.6	-177.9	160.4	0	0	121.5
33	G	34.5	Very low	47.6	Very low	51 Å²	51	116.5 Å²	116.5	53%	0.526	65%	0.645	S	S	.	*			trans	179.7	138.7	150.8	0	0	0	0	0	114	K85	G33-K85 VanDerWaalsContact C-NZ 3.26Å; G33-K85 VanDerWaalsContact O-CE 3.28Å; G33-K85 WeakPolarHBondContact O-CE 3.46Å; G33-K85 PolarHBondContact O-NZ 2.73Å
34	D	40.4	Very low	50.3	Low	146 Å²	146	111.4 Å²	111.4	78%	0.781	60%	0.603	S	S	*	*			trans	48	92.6	165.6	-65.3	-11.3	0	0	0	120	K36	D34-K36 PolarHBondContact O-N 2.86Å
35	T	45.7	Very low	52.8	Low	55 Å²	55	110 Å²	110	34%	0.337	58%	0.579	S	S	.	*			trans	-76.6	91.5	162.3	51	0	0	0	0	110.2	L37 E82 E83	T35-L37 PolarHBondContact O-N 2.95Å; T35-L37 VanDerWaalsContact O-N 3.14Å; T35-E82 VanDerWaalsContact CB-CG 3.5Å; T35-E82 VanDerWaalsContact CB-OE1 3.23Å; T35-E82 WeakPolarHBondContact CB-OE1 3.16Å; T35-E82 HydrophobicContact CG2-CG 3.96Å; T35-E82 WeakPolarHBondContact CG2-OE1 3.45Å; T35-E82 PolarHBondContact OG1-OE1 3.32Å; T35-E83 VanDerWaalsContact CG2-O 3.27Å; T35-E83 WeakPolarHBondContact CG2-O 3.23Å
36	K	56.3	Low	55	Low	157 Å²	157	107.7 Å²	107.7	68%	0.683	56%	0.563	S	S	*	*			trans	-59.9	108.7	171.4	-84.1	175.8	176.1	168.9	0	110.4	D34	D34-K36 PolarHBondContact O-N 2.86Å
37	L	70.7	Confident	57.6	Low	100 Å²	100	103.6 Å²	103.6	52%	0.524	54%	0.538	S	S	.	.			trans	-71.8	135.2	172.1	-61.8	174.6	0	0	0	110.9	T35 V81 E82 I93	T35-L37 PolarHBondContact O-N 2.95Å; T35-L37 VanDerWaalsContact O-N 3.14Å; L37-V81 VanDerWaalsContact CA-O 3.31Å; L37-V81 WeakPolarHBondContact CA-O 3.27Å; L37-E82 HydrophobicContact CD2-CB 3.71Å; L37-E82 HydrophobicContact CD2-CG 3.9Å; L37-I93 HydrophobicContact CD1-CD1 4.46Å; L37-I93 HydrophobicContact CD2-CD1 4.1Å
38	K	76.9	Confident	59.7	Low	131 Å²	131	97.9 Å²	97.9	57%	0.57	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.2	175.9	-69.2	177.5	-177.8	169.2	0	111	V81	K38-V81 HydrophobicContact CB-CG2 3.94Å; K38-V81 PolarHBondContact N-O 3.05Å; K38-V81 WeakPolarHBondContact O-CG2 3.34Å; K38-V81 PolarHBondContact O-N 2.82Å
39	T	81.1	Confident	60.9	Low	103 Å²	103	97.7 Å²	97.7	63%	0.632	52%	0.518	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.6	172.6	-53.9	0	0	0	0	109.6	I78 A79	T39-I78 HydrophobicContact CG2-CG2 3.94Å; T39-A79 WeakPolarHBondContact CA-O 3.45Å
40	V	81.4	Confident	63	Low	47 Å²	47	94 Å²	94	29%	0.285	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	139	-176.5	-73.2	0	0	0	0	109.8	I58 A79 V81	V40-I58 HydrophobicContact CG2-CD1 3.69Å; V40-A79 HydrophobicContact CG2-CB 4.27Å; V40-A79 PolarHBondContact N-O 2.91Å; V40-A79 PolarHBondContact O-N 3.03Å; V40-V81 HydrophobicContact CG2-CG1 3.68Å; V40-V81 HydrophobicContact CG2-CG2 4.24Å
41	R	82.6	Confident	65.5	Low	173 Å²	173	89 Å²	89	65%	0.653	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	131.3	166.9	-172.7	179.4	-175.9	171.6	2	106.6	E76	R41-E76 IonicContact CZ-OE2 3.29Å; R41-E76 VanDerWaalsContact CZ-OE2 3.29Å; R41-E76 IonicContact NE-OE2 3.5Å; R41-E76 PolarHBondContact NE-OE2 3.3Å; R41-E76 VanDerWaalsContact NE-OE2 3.13Å; R41-E76 IonicContact NH2-OE1 3.9Å; R41-E76 IonicContact NH2-OE2 2.66Å; R41-E76 PolarHBondContact NH2-OE2 2.85Å
42	G	82.4	Confident	68.1	Low	8 Å²	8	84.9 Å²	84.9	8%	0.082	44%	0.439	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-158.2	176.1	-179	0	0	0	0	0	111	D55 V77	G42-D55 VanDerWaalsContact CA-OD2 3.31Å; G42-D55 WeakPolarHBondContact CA-OD2 3.44Å; G42-V77 PolarHBondContact N-O 3Å; G42-V77 VanDerWaalsContact N-O 3.15Å; G42-V77 WeakPolarHBondContact O-CG2 3.34Å; G42-V77 PolarHBondContact O-N 3.05Å
43	V	82.7	Confident	70.5	Confident	50 Å²	50	78.3 Å²	78.3	30%	0.303	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	134	177.4	178.2	0	0	0	0	107.8	T45 I54 D55 G74 E76	V43-T45 PolarHBondContact O-N 3.1Å; V43-I54 CarbonylContact O-C 3.53Å; V43-I54 WeakPolarHBondContact O-CA 3.46Å; V43-I54 WeakPolarHBondContact O-CG2 3.31Å; V43-D55 PolarHBondContact N-OD1 2.81Å; V43-D55 PolarHBondContact O-N 3.4Å; V43-G74 VanDerWaalsContact CG1-CA 3.42Å; V43-G74 WeakPolarHBondContact CG1-O 3.46Å; V43-E76 HydrophobicContact CG2-CG 4.36Å
44	V	82.2	Confident	72.8	Confident	0 Å²	0	75.9 Å²	75.9	0%	0	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	106.7	169.3	177.6	0	0	0	0	107.8	R46 M53 F60 L71 N72 V73 G74 Q75 V77	V44-R46 WeakPolarHBondContact CG1-O 3.24Å; V44-M53 CarbonylContact C-O 3.44Å; V44-M53 WeakPolarHBondContact CA-O 3.37Å; V44-F60 HydrophobicContact CG1-CZ 4.44Å; V44-L71 HydrophobicContact CG2-CB 4.39Å; V44-N72 VanDerWaalsContact CB-O 3.28Å; V44-N72 WeakPolarHBondContact CB-O 3.31Å; V44-V73 HydrophobicContact CG1-CG2 4.36Å; V44-V73 CarbonylContact O-C 3.5Å; V44-V73 WeakPolarHBondContact O-CA 3.38Å; V44-G74 PolarHBondContact O-N 3.05Å; V44-Q75 PolarHBondContact N-O 3.18Å; V44-V77 HydrophobicContact CG2-CB 4.32Å; V44-V77 HydrophobicContact CG2-CG1 3.55Å; V44-V77 HydrophobicContact CG2-CG2 3.76Å
45	T	74.5	Confident	74.9	Confident	42 Å²	42	72.1 Å²	72.1	26%	0.258	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-25.2	176.4	56.9	0	0	0	0	111.7	V43 M53 D55 D56 V73	V43-T45 PolarHBondContact O-N 3.1Å; T45-M53 PolarHBondContact N-O 2.92Å; T45-D55 VanDerWaalsContact CG2-CA 3.41Å; T45-D56 VanDerWaalsContact CB-OD1 3.24Å; T45-D56 WeakPolarHBondContact CB-OD1 3.45Å; T45-D56 WeakPolarHBondContact OG1-CA 3.49Å; T45-D56 PolarHBondContact OG1-N 2.83Å; T45-D56 PolarHBondContact OG1-OD1 2.64Å; T45-V73 WeakPolarHBondContact O-CG1 3.44Å
46	R	71.1	Confident	76.4	Confident	137 Å²	137	73.4 Å²	73.4	52%	0.517	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	140.9	178.4	-54.5	-176.7	-170.9	-158.9	-6.7	109.9	V44 G52 M53 D56	V44-R46 WeakPolarHBondContact CG1-O 3.24Å; R46-G52 CarbonylContact O-C 3.53Å; R46-G52 WeakPolarHBondContact O-CA 3.11Å; R46-M53 HydrophobicContact CB-CB 3.98Å; R46-M53 HydrophobicContact CB-CG 4.26Å; R46-M53 HydrophobicContact CG-CB 4.4Å; R46-M53 PolarHBondContact N-O 2.9Å; R46-M53 PolarHBondContact O-N 2.95Å; R46-M53 VanDerWaalsContact O-O 3.13Å; R46-D56 IonicContact CZ-OD1 2.87Å; R46-D56 IonicContact NE-OD1 2.67Å; R46-D56 PolarHBondContact NE-OD1 2.87Å; R46-D56 IonicContact NH2-OD1 3.71Å
47	Y	77.3	Confident	77.4	Confident	53 Å²	53	72.7 Å²	72.7	21%	0.208	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	116.2	173.1	-171	-121.8	0	0	0	107.5	F60 V65 L70 L71	Y47-F60 HydrophobicContact CD2-CE1 4.44Å; Y47-F60 AromaticContact CD2-CE2 3.5Å; Y47-F60 HydrophobicContact CD2-CE2 3.5Å; Y47-F60 VanDerWaalsContact CD2-CE2 3.5Å; Y47-F60 AromaticContact CD2-CZ 3.34Å; Y47-F60 HydrophobicContact CD2-CZ 3.34Å; Y47-F60 HydrophobicContact CE2-CD2 4.41Å; Y47-F60 AromaticContact CE2-CE2 3.34Å; Y47-F60 HydrophobicContact CE2-CE2 3.34Å; Y47-F60 AromaticContact CE2-CZ 3.71Å; Y47-F60 HydrophobicContact CE2-CZ 3.71Å; Y47-F60 HydrophobicContact CG-CZ 4.39Å; Y47-V65 HydrophobicContact CE2-CG2 4.5Å; Y47-L70 HydrophobicContact CE1-CD2 4.06Å; Y47-L71 WeakPolarHBondContact CD1-O 3.34Å; Y47-L71 HydrophobicContact CE1-CB 4.36Å; Y47-L71 VanDerWaalsContact CE1-O 3.3Å; Y47-L71 WeakPolarHBondContact CE1-O 3.21Å
48	C	69.4	Low	78.1	Confident	53 Å²	53	68.3 Å²	68.3	36%	0.358	35%	0.346	S	S	.	.			trans	-112.8	173.2	179.7	-63.5	0	0	0	0	108.5	D50 Y51	C48-D50 VanDerWaalsContact C-N 3.3Å; C48-D50 PolarHBondContact O-N 3.01Å; C48-Y51 CarbonylContact C-O 3.49Å; C48-Y51 VanDerWaalsContact C-O 3.28Å; C48-Y51 VanDerWaalsContact CA-O 3.25Å; C48-Y51 WeakPolarHBondContact CA-O 3.48Å; C48-Y51 HydrophobicContact CB-CD1 4.26Å; C48-Y51 HydrophobicContact CB-CE1 3.92Å; C48-Y51 HydrophobicContact CB-CE2 4.31Å; C48-Y51 WeakPolarHBondContact CB-O 3.37Å; C48-Y51 PolarHBondContact N-O 3.15Å
49	S	63.8	Low	78.4	Confident	115 Å²	115	66.7 Å²	66.7	80%	0.804	34%	0.337	S	S	*	.	S	Bend	trans	-58	-33.7	-168.9	37.1	0	0	0	0	115.6	S62	S49-S62 PolarHBondContact O-OG 2.69Å
50	D	65.8	Low	78.7	Confident	98 Å²	98	61.8 Å²	61.8	52%	0.524	31%	0.307	S	S	.	.	S	Bend	trans	-121.3	-7.4	-173.4	54.4	-37.6	0	0	0	112.9	C48 S61 S62	C48-D50 VanDerWaalsContact C-N 3.3Å; C48-D50 PolarHBondContact O-N 3.01Å; D50-S61 CarbonylContact O-C 3.47Å; D50-S61 WeakPolarHBondContact O-CA 3.43Å; D50-S62 WeakPolarHBondContact CA-OG 3.32Å; D50-S62 PolarHBondContact N-OG 2.74Å; D50-S62 PolarHBondContact O-N 3.21Å; D50-S62 PolarHBondContact O-OG 2.83Å
51	Y	79.6	Confident	78.7	Confident	81 Å²	81	61.2 Å²	61.2	32%	0.318	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	166.1	179.1	72.8	-87	0	0	0	113	C48 Y59 F60 S62	C48-Y51 CarbonylContact C-O 3.49Å; C48-Y51 VanDerWaalsContact C-O 3.28Å; C48-Y51 VanDerWaalsContact CA-O 3.25Å; C48-Y51 WeakPolarHBondContact CA-O 3.48Å; C48-Y51 HydrophobicContact CB-CD1 4.26Å; C48-Y51 HydrophobicContact CB-CE1 3.92Å; C48-Y51 HydrophobicContact CB-CE2 4.31Å; C48-Y51 WeakPolarHBondContact CB-O 3.37Å; C48-Y51 PolarHBondContact N-O 3.15Å; Y51-Y59 VanDerWaalsContact CB-CE2 3.46Å; Y51-Y59 HydrophobicContact CD1-CE2 4.33Å; Y51-Y59 AromaticContact CD2-CD2 3.75Å; Y51-Y59 HydrophobicContact CD2-CD2 3.75Å; Y51-Y59 AromaticContact CD2-CE2 3.38Å; Y51-Y59 HydrophobicContact CD2-CE2 3.38Å; Y51-Y59 HydrophobicContact CE2-CD2 4.49Å; Y51-Y59 HydrophobicContact CE2-CE2 4.21Å; Y51-Y59 HydrophobicContact CG-CD2 4.27Å; Y51-Y59 AromaticContact CG-CE2 3.46Å; Y51-Y59 HydrophobicContact CG-CE2 3.46Å; Y51-Y59 VanDerWaalsContact CG-CE2 3.46Å; Y51-F60 CarbonylContact C-O 3.49Å; Y51-F60 VanDerWaalsContact C-O 3.26Å; Y51-F60 WeakPolarHBondContact CA-O 3.26Å; Y51-F60 WeakPolarHBondContact CB-O 2.93Å; Y51-S62 PolarHBondContact N-OG 2.94Å
52	G	83.8	Confident	78.5	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.1	-179.5	168.2	0	0	0	0	0	113.5	R46 Y59 F60	R46-G52 CarbonylContact O-C 3.53Å; R46-G52 WeakPolarHBondContact O-CA 3.11Å; G52-Y59 CarbonylContact O-C 3.53Å; G52-Y59 WeakPolarHBondContact O-CA 3.38Å; G52-F60 VanDerWaalsContact CA-CE1 3.43Å; G52-F60 PolarHBondContact N-O 2.9Å; G52-F60 VanDerWaalsContact O-CD1 3.26Å; G52-F60 WeakPolarHBondContact O-CD1 3.14Å; G52-F60 PolarHBondContact O-N 3.14Å
53	M	79.5	Confident	78.2	Confident	44 Å²	44	61.8 Å²	61.8	22%	0.217	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	144.7	173.4	-58.6	-171.7	72.4	0	0	112	V44 T45 R46 D56 I58	V44-M53 CarbonylContact C-O 3.44Å; V44-M53 WeakPolarHBondContact CA-O 3.37Å; T45-M53 PolarHBondContact N-O 2.92Å; R46-M53 HydrophobicContact CB-CB 3.98Å; R46-M53 HydrophobicContact CB-CG 4.26Å; R46-M53 HydrophobicContact CG-CB 4.4Å; R46-M53 PolarHBondContact N-O 2.9Å; R46-M53 PolarHBondContact O-N 2.95Å; R46-M53 VanDerWaalsContact O-O 3.13Å; M53-D56 VanDerWaalsContact CE-C 3.46Å; M53-D56 WeakPolarHBondContact CE-O 3.3Å; M53-I58 CarbonylContact C-O 3.52Å; M53-I58 WeakPolarHBondContact CA-O 3.2Å
54	I	82.1	Confident	78.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	129.1	172.8	-53	168.7	0	0	0	107.7	V43 D56 M57 I58 F60 V77 A79 V95	V43-I54 CarbonylContact O-C 3.53Å; V43-I54 WeakPolarHBondContact O-CA 3.46Å; V43-I54 WeakPolarHBondContact O-CG2 3.31Å; I54-D56 PolarHBondContact O-N 2.66Å; I54-D56 VanDerWaalsContact O-N 3.1Å; I54-M57 PolarHBondContact O-N 3.13Å; I54-I58 HydrophobicContact CB-CB 4.13Å; I54-I58 HydrophobicContact CB-CD1 4.34Å; I54-I58 HydrophobicContact CD1-CG2 4.47Å; I54-I58 HydrophobicContact CG2-CD1 4.46Å; I54-I58 PolarHBondContact N-O 2.94Å; I54-I58 PolarHBondContact O-N 3.43Å; I54-F60 HydrophobicContact CD1-CD1 4.2Å; I54-F60 HydrophobicContact CD1-CE1 4.38Å; I54-F60 HydrophobicContact CG1-CD1 3.97Å; I54-F60 HydrophobicContact CG1-CE1 3.85Å; I54-V77 HydrophobicContact CD1-CG2 3.71Å; I54-V77 HydrophobicContact CG1-CG2 3.93Å; I54-V77 HydrophobicContact CG2-CG2 4.15Å; I54-A79 HydrophobicContact CD1-CB 3.29Å; I54-V95 HydrophobicContact CD1-CG1 4.39Å; I54-V95 HydrophobicContact CD1-CG2 4.49Å
55	D	84	Confident	78.1	Confident	68 Å²	68	61 Å²	61	36%	0.364	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	28.7	-177.3	-56.8	-30.1	0	0	0	115.2	G42 V43 T45 M57	G42-D55 VanDerWaalsContact CA-OD2 3.31Å; G42-D55 WeakPolarHBondContact CA-OD2 3.44Å; V43-D55 PolarHBondContact N-OD1 2.81Å; V43-D55 PolarHBondContact O-N 3.4Å; T45-D55 VanDerWaalsContact CG2-CA 3.41Å; D55-M57 PolarHBondContact O-N 3.02Å
56	D	76.9	Confident	77.8	Confident	82 Å²	82	62.7 Å²	62.7	44%	0.439	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	10.7	-172.7	-76.9	-26.3	0	0	0	114.8	T45 R46 M53 I54	T45-D56 VanDerWaalsContact CB-OD1 3.24Å; T45-D56 WeakPolarHBondContact CB-OD1 3.45Å; T45-D56 WeakPolarHBondContact OG1-CA 3.49Å; T45-D56 PolarHBondContact OG1-N 2.83Å; T45-D56 PolarHBondContact OG1-OD1 2.64Å; R46-D56 IonicContact CZ-OD1 2.87Å; R46-D56 IonicContact NE-OD1 2.67Å; R46-D56 PolarHBondContact NE-OD1 2.87Å; R46-D56 IonicContact NH2-OD1 3.71Å; M53-D56 VanDerWaalsContact CE-C 3.46Å; M53-D56 WeakPolarHBondContact CE-O 3.3Å; I54-D56 PolarHBondContact O-N 2.66Å; I54-D56 VanDerWaalsContact O-N 3.1Å
57	M	77.5	Confident	77.4	Confident	141 Å²	141	57.9 Å²	57.9	70%	0.695	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	-22.4	-175.8	-68.4	-162.6	-72.6	0	0	114.9	I54 D55	I54-M57 PolarHBondContact O-N 3.13Å; D55-M57 PolarHBondContact O-N 3.02Å
58	I	85.3	Confident	76.3	Confident	9 Å²	9	66.6 Å²	66.6	5%	0.046	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	119.1	-171.8	-61.7	154.3	0	0	0	110.4	V40 M53 I54 V81 L90 A92	V40-I58 HydrophobicContact CG2-CD1 3.69Å; M53-I58 CarbonylContact C-O 3.52Å; M53-I58 WeakPolarHBondContact CA-O 3.2Å; I54-I58 HydrophobicContact CB-CB 4.13Å; I54-I58 HydrophobicContact CB-CD1 4.34Å; I54-I58 HydrophobicContact CD1-CG2 4.47Å; I54-I58 HydrophobicContact CG2-CD1 4.46Å; I54-I58 PolarHBondContact N-O 2.94Å; I54-I58 PolarHBondContact O-N 3.43Å; I58-V81 HydrophobicContact CB-CG1 4.42Å; I58-V81 HydrophobicContact CD1-CG1 4.09Å; I58-V81 HydrophobicContact CG1-CG1 4.16Å; I58-V81 HydrophobicContact CG2-CB 4.46Å; I58-V81 HydrophobicContact CG2-CG1 3.39Å; I58-L90 WeakPolarHBondContact CA-O 3.33Å; I58-L90 HydrophobicContact CB-CB 4.49Å; I58-L90 HydrophobicContact CG1-CB 3.97Å; I58-L90 HydrophobicContact CG1-CD1 4.07Å; I58-A92 HydrophobicContact CG2-CB 3.81Å
59	Y	83.6	Confident	75.7	Confident	97 Å²	97	68.6 Å²	68.6	38%	0.38	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	137.7	179.3	167.9	-88	0	0	0	112.6	Y51 G52 L90 K91 A92	Y51-Y59 VanDerWaalsContact CB-CE2 3.46Å; Y51-Y59 HydrophobicContact CD1-CE2 4.33Å; Y51-Y59 AromaticContact CD2-CD2 3.75Å; Y51-Y59 HydrophobicContact CD2-CD2 3.75Å; Y51-Y59 AromaticContact CD2-CE2 3.38Å; Y51-Y59 HydrophobicContact CD2-CE2 3.38Å; Y51-Y59 HydrophobicContact CE2-CD2 4.49Å; Y51-Y59 HydrophobicContact CE2-CE2 4.21Å; Y51-Y59 HydrophobicContact CG-CD2 4.27Å; Y51-Y59 AromaticContact CG-CE2 3.46Å; Y51-Y59 HydrophobicContact CG-CE2 3.46Å; Y51-Y59 VanDerWaalsContact CG-CE2 3.46Å; G52-Y59 CarbonylContact O-C 3.53Å; G52-Y59 WeakPolarHBondContact O-CA 3.38Å; Y59-L90 PolarHBondContact N-O 3.03Å; Y59-K91 HydrophobicContact CD1-CG 4.13Å; Y59-K91 CarbonylContact O-C 3.52Å; Y59-K91 WeakPolarHBondContact O-CA 3.1Å; Y59-A92 PolarHBondContact O-N 3.44Å
60	F	87.7	Confident	75.6	Confident	0 Å²	0	69.3 Å²	69.3	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	149.5	174.4	66	-87.8	0	0	0	112.4	V44 Y47 Y51 G52 I54 V65 L71 A92 V95	V44-F60 HydrophobicContact CG1-CZ 4.44Å; Y47-F60 HydrophobicContact CD2-CE1 4.44Å; Y47-F60 AromaticContact CD2-CE2 3.5Å; Y47-F60 HydrophobicContact CD2-CE2 3.5Å; Y47-F60 VanDerWaalsContact CD2-CE2 3.5Å; Y47-F60 AromaticContact CD2-CZ 3.34Å; Y47-F60 HydrophobicContact CD2-CZ 3.34Å; Y47-F60 HydrophobicContact CE2-CD2 4.41Å; Y47-F60 AromaticContact CE2-CE2 3.34Å; Y47-F60 HydrophobicContact CE2-CE2 3.34Å; Y47-F60 AromaticContact CE2-CZ 3.71Å; Y47-F60 HydrophobicContact CE2-CZ 3.71Å; Y47-F60 HydrophobicContact CG-CZ 4.39Å; Y51-F60 CarbonylContact C-O 3.49Å; Y51-F60 VanDerWaalsContact C-O 3.26Å; Y51-F60 WeakPolarHBondContact CA-O 3.26Å; Y51-F60 WeakPolarHBondContact CB-O 2.93Å; G52-F60 VanDerWaalsContact CA-CE1 3.43Å; G52-F60 PolarHBondContact N-O 2.9Å; G52-F60 VanDerWaalsContact O-CD1 3.26Å; G52-F60 WeakPolarHBondContact O-CD1 3.14Å; G52-F60 PolarHBondContact O-N 3.14Å; I54-F60 HydrophobicContact CD1-CD1 4.2Å; I54-F60 HydrophobicContact CD1-CE1 4.38Å; I54-F60 HydrophobicContact CG1-CD1 3.97Å; I54-F60 HydrophobicContact CG1-CE1 3.85Å; F60-V65 HydrophobicContact CD2-CG2 4.41Å; F60-V65 HydrophobicContact CE2-CG2 4.05Å; F60-L71 HydrophobicContact CE2-CD1 3.95Å; F60-L71 HydrophobicContact CZ-CD1 4.06Å; F60-A92 HydrophobicContact CB-CB 3.57Å; F60-V95 HydrophobicContact CB-CG2 3.79Å; F60-V95 HydrophobicContact CD1-CG2 4.3Å; F60-V95 HydrophobicContact CD2-CG2 3.72Å; F60-V95 HydrophobicContact CE2-CG2 4.26Å; F60-V95 HydrophobicContact CG-CG2 3.72Å
61	S	81.9	Confident	75.8	Confident	35 Å²	35	64.8 Å²	64.8	25%	0.245	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	153.5	173.3	53	0	0	0	0	112.1	D50 D63 A64	D50-S61 CarbonylContact O-C 3.47Å; D50-S61 WeakPolarHBondContact O-CA 3.43Å; S61-D63 PolarHBondContact O-N 2.99Å; S61-D63 VanDerWaalsContact O-N 3.14Å; S61-A64 WeakPolarHBondContact O-CB 3.39Å; S61-A64 PolarHBondContact O-N 3.04Å
62	S	76.7	Confident	75.7	Confident	31 Å²	31	66.1 Å²	66.1	22%	0.217	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-56.5	-31.3	179.1	-61.2	0	0	0	0	113.9	S49 D50 Y51 A64 V65	S49-S62 PolarHBondContact O-OG 2.69Å; D50-S62 WeakPolarHBondContact CA-OG 3.32Å; D50-S62 PolarHBondContact N-OG 2.74Å; D50-S62 PolarHBondContact O-N 3.21Å; D50-S62 PolarHBondContact O-OG 2.83Å; Y51-S62 PolarHBondContact N-OG 2.94Å; S62-A64 PolarHBondContact O-N 3.44Å; S62-V65 PolarHBondContact O-N 2.98Å
63	D	78	Confident	75.1	Confident	161 Å²	161	70.3 Å²	70.3	86%	0.861	37%	0.366	S	S	*	.	G	3₁₀ helix	trans	-66.1	-15.3	175.5	-63.2	-25.9	0	0	0	113.7	S61 V65	S61-D63 PolarHBondContact O-N 2.99Å; S61-D63 VanDerWaalsContact O-N 3.14Å; D63-V65 VanDerWaalsContact C-N 3.32Å
64	A	82.5	Confident	74.8	Confident	8 Å²	8	70.7 Å²	70.7	7%	0.066	38%	0.382	C	S	.	.	G	3₁₀ helix	trans	-80.1	-9.5	178.9	0	0	0	0	0	113.4	S61 S62 I93 R94 V95	S61-A64 WeakPolarHBondContact O-CB 3.39Å; S61-A64 PolarHBondContact O-N 3.04Å; S62-A64 PolarHBondContact O-N 3.44Å; A64-I93 WeakPolarHBondContact CB-O 3.37Å; A64-R94 CarbonylContact O-C 3.38Å; A64-R94 VanDerWaalsContact O-CA 3.3Å; A64-R94 WeakPolarHBondContact O-CA 3.16Å; A64-V95 HydrophobicContact CB-CG2 4.4Å; A64-V95 PolarHBondContact O-N 3.49Å
65	V	79.1	Confident	74.7	Confident	25 Å²	25	72.6 Å²	72.6	15%	0.152	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-82.1	116.2	-178.3	-175	0	0	0	0	110.4	Y47 F60 S62 D63 L71 V95	Y47-V65 HydrophobicContact CE2-CG2 4.5Å; F60-V65 HydrophobicContact CD2-CG2 4.41Å; F60-V65 HydrophobicContact CE2-CG2 4.05Å; S62-V65 PolarHBondContact O-N 2.98Å; D63-V65 VanDerWaalsContact C-N 3.32Å; V65-L71 HydrophobicContact CB-CD1 4.37Å; V65-L71 HydrophobicContact CG1-CD1 3.89Å; V65-L71 HydrophobicContact CG1-CD2 4.48Å; V65-L71 HydrophobicContact CG1-CG 3.88Å; V65-L71 HydrophobicContact CG2-CD1 3.57Å; V65-L71 HydrophobicContact CG2-CG 4.27Å; V65-V95 WeakPolarHBondContact CA-O 3.35Å; V65-V95 HydrophobicContact CG2-CB 4.47Å
66	T	68.1	Low	74.3	Confident	79 Å²	79	73.4 Å²	73.4	49%	0.485	39%	0.393	S	S	.	.			trans	-87.2	-22	-173.7	56.4	0	0	0	0	114.4	R94 V95 E96	T66-R94 HydrophobicContact CG2-CG 3.76Å; T66-V95 PolarHBondContact N-O 2.92Å; T66-V95 VanDerWaalsContact N-O 3.14Å; T66-E96 WeakPolarHBondContact OG1-CG 3.36Å; T66-E96 PolarHBondContact OG1-OE1 3.34Å
67	S	62.6	Low	74.8	Confident	36 Å²	36	69.5 Å²	69.5	25%	0.252	37%	0.372	S	S	.	.	S	Bend	trans	-79.6	137	170.3	61.9	0	0	0	0	110.2	V69	S67-V69 PolarHBondContact O-N 2.93Å; S67-V69 PolarHBondContact OG-O 2.73Å
68	R	55.6	Low	75.1	Confident	235 Å²	235	66.4 Å²	66.4	89%	0.887	36%	0.357	S	S	*	.	S	Bend	trans	-65.5	7.1	168.8	-68.2	-173.3	179.4	-178.5	0.9	113.9
69	V	56	Low	75.2	Confident	96 Å²	96	66 Å²	66	58%	0.582	36%	0.355	S	S	*	.	S	Bend	trans	-97.6	130.9	177.8	-177.3	0	0	0	0	107.8	S67	S67-V69 PolarHBondContact O-N 2.93Å; S67-V69 PolarHBondContact OG-O 2.73Å
70	L	60.8	Low	75.2	Confident	130 Å²	130	63 Å²	63	68%	0.681	35%	0.347	S	S	*	.	P	Polyproline II helix	trans	-62.9	137.1	173.5	-75.6	158.9	0	0	0	110.1	Y47	Y47-L70 HydrophobicContact CE1-CD2 4.06Å
71	L	70.6	Confident	75.3	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-78.1	140.6	169.9	-61.3	172.8	0	0	0	109.5	V44 Y47 F60 V65 V77 V95 A97	V44-L71 HydrophobicContact CG2-CB 4.39Å; Y47-L71 WeakPolarHBondContact CD1-O 3.34Å; Y47-L71 HydrophobicContact CE1-CB 4.36Å; Y47-L71 VanDerWaalsContact CE1-O 3.3Å; Y47-L71 WeakPolarHBondContact CE1-O 3.21Å; F60-L71 HydrophobicContact CE2-CD1 3.95Å; F60-L71 HydrophobicContact CZ-CD1 4.06Å; V65-L71 HydrophobicContact CB-CD1 4.37Å; V65-L71 HydrophobicContact CG1-CD1 3.89Å; V65-L71 HydrophobicContact CG1-CD2 4.48Å; V65-L71 HydrophobicContact CG1-CG 3.88Å; V65-L71 HydrophobicContact CG2-CD1 3.57Å; V65-L71 HydrophobicContact CG2-CG 4.27Å; L71-V77 HydrophobicContact CD1-CG1 4.19Å; L71-V77 HydrophobicContact CD2-CG1 3.6Å; L71-V77 HydrophobicContact CG-CG1 4.42Å; L71-V95 HydrophobicContact CD1-CB 4.03Å; L71-V95 HydrophobicContact CD1-CG1 3.33Å; L71-A97 HydrophobicContact CD2-CB 3.77Å
72	N	77.1	Confident	75.3	Confident	109 Å²	109	64.7 Å²	64.7	58%	0.583	35%	0.351	S	S	*	.	P	Polyproline II helix	trans	-99.3	150.4	172	-69.8	-36.7	0	0	0	110.9	V44 G74 Q75	V44-N72 VanDerWaalsContact CB-O 3.28Å; V44-N72 WeakPolarHBondContact CB-O 3.31Å; N72-G74 PolarHBondContact O-N 2.74Å; N72-Q75 HydrophobicContact CB-CB 4.18Å; N72-Q75 WeakPolarHBondContact O-CB 3.24Å; N72-Q75 PolarHBondContact O-N 3.21Å
73	V	72.5	Confident	75.3	Confident	88 Å²	88	67.8 Å²	67.8	53%	0.533	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	129.6	161.7	176.8	0	0	0	0	108.9	V44 T45	V44-V73 HydrophobicContact CG1-CG2 4.36Å; V44-V73 CarbonylContact O-C 3.5Å; V44-V73 WeakPolarHBondContact O-CA 3.38Å; T45-V73 WeakPolarHBondContact O-CG1 3.44Å
74	G	72.3	Confident	74.8	Confident	53 Å²	53	63.5 Å²	63.5	55%	0.546	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	92.8	-8.8	-169.8	0	0	0	0	0	114.4	V43 V44 N72	V43-G74 VanDerWaalsContact CG1-CA 3.42Å; V43-G74 WeakPolarHBondContact CG1-O 3.46Å; V44-G74 PolarHBondContact O-N 3.05Å; N72-G74 PolarHBondContact O-N 2.74Å
75	Q	79.7	Confident	73.9	Confident	39 Å²	39	68.4 Å²	68.4	18%	0.182	36%	0.359	C	S	.	.			trans	-78	134.7	-179.7	-171.7	170.1	-14.2	0	0	111.6	V44 N72 V77	V44-Q75 PolarHBondContact N-O 3.18Å; N72-Q75 HydrophobicContact CB-CB 4.18Å; N72-Q75 WeakPolarHBondContact O-CB 3.24Å; N72-Q75 PolarHBondContact O-N 3.21Å; Q75-V77 PolarHBondContact O-N 3.18Å
76	E	76.4	Confident	72.7	Confident	86 Å²	86	73.3 Å²	73.3	40%	0.402	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	130.8	168.7	-76.3	-161.8	173.9	0	0	111.2	R41 V43 V98	R41-E76 IonicContact CZ-OE2 3.29Å; R41-E76 VanDerWaalsContact CZ-OE2 3.29Å; R41-E76 IonicContact NE-OE2 3.5Å; R41-E76 PolarHBondContact NE-OE2 3.3Å; R41-E76 VanDerWaalsContact NE-OE2 3.13Å; R41-E76 IonicContact NH2-OE1 3.9Å; R41-E76 IonicContact NH2-OE2 2.66Å; R41-E76 PolarHBondContact NH2-OE2 2.85Å; V43-E76 HydrophobicContact CG2-CG 4.36Å; E76-V98 HydrophobicContact CB-CB 4.37Å; E76-V98 HydrophobicContact CB-CG2 4.2Å; E76-V98 PolarHBondContact O-N 3.39Å
77	V	86.8	Confident	72.1	Confident	0 Å²	0	73.3 Å²	73.3	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	154.9	178.9	-66.7	0	0	0	0	110.9	G42 V44 I54 L71 Q75 V95 E96	G42-V77 PolarHBondContact N-O 3Å; G42-V77 VanDerWaalsContact N-O 3.15Å; G42-V77 WeakPolarHBondContact O-CG2 3.34Å; G42-V77 PolarHBondContact O-N 3.05Å; V44-V77 HydrophobicContact CG2-CB 4.32Å; V44-V77 HydrophobicContact CG2-CG1 3.55Å; V44-V77 HydrophobicContact CG2-CG2 3.76Å; I54-V77 HydrophobicContact CD1-CG2 3.71Å; I54-V77 HydrophobicContact CG1-CG2 3.93Å; I54-V77 HydrophobicContact CG2-CG2 4.15Å; L71-V77 HydrophobicContact CD1-CG1 4.19Å; L71-V77 HydrophobicContact CD2-CG1 3.6Å; L71-V77 HydrophobicContact CG-CG1 4.42Å; Q75-V77 PolarHBondContact O-N 3.18Å; V77-V95 HydrophobicContact CB-CG1 3.84Å; V77-V95 HydrophobicContact CG1-CG1 3.96Å; V77-V95 HydrophobicContact CG2-CG1 4.14Å; V77-E96 CarbonylContact C-O 3.58Å; V77-E96 WeakPolarHBondContact CA-O 3.06Å; V77-E96 WeakPolarHBondContact CB-O 3.17Å
78	I	83	Confident	71.8	Confident	75 Å²	75	78 Å²	78	39%	0.385	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	125.5	166.1	-58.6	173.1	0	0	0	107	T39 E96 V98	T39-I78 HydrophobicContact CG2-CG2 3.94Å; I78-E96 PolarHBondContact N-O 3.25Å; I78-E96 PolarHBondContact O-N 2.74Å; I78-V98 HydrophobicContact CD1-CG2 4.41Å; I78-V98 HydrophobicContact CG1-CG2 4.15Å
79	A	87.8	Confident	72.4	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.008	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	144.7	-178.1	0	0	0	0	0	113.1	T39 V40 I54 A92 R94	T39-A79 WeakPolarHBondContact CA-O 3.45Å; V40-A79 HydrophobicContact CG2-CB 4.27Å; V40-A79 PolarHBondContact N-O 2.91Å; V40-A79 PolarHBondContact O-N 3.03Å; I54-A79 HydrophobicContact CD1-CB 3.29Å; A79-A92 HydrophobicContact CB-CB 4.25Å; A79-R94 WeakPolarHBondContact CA-O 3.22Å
80	V	84.3	Confident	73.6	Confident	34 Å²	34	66.7 Å²	66.7	21%	0.206	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	121	170.6	-177.7	0	0	0	0	108.4	A92 I93 R94	V80-A92 VanDerWaalsContact O-CA 3.24Å; V80-A92 WeakPolarHBondContact O-CA 3.25Å; V80-I93 HydrophobicContact CB-CG1 4.2Å; V80-I93 HydrophobicContact CG1-CD1 4.09Å; V80-I93 HydrophobicContact CG1-CG1 4.05Å; V80-I93 PolarHBondContact O-N 3.07Å; V80-R94 HydrophobicContact CB-CB 4.36Å; V80-R94 HydrophobicContact CG2-CB 4.37Å; V80-R94 PolarHBondContact N-O 2.85Å
81	V	88.5	Confident	74.7	Confident	5 Å²	5	65 Å²	65	3%	0.03	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	146.7	-170.8	-57.8	0	0	0	0	113.7	L37 K38 V40 I58 K91 A92	L37-V81 VanDerWaalsContact CA-O 3.31Å; L37-V81 WeakPolarHBondContact CA-O 3.27Å; K38-V81 HydrophobicContact CB-CG2 3.94Å; K38-V81 PolarHBondContact N-O 3.05Å; K38-V81 WeakPolarHBondContact O-CG2 3.34Å; K38-V81 PolarHBondContact O-N 2.82Å; V40-V81 HydrophobicContact CG2-CG1 3.68Å; V40-V81 HydrophobicContact CG2-CG2 4.24Å; I58-V81 HydrophobicContact CB-CG1 4.42Å; I58-V81 HydrophobicContact CD1-CG1 4.09Å; I58-V81 HydrophobicContact CG1-CG1 4.16Å; I58-V81 HydrophobicContact CG2-CB 4.46Å; I58-V81 HydrophobicContact CG2-CG1 3.39Å; V81-K91 CarbonylContact C-O 3.56Å; V81-K91 WeakPolarHBondContact CA-O 2.94Å; V81-A92 HydrophobicContact CG1-CB 4.19Å
82	E	83.2	Confident	75.4	Confident	66 Å²	66	64.9 Å²	64.9	31%	0.308	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	144.9	177	-166.4	-176.9	-173.7	0	0	110.3	T35 L37 L90 K91	T35-E82 VanDerWaalsContact CB-CG 3.5Å; T35-E82 VanDerWaalsContact CB-OE1 3.23Å; T35-E82 WeakPolarHBondContact CB-OE1 3.16Å; T35-E82 HydrophobicContact CG2-CG 3.96Å; T35-E82 WeakPolarHBondContact CG2-OE1 3.45Å; T35-E82 PolarHBondContact OG1-OE1 3.32Å; L37-E82 HydrophobicContact CD2-CB 3.71Å; L37-E82 HydrophobicContact CD2-CG 3.9Å; E82-L90 CarbonylContact O-C 3.57Å; E82-L90 WeakPolarHBondContact O-CA 3.28Å; E82-K91 PolarHBondContact N-O 3.02Å; E82-K91 PolarHBondContact O-N 3.43Å
83	E	77.2	Confident	75.9	Confident	95 Å²	95	63.6 Å²	63.6	44%	0.444	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.6	123	-179.6	-167.7	169.3	-170.4	0	0	111.7	T35 L90	T35-E83 VanDerWaalsContact CG2-O 3.27Å; T35-E83 WeakPolarHBondContact CG2-O 3.23Å; E83-L90 HydrophobicContact CB-CD2 4.29Å; E83-L90 HydrophobicContact CG-CD2 4.48Å
84	N	67.2	Low	76.5	Confident	71 Å²	71	65.2 Å²	65.2	38%	0.38	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	112.7	-179.3	-175.1	-0.4	0	0	0	111.2	V86 S87 N88 G89	N84-V86 PolarHBondContact O-N 3.22Å; N84-V86 PolarHBondContact OD1-N 2.72Å; N84-S87 PolarHBondContact ND2-OG 2.92Å; N84-S87 PolarHBondContact O-N 2.91Å; N84-N88 WeakPolarHBondContact O-CA 3.49Å; N84-N88 PolarHBondContact O-N 3.14Å; N84-G89 WeakPolarHBondContact CB-O 3.26Å; N84-G89 PolarHBondContact N-O 3.16Å
85	K	63.4	Low	77	Confident	112 Å²	112	62.7 Å²	62.7	49%	0.487	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-19.7	-177.1	-64.7	-177.5	-179.6	165.2	0	114.9	G33	G33-K85 VanDerWaalsContact C-NZ 3.26Å; G33-K85 VanDerWaalsContact O-CE 3.28Å; G33-K85 WeakPolarHBondContact O-CE 3.46Å; G33-K85 PolarHBondContact O-NZ 2.73Å
86	V	53.4	Low	77.2	Confident	128 Å²	128	63.8 Å²	63.8	78%	0.776	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-21.9	-178.5	-173.1	0	0	0	0	112.3	N84	N84-V86 PolarHBondContact O-N 3.22Å; N84-V86 PolarHBondContact OD1-N 2.72Å
87	S	56.6	Low	77.3	Confident	79 Å²	79	60.9 Å²	60.9	55%	0.552	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.2	2.4	-174.1	73.3	0	0	0	0	114.8	N84 G89	N84-S87 PolarHBondContact ND2-OG 2.92Å; N84-S87 PolarHBondContact O-N 2.91Å; S87-G89 PolarHBondContact O-N 3.49Å; S87-G89 PolarHBondContact OG-N 3.49Å
88	N	56.4	Low	76.7	Confident	135 Å²	135	63.3 Å²	63.3	72%	0.722	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	28.3	-168.9	-75	-15.9	0	0	0	113.7	N84	N84-N88 WeakPolarHBondContact O-CA 3.49Å; N84-N88 PolarHBondContact O-N 3.14Å
89	G	68.4	Low	75.5	Confident	26 Å²	26	63.1 Å²	63.1	27%	0.268	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	154.4	-175.5	0	0	0	0	0	112.4	N84 S87	N84-G89 WeakPolarHBondContact CB-O 3.26Å; N84-G89 PolarHBondContact N-O 3.16Å; S87-G89 PolarHBondContact O-N 3.49Å; S87-G89 PolarHBondContact OG-N 3.49Å
90	L	81.1	Confident	73	Confident	66 Å²	66	69.4 Å²	69.4	35%	0.346	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	130.1	179.6	-63.4	171.4	0	0	0	111.4	I58 Y59 E82 E83	I58-L90 WeakPolarHBondContact CA-O 3.33Å; I58-L90 HydrophobicContact CB-CB 4.49Å; I58-L90 HydrophobicContact CG1-CB 3.97Å; I58-L90 HydrophobicContact CG1-CD1 4.07Å; Y59-L90 PolarHBondContact N-O 3.03Å; E82-L90 CarbonylContact O-C 3.57Å; E82-L90 WeakPolarHBondContact O-CA 3.28Å; E83-L90 HydrophobicContact CB-CD2 4.29Å; E83-L90 HydrophobicContact CG-CD2 4.48Å
91	K	84	Confident	70.6	Confident	94 Å²	94	76.1 Å²	76.1	41%	0.409	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	127.3	175.6	178.3	176	-179.4	-172.9	0	111.6	Y59 V81 E82	Y59-K91 HydrophobicContact CD1-CG 4.13Å; Y59-K91 CarbonylContact O-C 3.52Å; Y59-K91 WeakPolarHBondContact O-CA 3.1Å; V81-K91 CarbonylContact C-O 3.56Å; V81-K91 WeakPolarHBondContact CA-O 2.94Å; E82-K91 PolarHBondContact N-O 3.02Å; E82-K91 PolarHBondContact O-N 3.43Å
92	A	84.8	Confident	68	Low	0 Å²	0	88.1 Å²	88.1	0%	0	44%	0.444	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	129	172.5	0	0	0	0	0	112.2	I58 Y59 F60 A79 V80 V81 V95	I58-A92 HydrophobicContact CG2-CB 3.81Å; Y59-A92 PolarHBondContact O-N 3.44Å; F60-A92 HydrophobicContact CB-CB 3.57Å; A79-A92 HydrophobicContact CB-CB 4.25Å; V80-A92 VanDerWaalsContact O-CA 3.24Å; V80-A92 WeakPolarHBondContact O-CA 3.25Å; V81-A92 HydrophobicContact CG1-CB 4.19Å; A92-V95 HydrophobicContact CB-CG2 4.11Å
93	I	87.4	Confident	65.4	Low	82 Å²	82	92.1 Å²	92.1	42%	0.421	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	-16.1	178.8	57.9	170.1	0	0	0	112.7	L37 A64 V80	L37-I93 HydrophobicContact CD1-CD1 4.46Å; L37-I93 HydrophobicContact CD2-CD1 4.1Å; A64-I93 WeakPolarHBondContact CB-O 3.37Å; V80-I93 HydrophobicContact CB-CG1 4.2Å; V80-I93 HydrophobicContact CG1-CD1 4.09Å; V80-I93 HydrophobicContact CG1-CG1 4.05Å; V80-I93 PolarHBondContact O-N 3.07Å
94	R	84.6	Confident	63.5	Low	122 Å²	122	95.4 Å²	95.4	46%	0.46	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	132.4	177.5	179.8	171.6	163	-154.3	-3.9	110.3	A64 T66 A79 V80 E96	A64-R94 CarbonylContact O-C 3.38Å; A64-R94 VanDerWaalsContact O-CA 3.3Å; A64-R94 WeakPolarHBondContact O-CA 3.16Å; T66-R94 HydrophobicContact CG2-CG 3.76Å; A79-R94 WeakPolarHBondContact CA-O 3.22Å; V80-R94 HydrophobicContact CB-CB 4.36Å; V80-R94 HydrophobicContact CG2-CB 4.37Å; V80-R94 PolarHBondContact N-O 2.85Å; R94-E96 IonicContact CZ-OE1 2.79Å; R94-E96 IonicContact NE-OE1 3.73Å; R94-E96 PolarHBondContact NE-OE1 3.49Å; R94-E96 IonicContact NH2-OE1 3.17Å; R94-E96 PolarHBondContact NH2-OE1 3.44Å; R94-E96 IonicContact NH2-OE2 3.13Å; R94-E96 PolarHBondContact NH2-OE2 3.23Å
95	V	83.2	Confident	61.6	Low	0 Å²	0	97.6 Å²	97.6	0%	0	50%	0.495	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	125.7	-178.8	-169.4	0	0	0	0	110.5	I54 F60 A64 V65 T66 L71 V77 A92	I54-V95 HydrophobicContact CD1-CG1 4.39Å; I54-V95 HydrophobicContact CD1-CG2 4.49Å; F60-V95 HydrophobicContact CB-CG2 3.79Å; F60-V95 HydrophobicContact CD1-CG2 4.3Å; F60-V95 HydrophobicContact CD2-CG2 3.72Å; F60-V95 HydrophobicContact CE2-CG2 4.26Å; F60-V95 HydrophobicContact CG-CG2 3.72Å; A64-V95 HydrophobicContact CB-CG2 4.4Å; A64-V95 PolarHBondContact O-N 3.49Å; V65-V95 WeakPolarHBondContact CA-O 3.35Å; V65-V95 HydrophobicContact CG2-CB 4.47Å; T66-V95 PolarHBondContact N-O 2.92Å; T66-V95 VanDerWaalsContact N-O 3.14Å; L71-V95 HydrophobicContact CD1-CB 4.03Å; L71-V95 HydrophobicContact CD1-CG1 3.33Å; V77-V95 HydrophobicContact CB-CG1 3.84Å; V77-V95 HydrophobicContact CG1-CG1 3.96Å; V77-V95 HydrophobicContact CG2-CG1 4.14Å; A92-V95 HydrophobicContact CB-CG2 4.11Å
96	E	83.4	Confident	60.6	Low	63 Å²	63	97.6 Å²	97.6	29%	0.294	51%	0.509	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	127.1	-179.4	-85.1	172.7	-169	0	0	111.6	T66 V77 I78 R94 V98	T66-E96 WeakPolarHBondContact OG1-CG 3.36Å; T66-E96 PolarHBondContact OG1-OE1 3.34Å; V77-E96 CarbonylContact C-O 3.58Å; V77-E96 WeakPolarHBondContact CA-O 3.06Å; V77-E96 WeakPolarHBondContact CB-O 3.17Å; I78-E96 PolarHBondContact N-O 3.25Å; I78-E96 PolarHBondContact O-N 2.74Å; R94-E96 IonicContact CZ-OE1 2.79Å; R94-E96 IonicContact NE-OE1 3.73Å; R94-E96 PolarHBondContact NE-OE1 3.49Å; R94-E96 IonicContact NH2-OE1 3.17Å; R94-E96 PolarHBondContact NH2-OE1 3.44Å; R94-E96 IonicContact NH2-OE2 3.13Å; R94-E96 PolarHBondContact NH2-OE2 3.23Å; E96-V98 PolarHBondContact O-N 3.4Å
97	A	78.8	Confident	59.7	Low	25 Å²	25	101.5 Å²	101.5	21%	0.207	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.9	127.4	167.7	0	0	0	0	0	109.9	L71 S99	L71-A97 HydrophobicContact CD2-CB 3.77Å; A97-S99 PolarHBondContact O-N 3.16Å
98	V	73.9	Confident	58.3	Low	51 Å²	51	105.2 Å²	105.2	31%	0.309	52%	0.524	S	S	.	.			trans	-68.1	104.1	158.5	-177.1	0	0	0	0	106	E76 I78 E96	E76-V98 HydrophobicContact CB-CB 4.37Å; E76-V98 HydrophobicContact CB-CG2 4.2Å; E76-V98 PolarHBondContact O-N 3.39Å; I78-V98 HydrophobicContact CD1-CG2 4.41Å; I78-V98 HydrophobicContact CG1-CG2 4.15Å; E96-V98 PolarHBondContact O-N 3.4Å
99	S	59	Low	57	Low	71 Å²	71	107.3 Å²	107.3	50%	0.497	53%	0.528	S	S	.	.			trans	-88.8	124.1	173	67.2	0	0	0	0	108.7	A97 K101	A97-S99 PolarHBondContact O-N 3.16Å; S99-K101 PolarHBondContact O-N 3.4Å
100	D	35.5	Very low	55.1	Low	133 Å²	133	109.6 Å²	109.6	71%	0.711	55%	0.552	S	S	*	*			trans	-68.7	71	161.2	-68.3	-16.3	0	0	0	108.7	W102	D100-W102 VanDerWaalsContact C-N 3.32Å; D100-W102 PolarHBondContact O-N 3.28Å; D100-W102 VanDerWaalsContact O-N 3.07Å
101	K	32.9	Very low	52.7	Low	175 Å²	175	109.4 Å²	109.4	76%	0.761	56%	0.556	S	S	*	*			trans	-70.5	96.5	162.4	-87.7	-179.3	-179.1	176.7	0	106.2	S99 E103	S99-K101 PolarHBondContact O-N 3.4Å; K101-E103 PolarHBondContact O-N 3.2Å
102	W	33	Very low	50.6	Low	257 Å²	257	110.9 Å²	110.9	97%	0.973	58%	0.575	S	S	*	*			trans	43.3	61.2	165.8	-80.1	45.8	0	0	0	111.4	D100 D104	D100-W102 VanDerWaalsContact C-N 3.32Å; D100-W102 PolarHBondContact O-N 3.28Å; D100-W102 VanDerWaalsContact O-N 3.07Å; W102-D104 PolarHBondContact O-N 2.91Å
103	E	28.9	Very low	48.6	Very low	150 Å²	150	115 Å²	115	70%	0.701	60%	0.604	S	S	*	*			trans	-67.7	114.6	155.2	-78.5	-162.1	157.7	0	0	106.9	K101 D105	K101-E103 PolarHBondContact O-N 3.2Å; E103-D105 VanDerWaalsContact C-N 3.28Å; E103-D105 PolarHBondContact O-N 3Å
104	D	38.2	Very low	46.8	Very low	163 Å²	163	116.6 Å²	116.6	87%	0.872	61%	0.614	S	S	*	*			trans	-52.9	91.6	166.1	-164.2	15.4	0	0	0	107.9	W102	W102-D104 PolarHBondContact O-N 2.91Å
105	D	28	Very low	45.3	Very low	118 Å²	118	114.6 Å²	114.6	63%	0.631	62%	0.618	S	S	*	*			trans	-142.7	106.9	171	-107	-27	0	0	0	112.4	E103 R107	E103-D105 VanDerWaalsContact C-N 3.28Å; E103-D105 PolarHBondContact O-N 3Å; D105-R107 PolarHBondContact O-N 3.48Å
106	S	41.1	Very low	44.5	Very low	111 Å²	111	116.1 Å²	116.1	78%	0.776	63%	0.633	S	S	*	*	S	Bend	trans	-47.6	22.3	161.2	58.7	0	0	0	0	116.5
107	R	34.1	Very low	44.3	Very low	210 Å²	210	115.8 Å²	115.8	79%	0.792	64%	0.636	S	S	*	*			trans	-144	63.4	176.8	-70	-172.3	-179	174.4	1.6	112.1	D105	D105-R107 PolarHBondContact O-N 3.48Å
108	N	28.3	Very low	44.6	Very low	158 Å²	158	119.1 Å²	119.1	85%	0.845	64%	0.643	S	S	*	*			trans	-164.9	94.5	136.8	-94	-27.4	0	0	0	107.8	G110	N108-G110 PolarHBondContact O-N 3.37Å
109	H	28.1	Very low	45.3	Very low	178 Å²	178	120 Å²	120	82%	0.824	65%	0.649	S	S	*	*			trans	-62	73.9	152.8	-74.7	-76.4	0	0	0	108.5	S111	H109-S111 PolarHBondContact O-N 3.29Å
110	G	29.8	Very low	46.7	Very low	74 Å²	74	116.6 Å²	116.6	76%	0.763	63%	0.625	S	S	*	*			trans	-72.1	78.8	144.2	0	0	0	0	0	104.9	N108	N108-G110 PolarHBondContact O-N 3.37Å
111	S	29.9	Very low	49.1	Very low	62 Å²	62	111.7 Å²	111.7	43%	0.434	60%	0.599	S	S	.	*			trans	-47.9	147.6	-164.3	32.8	0	0	0	0	112.6	H109 S113	H109-S111 PolarHBondContact O-N 3.29Å; S111-S113 VanDerWaalsContact CB-OG 3.31Å; S111-S113 WeakPolarHBondContact CB-OG 3.41Å; S111-S113 PolarHBondContact O-N 3.18Å; S111-S113 PolarHBondContact O-OG 3Å; S111-S113 VanDerWaalsContact OG-CB 3.27Å; S111-S113 WeakPolarHBondContact OG-CB 3.38Å; S111-S113 PolarHBondContact OG-OG 2.85Å
112	P	40.9	Very low	51.8	Low	125 Å²	125	103.4 Å²	103.4	81%	0.812	56%	0.562	S	S	*	*	S	Bend	trans	-66.9	37.5	162.6	29.4	-32.5	0	0	0	111.5	D114	P112-D114 PolarHBondContact O-N 2.99Å
113	S	42.3	Very low	54.5	Low	87 Å²	87	92.3 Å²	92.3	61%	0.608	52%	0.524	S	S	*	.			trans	-87.1	2.5	-165.4	52.6	0	0	0	0	114.9	S111 C115	S111-S113 VanDerWaalsContact CB-OG 3.31Å; S111-S113 WeakPolarHBondContact CB-OG 3.41Å; S111-S113 PolarHBondContact O-N 3.18Å; S111-S113 PolarHBondContact O-OG 3Å; S111-S113 VanDerWaalsContact OG-CB 3.27Å; S111-S113 WeakPolarHBondContact OG-CB 3.38Å; S111-S113 PolarHBondContact OG-OG 2.85Å; S113-C115 PolarHBondContact O-N 3.26Å
114	D	50.1	Low	57.5	Low	115 Å²	115	85.1 Å²	85.1	62%	0.615	49%	0.49	S	S	*	.			trans	-97.9	41.3	168.3	-153.8	41.5	0	0	0	111.2	P112 G116 R118	P112-D114 PolarHBondContact O-N 2.99Å; D114-G116 PolarHBondContact O-N 2.76Å; D114-R118 IonicContact OD2-CZ 2.99Å; D114-R118 IonicContact OD2-NE 3.73Å; D114-R118 IonicContact OD2-NH2 3.16Å; D114-R118 PolarHBondContact OD2-NH2 3.44Å
115	C	52.6	Low	59.7	Low	81 Å²	81	78.8 Å²	78.8	55%	0.547	46%	0.457	S	S	.	.			trans	-78.6	22.4	168.5	-148.2	0	0	0	0	111.2	S113	S113-C115 PolarHBondContact O-N 3.26Å
116	G	67	Low	62.4	Low	31 Å²	31	74.6 Å²	74.6	32%	0.32	44%	0.437	S	S	.	.	S	Bend	trans	-69.5	149.5	173.5	0	0	0	0	0	110.7	D114 R118	D114-G116 PolarHBondContact O-N 2.76Å; G116-R118 PolarHBondContact O-N 3.23Å
117	P	78.4	Confident	64.5	Low	56 Å²	56	72.8 Å²	72.8	36%	0.364	42%	0.419	S	S	.	.	P	Polyproline II helix	trans	-58.1	130.3	169.3	24.6	-29.1	0	0	0	109.7	E160	P117-E160 HydrophobicContact CB-CB 3.99Å; P117-E160 HydrophobicContact CB-CG 4.38Å
118	R	84.8	Confident	66.7	Low	95 Å²	95	67.3 Å²	67.3	36%	0.358	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	149.2	174.4	-68.3	-178.3	176.7	-170.8	-7.3	109.7	D114 G116 E160 Y161	D114-R118 IonicContact OD2-CZ 2.99Å; D114-R118 IonicContact OD2-NE 3.73Å; D114-R118 IonicContact OD2-NH2 3.16Å; D114-R118 PolarHBondContact OD2-NH2 3.44Å; G116-R118 PolarHBondContact O-N 3.23Å; R118-E160 CarbonylContact O-C 3.28Å; R118-E160 VanDerWaalsContact O-CA 3.22Å; R118-E160 WeakPolarHBondContact O-CA 3.3Å; R118-Y161 HydrophobicContact CB-CD1 4.04Å; R118-Y161 HydrophobicContact CB-CE1 3.55Å; R118-Y161 PolarHBondContact N-O 3.43Å; R118-Y161 WeakPolarHBondContact O-CD1 3.41Å; R118-Y161 PolarHBondContact O-N 2.64Å
119	V	88.5	Confident	68.8	Low	69 Å²	69	68 Å²	68	42%	0.418	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	133.9	177.3	-175.5	0	0	0	0	110	E158 A159 E160	V119-E158 HydrophobicContact CG1-CG 3.54Å; V119-A159 CarbonylContact C-O 3.59Å; V119-A159 WeakPolarHBondContact CA-O 3.28Å; V119-E160 HydrophobicContact CG2-CG 4.41Å
120	L	88.9	Confident	71.3	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	134.1	175.2	156.2	72.1	0	0	0	107.8	I134 T138 E158 A159 Y161 A522	L120-I134 HydrophobicContact CD2-CB 4.26Å; L120-I134 HydrophobicContact CD2-CD1 4.36Å; L120-I134 HydrophobicContact CD2-CG2 3.92Å; L120-I134 HydrophobicContact CG-CG2 4.38Å; L120-T138 HydrophobicContact CD2-CG2 3.74Å; L120-T138 WeakPolarHBondContact CD2-OG1 3.44Å; L120-E158 CarbonylContact O-C 3.53Å; L120-E158 WeakPolarHBondContact O-CA 3.41Å; L120-A159 HydrophobicContact CD2-CB 4.48Å; L120-A159 PolarHBondContact N-O 2.86Å; L120-A159 PolarHBondContact O-N 3.2Å; L120-Y161 HydrophobicContact CB-CD1 3.52Å; L120-Y161 HydrophobicContact CB-CE1 3.87Å; L120-A522 HydrophobicContact CB-CB 4.08Å; L120-A522 HydrophobicContact CD1-CB 3.65Å; L120-A522 HydrophobicContact CG-CB 4.49Å
121	I	86.6	Confident	74.1	Confident	31 Å²	31	58.8 Å²	58.8	16%	0.159	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	127	165.3	-69.1	167.6	0	0	0	108.5	W156 V157 E158 L178 A522 L524	I121-W156 HydrophobicContact CG2-CE3 4.33Å; I121-V157 WeakPolarHBondContact CA-O 3.46Å; I121-E158 HydrophobicContact CG1-CB 4.24Å; I121-E158 HydrophobicContact CG1-CG 4.12Å; I121-L178 HydrophobicContact CB-CD1 4.47Å; I121-L178 HydrophobicContact CD1-CD1 3.58Å; I121-L178 HydrophobicContact CG1-CD1 3.82Å; I121-L178 HydrophobicContact CG2-CD1 3.81Å; I121-L178 HydrophobicContact CG2-CD2 3.75Å; I121-L178 HydrophobicContact CG2-CG 4.35Å; I121-A522 PolarHBondContact N-O 3.42Å; I121-L524 HydrophobicContact CB-CD2 4.5Å; I121-L524 HydrophobicContact CD1-CD1 3.79Å; I121-L524 HydrophobicContact CD1-CD2 3.64Å; I121-L524 HydrophobicContact CD1-CG 3.59Å; I121-L524 HydrophobicContact CG2-CD2 4.47Å
122	G	88.9	Confident	76.9	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	173.8	-176.4	0	0	0	0	0	113.1	S135 V157	G122-S135 WeakPolarHBondContact CA-OG 3.4Å; G122-V157 PolarHBondContact N-O 2.71Å; G122-V157 VanDerWaalsContact N-O 3.07Å; G122-V157 WeakPolarHBondContact O-CG2 3.24Å; G122-V157 PolarHBondContact O-N 2.93Å
123	C	90	Very high	79.3	Confident	24 Å²	24	51.2 Å²	51.2	16%	0.162	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	136.7	179.4	-178.8	0	0	0	0	109.5	T125 I134 S135 G154 D155 W156	C123-T125 WeakPolarHBondContact O-CG2 3.18Å; C123-T125 PolarHBondContact O-N 3.16Å; C123-I134 WeakPolarHBondContact O-CA 3.47Å; C123-S135 PolarHBondContact N-OG 2.78Å; C123-S135 PolarHBondContact O-N 3.41Å; C123-G154 VanDerWaalsContact SG-CA 3.52Å; C123-G154 PolarHBondContact SG-O 2.88Å; C123-D155 CarbonylContact C-O 3.46Å; C123-D155 WeakPolarHBondContact CA-O 3.4Å; C123-W156 HydrophobicContact CB-CD2 4.24Å; C123-W156 HydrophobicContact CB-CE3 4.25Å; C123-W156 HydrophobicContact CB-CH2 4.31Å; C123-W156 HydrophobicContact CB-CZ2 4.29Å; C123-W156 HydrophobicContact CB-CZ3 4.29Å
124	V	90.5	Very high	81.5	Confident	0 Å²	0	47 Å²	47	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	118.3	173.3	179.2	0	0	0	0	108.9	F140 P151 C152 K153 G154 D155 V157	V124-F140 HydrophobicContact CG1-CE1 4.31Å; V124-F140 HydrophobicContact CG1-CZ 4.15Å; V124-F140 HydrophobicContact CG2-CE1 4.46Å; V124-F140 HydrophobicContact CG2-CZ 4.38Å; V124-P151 HydrophobicContact CG2-CB 4.35Å; V124-C152 WeakPolarHBondContact CB-O 3.36Å; V124-K153 CarbonylContact O-C 3.39Å; V124-K153 WeakPolarHBondContact O-CA 3.33Å; V124-G154 PolarHBondContact O-N 3.05Å; V124-D155 HydrophobicContact CG2-CB 4.27Å; V124-D155 PolarHBondContact N-O 2.77Å; V124-V157 HydrophobicContact CG2-CG1 3.89Å; V124-V157 HydrophobicContact CG2-CG2 4.1Å
125	T	85.6	Confident	83.1	Confident	29 Å²	29	41.9 Å²	41.9	18%	0.178	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	-29	-172.5	53.3	0	0	0	0	114.1	C123 C133 Q136 K153	C123-T125 WeakPolarHBondContact O-CG2 3.18Å; C123-T125 PolarHBondContact O-N 3.16Å; T125-C133 PolarHBondContact N-O 2.8Å; T125-C133 PolarHBondContact OG1-O 3.38Å; T125-Q136 HydrophobicContact CG2-CG 3.77Å; T125-Q136 PolarHBondContact OG1-N 3.3Å; T125-K153 VanDerWaalsContact O-CE 3.23Å; T125-K153 WeakPolarHBondContact O-CE 3.31Å
126	S	85.3	Confident	84.4	Confident	30 Å²	30	42.8 Å²	42.8	21%	0.21	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	149.9	175.1	61.5	0	0	0	0	110.2	G132 C133	S126-G132 CarbonylContact O-C 3.05Å; S126-G132 WeakPolarHBondContact O-CA 3.3Å; S126-C133 PolarHBondContact O-N 3.43Å; S126-C133 VanDerWaalsContact OG-CB 3.3Å; S126-C133 WeakPolarHBondContact OG-CB 3.49Å
127	L	84.2	Confident	85.1	Confident	73 Å²	73	42.5 Å²	42.5	38%	0.382	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	122.1	171.7	-164.7	78.4	0	0	0	106.4	A131 F140 L142 P151	L127-A131 CarbonylContact C-O 3.57Å; L127-A131 WeakPolarHBondContact CA-O 3.29Å; L127-F140 HydrophobicContact CD1-CE2 4.36Å; L127-F140 HydrophobicContact CD1-CZ 4.12Å; L127-L142 HydrophobicContact CD1-CD1 4.03Å; L127-P151 HydrophobicContact CD1-CG 4.35Å; L127-P151 WeakPolarHBondContact CD2-O 3.01Å
128	V	80.2	Confident	85.5	Confident	96 Å²	96	39.8 Å²	39.8	58%	0.582	22%	0.224	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-135	127.7	-178.8	-174.8	0	0	0	0	107.4	G130 A131	V128-G130 PolarHBondContact O-N 3.09Å; V128-A131 PolarHBondContact N-O 3.41Å; V128-A131 PolarHBondContact O-N 3.36Å
129	E	73.1	Confident	85.8	Confident	172 Å²	172	40 Å²	40	80%	0.804	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	3.7	78.7	178.7	-66	-172.2	156.4	0	0	115.9
130	G	80.9	Confident	86	Confident	44 Å²	44	36.8 Å²	36.8	45%	0.454	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	98.2	-4.1	174	0	0	0	0	0	116.8	V128 L142	V128-G130 PolarHBondContact O-N 3.09Å; G130-L142 WeakPolarHBondContact O-CB 3.5Å; G130-L142 PolarHBondContact O-N 3.21Å
131	A	87.8	Confident	86.2	Confident	15 Å²	15	38.2 Å²	38.2	12%	0.124	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	165.9	178	0	0	0	0	0	113	L127 V128 Y139 F140	L127-A131 CarbonylContact C-O 3.57Å; L127-A131 WeakPolarHBondContact CA-O 3.29Å; V128-A131 PolarHBondContact N-O 3.41Å; V128-A131 PolarHBondContact O-N 3.36Å; A131-Y139 HydrophobicContact CB-CE2 3.49Å; A131-Y139 VanDerWaalsContact CB-CE2 3.49Å; A131-Y139 VanDerWaalsContact CB-OH 3.26Å; A131-Y139 WeakPolarHBondContact CB-OH 3.49Å; A131-F140 CarbonylContact C-O 3.43Å; A131-F140 WeakPolarHBondContact CA-O 3.25Å; A131-F140 WeakPolarHBondContact CB-O 3.48Å
132	G	89.1	Confident	86.4	Confident	5 Å²	5	40.6 Å²	40.6	5%	0.052	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147	177.4	176.6	0	0	0	0	0	113.6	S126 F140	S126-G132 CarbonylContact O-C 3.05Å; S126-G132 WeakPolarHBondContact O-CA 3.3Å; G132-F140 VanDerWaalsContact CA-CE1 3.46Å; G132-F140 PolarHBondContact N-O 3.18Å; G132-F140 VanDerWaalsContact O-CD1 3.31Å; G132-F140 WeakPolarHBondContact O-CD1 3.44Å; G132-F140 PolarHBondContact O-N 2.99Å
133	C	89.7	Confident	86.3	Confident	22 Å²	22	49.2 Å²	49.2	15%	0.149	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	129.1	176.8	-168.2	0	0	0	0	111.6	T125 S126 Q136 T137 T138	T125-C133 PolarHBondContact N-O 2.8Å; T125-C133 PolarHBondContact OG1-O 3.38Å; S126-C133 PolarHBondContact O-N 3.43Å; S126-C133 VanDerWaalsContact OG-CB 3.3Å; S126-C133 WeakPolarHBondContact OG-CB 3.49Å; C133-Q136 VanDerWaalsContact SG-CA 3.53Å; C133-T137 PolarHBondContact SG-N 3.24Å; C133-T137 VanDerWaalsContact SG-N 3.35Å; C133-T138 CarbonylContact C-O 3.54Å; C133-T138 VanDerWaalsContact CA-O 3.31Å; C133-T138 WeakPolarHBondContact CA-O 3.22Å
134	I	88.9	Confident	86.4	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	129.6	174.7	-57.9	164.3	0	0	0	108.3	L120 C123 Q136 T137 T138 F140 V157 A159 A172 V175	L120-I134 HydrophobicContact CD2-CB 4.26Å; L120-I134 HydrophobicContact CD2-CD1 4.36Å; L120-I134 HydrophobicContact CD2-CG2 3.92Å; L120-I134 HydrophobicContact CG-CG2 4.38Å; C123-I134 WeakPolarHBondContact O-CA 3.47Å; I134-Q136 PolarHBondContact O-N 2.84Å; I134-T137 PolarHBondContact O-N 3.25Å; I134-T137 VanDerWaalsContact O-N 3.08Å; I134-T138 PolarHBondContact N-O 2.98Å; I134-T138 PolarHBondContact O-N 3.39Å; I134-F140 HydrophobicContact CD1-CD1 3.97Å; I134-F140 HydrophobicContact CD1-CE1 4.45Å; I134-F140 HydrophobicContact CG1-CD1 3.66Å; I134-F140 HydrophobicContact CG1-CE1 3.79Å; I134-V157 HydrophobicContact CD1-CG2 3.74Å; I134-V157 HydrophobicContact CG1-CG2 3.87Å; I134-V157 HydrophobicContact CG2-CG2 4.17Å; I134-A159 HydrophobicContact CD1-CB 3.56Å; I134-A172 HydrophobicContact CD1-CB 4.43Å; I134-V175 HydrophobicContact CD1-CG1 4.46Å; I134-V175 HydrophobicContact CD1-CG2 4.21Å
135	S	83.3	Confident	86.5	Confident	6 Å²	6	49.9 Å²	49.9	4%	0.042	27%	0.272	C	S	.	.	T	Hydrogen-bonded Turn	trans	51.1	29.5	177.8	-60.4	0	0	0	0	114.3	G122 C123 T137 A930	G122-S135 WeakPolarHBondContact CA-OG 3.4Å; C123-S135 PolarHBondContact N-OG 2.78Å; C123-S135 PolarHBondContact O-N 3.41Å; S135-T137 PolarHBondContact O-N 3Å; S135-T137 VanDerWaalsContact O-N 3.12Å; S135-A930 VanDerWaalsContact O-CB 3.23Å; S135-A930 WeakPolarHBondContact O-CB 3.44Å
136	Q	80.9	Confident	86.8	Confident	100 Å²	100	50.7 Å²	50.7	47%	0.467	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.1	4.2	-176.9	-44.4	-177	-2.2	0	0	116	T125 C133 I134	T125-Q136 HydrophobicContact CG2-CG 3.77Å; T125-Q136 PolarHBondContact OG1-N 3.3Å; C133-Q136 VanDerWaalsContact SG-CA 3.53Å; I134-Q136 PolarHBondContact O-N 2.84Å
137	T	81.3	Confident	86.9	Confident	25 Å²	25	58.9 Å²	58.9	15%	0.153	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-42.5	-174.8	55.5	0	0	0	0	112.7	C133 I134 S135 I514 L927 Y931	C133-T137 PolarHBondContact SG-N 3.24Å; C133-T137 VanDerWaalsContact SG-N 3.35Å; I134-T137 PolarHBondContact O-N 3.25Å; I134-T137 VanDerWaalsContact O-N 3.08Å; S135-T137 PolarHBondContact O-N 3Å; S135-T137 VanDerWaalsContact O-N 3.12Å; T137-I514 HydrophobicContact CG2-CG2 4.4Å; T137-L927 HydrophobicContact CG2-CD2 3.76Å; T137-Y931 HydrophobicContact CG2-CE2 4.24Å; T137-Y931 PolarHBondContact OG1-OH 3.33Å
138	T	87.9	Confident	86.9	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.8	-167	-54.1	0	0	0	0	110.9	L120 C133 I134 S170 A172	L120-T138 HydrophobicContact CD2-CG2 3.74Å; L120-T138 WeakPolarHBondContact CD2-OG1 3.44Å; C133-T138 CarbonylContact C-O 3.54Å; C133-T138 VanDerWaalsContact CA-O 3.31Å; C133-T138 WeakPolarHBondContact CA-O 3.22Å; I134-T138 PolarHBondContact N-O 2.98Å; I134-T138 PolarHBondContact O-N 3.39Å; T138-S170 VanDerWaalsContact CA-OG 3.27Å; T138-S170 WeakPolarHBondContact CA-OG 3.35Å; T138-S170 WeakPolarHBondContact CB-OG 3.27Å; T138-S170 PolarHBondContact OG1-OG 2.84Å; T138-A172 HydrophobicContact CG2-CB 4.19Å
139	Y	90.3	Very high	87.3	Confident	100 Å²	100	54.4 Å²	54.4	39%	0.392	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	142.7	178.9	174.4	-93.5	0	0	0	111	A131 S170 E171 A172	A131-Y139 HydrophobicContact CB-CE2 3.49Å; A131-Y139 VanDerWaalsContact CB-CE2 3.49Å; A131-Y139 VanDerWaalsContact CB-OH 3.26Å; A131-Y139 WeakPolarHBondContact CB-OH 3.49Å; Y139-S170 PolarHBondContact N-O 2.79Å; Y139-S170 VanDerWaalsContact N-O 3.14Å; Y139-E171 HydrophobicContact CD1-CG 4.28Å; Y139-E171 CarbonylContact O-C 3.57Å; Y139-E171 WeakPolarHBondContact O-CA 3.48Å; Y139-A172 PolarHBondContact O-N 3.48Å
140	F	93.1	Very high	88.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	143.6	170.6	71.2	-88.9	0	0	0	111.6	V124 L127 A131 G132 I134 V145 P151 A172 V175	V124-F140 HydrophobicContact CG1-CE1 4.31Å; V124-F140 HydrophobicContact CG1-CZ 4.15Å; V124-F140 HydrophobicContact CG2-CE1 4.46Å; V124-F140 HydrophobicContact CG2-CZ 4.38Å; L127-F140 HydrophobicContact CD1-CE2 4.36Å; L127-F140 HydrophobicContact CD1-CZ 4.12Å; A131-F140 CarbonylContact C-O 3.43Å; A131-F140 WeakPolarHBondContact CA-O 3.25Å; A131-F140 WeakPolarHBondContact CB-O 3.48Å; G132-F140 VanDerWaalsContact CA-CE1 3.46Å; G132-F140 PolarHBondContact N-O 3.18Å; G132-F140 VanDerWaalsContact O-CD1 3.31Å; G132-F140 WeakPolarHBondContact O-CD1 3.44Å; G132-F140 PolarHBondContact O-N 2.99Å; I134-F140 HydrophobicContact CD1-CD1 3.97Å; I134-F140 HydrophobicContact CD1-CE1 4.45Å; I134-F140 HydrophobicContact CG1-CD1 3.66Å; I134-F140 HydrophobicContact CG1-CE1 3.79Å; F140-V145 HydrophobicContact CD2-CG2 3.93Å; F140-V145 HydrophobicContact CE2-CG2 3.92Å; F140-P151 HydrophobicContact CE2-CG 3.94Å; F140-P151 HydrophobicContact CZ-CB 4.49Å; F140-P151 HydrophobicContact CZ-CG 4.25Å; F140-A172 HydrophobicContact CB-CB 3.7Å; F140-V175 HydrophobicContact CB-CG2 3.84Å; F140-V175 HydrophobicContact CD2-CG2 4.12Å; F140-V175 HydrophobicContact CG-CG2 4.02Å
141	S	92	Very high	88.5	Confident	31 Å²	31	49 Å²	49	22%	0.217	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	148.6	169.9	175.2	0	0	0	0	110	E143 S144	S141-E143 PolarHBondContact O-N 3.24Å; S141-E143 VanDerWaalsContact O-N 3.17Å; S141-E143 PolarHBondContact OG-N 3.04Å; S141-S144 WeakPolarHBondContact O-CB 3.5Å; S141-S144 PolarHBondContact O-N 3.11Å; S141-S144 PolarHBondContact O-OG 3.45Å
142	L	90.5	Very high	88.5	Confident	80 Å²	80	49.5 Å²	49.5	42%	0.419	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-59.8	-25	173.4	-136.1	71.8	0	0	0	112.5	L127 G130 S144 V145 P151	L127-L142 HydrophobicContact CD1-CD1 4.03Å; G130-L142 WeakPolarHBondContact O-CB 3.5Å; G130-L142 PolarHBondContact O-N 3.21Å; L142-S144 PolarHBondContact O-N 3.2Å; L142-V145 WeakPolarHBondContact O-CB 3.44Å; L142-V145 PolarHBondContact O-N 3.01Å; L142-P151 HydrophobicContact CD1-CG 4.16Å
143	E	88.8	Confident	88.3	Confident	182 Å²	182	51 Å²	51	85%	0.85	27%	0.271	S	S	*	.	G	3₁₀ helix	trans	-67.2	-23.3	174.6	-61.1	175.3	173.7	0	0	113.4	S141 V145	S141-E143 PolarHBondContact O-N 3.24Å; S141-E143 VanDerWaalsContact O-N 3.17Å; S141-E143 PolarHBondContact OG-N 3.04Å; E143-V145 VanDerWaalsContact C-N 3.29Å
144	S	91.1	Very high	88.2	Confident	18 Å²	18	50.1 Å²	50.1	13%	0.126	27%	0.265	C	S	.	.	G	3₁₀ helix	trans	-82.5	-7.9	176.9	69.4	0	0	0	0	113	S141 L142 S174 V175	S141-S144 WeakPolarHBondContact O-CB 3.5Å; S141-S144 PolarHBondContact O-N 3.11Å; S141-S144 PolarHBondContact O-OG 3.45Å; L142-S144 PolarHBondContact O-N 3.2Å; S144-S174 CarbonylContact O-C 3.5Å; S144-S174 VanDerWaalsContact O-CA 3.28Å; S144-S174 WeakPolarHBondContact O-CA 3.21Å; S144-V175 PolarHBondContact O-N 2.85Å
145	V	93.2	Very high	88.4	Confident	20 Å²	20	50.1 Å²	50.1	12%	0.121	27%	0.265	C	S	.	.	B	Isolated β-bridge	trans	-82.6	139	-176.7	-173.2	0	0	0	0	110.4	F140 L142 E143 F149 P151 V175	F140-V145 HydrophobicContact CD2-CG2 3.93Å; F140-V145 HydrophobicContact CE2-CG2 3.92Å; L142-V145 WeakPolarHBondContact O-CB 3.44Å; L142-V145 PolarHBondContact O-N 3.01Å; E143-V145 VanDerWaalsContact C-N 3.29Å; V145-F149 HydrophobicContact CG1-CB 4.41Å; V145-F149 HydrophobicContact CG1-CD1 3.58Å; V145-F149 HydrophobicContact CG1-CE1 4.3Å; V145-F149 HydrophobicContact CG1-CG 4.38Å; V145-F149 VanDerWaalsContact CG1-O 3.3Å; V145-F149 WeakPolarHBondContact CG1-O 3.22Å; V145-P151 HydrophobicContact CG1-CG 4.24Å; V145-P151 HydrophobicContact CG2-CG 3.97Å; V145-V175 WeakPolarHBondContact CA-O 3.48Å; V145-V175 HydrophobicContact CG2-CB 4.21Å
146	C	91.2	Very high	88.8	Confident	46 Å²	46	54.2 Å²	54.2	31%	0.311	28%	0.28	S	S	.	.	P	Polyproline II helix	trans	-59.5	141.5	179.1	68.9	0	0	0	0	112.3	G148 F149 V175 K176	C146-G148 PolarHBondContact O-N 3.48Å; C146-F149 PolarHBondContact O-N 2.86Å; C146-F149 VanDerWaalsContact SG-CB 3.57Å; C146-V175 PolarHBondContact N-O 3.04Å; C146-K176 HydrophobicContact CB-CB 4.25Å
147	E	87.9	Confident	89.4	Confident	201 Å²	201	49.5 Å²	49.5	94%	0.939	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	136.2	-177.5	-166.9	-179.5	174.5	0	0	112.3	F149	E147-F149 VanDerWaalsContact C-N 3.31Å; E147-F149 PolarHBondContact O-N 2.74Å
148	G	83.3	Confident	90	Very high	60 Å²	60	50.7 Å²	50.7	62%	0.619	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.2	-13	179.3	0	0	0	0	0	115.5	C146	C146-G148 PolarHBondContact O-N 3.48Å
149	F	89.8	Confident	90.3	Very high	15 Å²	15	50.8 Å²	50.8	7%	0.066	26%	0.262	C	S	.	.			trans	-101.7	118.4	176.6	176	-125	0	0	0	111.4	V145 C146 E147 P151 D155 V157 P177 V228 L240	V145-F149 HydrophobicContact CG1-CB 4.41Å; V145-F149 HydrophobicContact CG1-CD1 3.58Å; V145-F149 HydrophobicContact CG1-CE1 4.3Å; V145-F149 HydrophobicContact CG1-CG 4.38Å; V145-F149 VanDerWaalsContact CG1-O 3.3Å; V145-F149 WeakPolarHBondContact CG1-O 3.22Å; C146-F149 PolarHBondContact O-N 2.86Å; C146-F149 VanDerWaalsContact SG-CB 3.57Å; E147-F149 VanDerWaalsContact C-N 3.31Å; E147-F149 PolarHBondContact O-N 2.74Å; F149-P151 HydrophobicContact CE1-CB 3.85Å; F149-P151 HydrophobicContact CZ-CB 4Å; F149-D155 HydrophobicContact CZ-CB 4.3Å; F149-V157 HydrophobicContact CE1-CG1 3.91Å; F149-V157 HydrophobicContact CZ-CG1 4.11Å; F149-P177 HydrophobicContact CD2-CG 4.48Å; F149-P177 HydrophobicContact CE1-CB 4.43Å; F149-P177 HydrophobicContact CE2-CB 4.26Å; F149-P177 HydrophobicContact CG-CG 4.41Å; F149-P177 HydrophobicContact CZ-CB 4.21Å; F149-V228 HydrophobicContact CD2-CG1 4.48Å; F149-V228 HydrophobicContact CE2-CG1 4.18Å; F149-V228 HydrophobicContact CE2-CG2 4.37Å; F149-L240 HydrophobicContact CD2-CD1 3.97Å; F149-L240 HydrophobicContact CD2-CD2 4.02Å; F149-L240 HydrophobicContact CE2-CD2 4.06Å
150	E	88.5	Confident	90.4	Very high	97 Å²	97	49.8 Å²	49.8	45%	0.453	26%	0.261	S	S	.	.			trans	-101.1	108.8	170.4	-79.1	163.9	-142	0	0	109	K210 R238	E150-K210 WeakPolarHBondContact OE1-CE 3.1Å; E150-K210 IonicContact OE1-NZ 2.69Å; E150-K210 PolarHBondContact OE1-NZ 2.87Å; E150-R238 PolarHBondContact O-NH2 3.33Å
151	P	90.2	Very high	90.3	Very high	5 Å²	5	50 Å²	50	3%	0.032	26%	0.262	C	S	.	.			trans	-73.4	139.1	-174.1	28.7	-28.8	0	0	0	109.7	V124 L127 F140 L142 V145 F149	V124-P151 HydrophobicContact CG2-CB 4.35Å; L127-P151 HydrophobicContact CD1-CG 4.35Å; L127-P151 WeakPolarHBondContact CD2-O 3.01Å; F140-P151 HydrophobicContact CE2-CG 3.94Å; F140-P151 HydrophobicContact CZ-CB 4.49Å; F140-P151 HydrophobicContact CZ-CG 4.25Å; L142-P151 HydrophobicContact CD1-CG 4.16Å; V145-P151 HydrophobicContact CG1-CG 4.24Å; V145-P151 HydrophobicContact CG2-CG 3.97Å; F149-P151 HydrophobicContact CE1-CB 3.85Å; F149-P151 HydrophobicContact CZ-CB 4Å
152	C	87.4	Confident	90.1	Very high	26 Å²	26	54.1 Å²	54.1	18%	0.176	27%	0.273	C	S	.	.			trans	-119.6	153.8	173.6	-72.3	0	0	0	0	109.9	V124 G154 D155 S208 R238	V124-C152 WeakPolarHBondContact CB-O 3.36Å; C152-G154 PolarHBondContact O-N 2.63Å; C152-D155 PolarHBondContact N-OD2 2.66Å; C152-D155 VanDerWaalsContact O-CB 3.25Å; C152-D155 WeakPolarHBondContact O-CB 3.33Å; C152-D155 PolarHBondContact O-N 2.73Å; C152-S208 VanDerWaalsContact SG-CB 3.53Å; C152-R238 VanDerWaalsContact SG-CZ 3.52Å
153	K	85.1	Confident	89.8	Confident	38 Å²	38	52.3 Å²	52.3	17%	0.165	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	134.9	169.7	-175.4	176.1	-176.7	165	0	110.1	V124 T125 Q232 D1118 R1120	V124-K153 CarbonylContact O-C 3.39Å; V124-K153 WeakPolarHBondContact O-CA 3.33Å; T125-K153 VanDerWaalsContact O-CE 3.23Å; T125-K153 WeakPolarHBondContact O-CE 3.31Å; K153-Q232 PolarHBondContact O-NE2 2.98Å; K153-D1118 IonicContact NZ-OD1 2.92Å; K153-D1118 PolarHBondContact NZ-OD1 2.78Å; K153-D1118 IonicContact NZ-OD2 3.97Å; K153-D1118 PolarHBondContact NZ-OD2 2.8Å; K153-R1120 HydrophobicContact CD-CB 4.24Å; K153-R1120 VanDerWaalsContact NZ-CB 3.33Å; K153-R1120 PolarHBondContact O-NH2 3.45Å
154	G	87.6	Confident	89.3	Confident	2 Å²	2	47.9 Å²	47.9	2%	0.021	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	94.9	-22.2	-174.3	0	0	0	0	0	114.2	C123 V124 C152 W156 S230 S231	C123-G154 VanDerWaalsContact SG-CA 3.52Å; C123-G154 PolarHBondContact SG-O 2.88Å; V124-G154 PolarHBondContact O-N 3.05Å; C152-G154 PolarHBondContact O-N 2.63Å; G154-W156 PolarHBondContact O-N 2.87Å; G154-S230 VanDerWaalsContact C-OG 3.31Å; G154-S230 CarbonylContact O-C 3.57Å; G154-S230 WeakPolarHBondContact O-CA 3.27Å; G154-S230 PolarHBondContact O-OG 3.15Å; G154-S231 PolarHBondContact O-N 3.29Å
155	D	92.6	Very high	88.5	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-64.7	136.1	-178	-68.1	-10.7	0	0	0	111.6	C123 V124 F149 C152 S230 R238	C123-D155 CarbonylContact C-O 3.46Å; C123-D155 WeakPolarHBondContact CA-O 3.4Å; V124-D155 HydrophobicContact CG2-CB 4.27Å; V124-D155 PolarHBondContact N-O 2.77Å; F149-D155 HydrophobicContact CZ-CB 4.3Å; C152-D155 PolarHBondContact N-OD2 2.66Å; C152-D155 VanDerWaalsContact O-CB 3.25Å; C152-D155 WeakPolarHBondContact O-CB 3.33Å; C152-D155 PolarHBondContact O-N 2.73Å; D155-S230 WeakPolarHBondContact CA-OG 3.12Å; D155-S230 PolarHBondContact N-OG 3.39Å; D155-S230 VanDerWaalsContact OD1-CB 3.28Å; D155-S230 WeakPolarHBondContact OD1-CB 3.3Å; D155-S230 PolarHBondContact OD1-OG 3.12Å; D155-R238 IonicContact OD1-CZ 2.8Å; D155-R238 IonicContact OD1-NE 3.31Å; D155-R238 PolarHBondContact OD1-NE 2.63Å; D155-R238 IonicContact OD1-NH2 2.79Å; D155-R238 IonicContact OD2-CZ 3.85Å; D155-R238 IonicContact OD2-NE 3.8Å; D155-R238 PolarHBondContact OD2-NE 2.99Å; D155-R238 IonicContact OD2-NH2 3.16Å; D155-R238 PolarHBondContact OD2-NH2 3.42Å
156	W	92.4	Very high	87.6	Confident	93 Å²	93	54.9 Å²	54.9	35%	0.352	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	125.7	170.9	-75.8	96.8	0	0	0	109.4	I121 C123 G154 L178 E229	I121-W156 HydrophobicContact CG2-CE3 4.33Å; C123-W156 HydrophobicContact CB-CD2 4.24Å; C123-W156 HydrophobicContact CB-CE3 4.25Å; C123-W156 HydrophobicContact CB-CH2 4.31Å; C123-W156 HydrophobicContact CB-CZ2 4.29Å; C123-W156 HydrophobicContact CB-CZ3 4.29Å; G154-W156 PolarHBondContact O-N 2.87Å; W156-L178 HydrophobicContact CB-CB 3.96Å; W156-L178 HydrophobicContact CB-CD2 3.96Å; W156-L178 WeakPolarHBondContact O-CB 3.35Å; W156-L178 PolarHBondContact O-N 3.1Å; W156-E229 HydrophobicContact CB-CB 4.45Å; W156-E229 HydrophobicContact CB-CG 4.27Å; W156-E229 HydrophobicContact CG-CG 4.37Å; W156-E229 PolarHBondContact N-O 2.82Å
157	V	94.3	Very high	86.9	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	147.8	-175.9	-63.6	0	0	0	0	110.8	I121 G122 V124 I134 F149 V175 K176	I121-V157 WeakPolarHBondContact CA-O 3.46Å; G122-V157 PolarHBondContact N-O 2.71Å; G122-V157 VanDerWaalsContact N-O 3.07Å; G122-V157 WeakPolarHBondContact O-CG2 3.24Å; G122-V157 PolarHBondContact O-N 2.93Å; V124-V157 HydrophobicContact CG2-CG1 3.89Å; V124-V157 HydrophobicContact CG2-CG2 4.1Å; I134-V157 HydrophobicContact CD1-CG2 3.74Å; I134-V157 HydrophobicContact CG1-CG2 3.87Å; I134-V157 HydrophobicContact CG2-CG2 4.17Å; F149-V157 HydrophobicContact CE1-CG1 3.91Å; F149-V157 HydrophobicContact CZ-CG1 4.11Å; V157-V175 HydrophobicContact CB-CG1 3.83Å; V157-V175 HydrophobicContact CG1-CG1 3.93Å; V157-V175 HydrophobicContact CG2-CG1 4.03Å; V157-K176 CarbonylContact C-O 3.52Å; V157-K176 VanDerWaalsContact CA-O 3.23Å; V157-K176 WeakPolarHBondContact CA-O 3.31Å; V157-K176 WeakPolarHBondContact CB-O 3.32Å
158	E	93.8	Very high	86.2	Confident	50 Å²	50	54.6 Å²	54.6	23%	0.234	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125	161.9	-174.4	-175.9	127.1	0	0	107	V119 L120 I121 K176 L178	V119-E158 HydrophobicContact CG1-CG 3.54Å; L120-E158 CarbonylContact O-C 3.53Å; L120-E158 WeakPolarHBondContact O-CA 3.41Å; I121-E158 HydrophobicContact CG1-CB 4.24Å; I121-E158 HydrophobicContact CG1-CG 4.12Å; E158-K176 HydrophobicContact CB-CG 4.12Å; E158-K176 PolarHBondContact N-O 2.93Å; E158-K176 WeakPolarHBondContact O-CG 3.37Å; E158-K176 PolarHBondContact O-N 2.63Å; E158-K176 WeakPolarHBondContact OE1-CE 3.41Å; E158-K176 IonicContact OE1-NZ 3.64Å; E158-K176 PolarHBondContact OE1-NZ 2.91Å; E158-K176 IonicContact OE2-NZ 2.62Å; E158-L178 HydrophobicContact CB-CD1 4.34Å
159	A	93.1	Very high	86.2	Confident	2 Å²	2	53.4 Å²	53.4	2%	0.017	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	139.8	-176.9	0	0	0	0	0	111.1	V119 L120 I134 A172 S174 V175	V119-A159 CarbonylContact C-O 3.59Å; V119-A159 WeakPolarHBondContact CA-O 3.28Å; L120-A159 HydrophobicContact CD2-CB 4.48Å; L120-A159 PolarHBondContact N-O 2.86Å; L120-A159 PolarHBondContact O-N 3.2Å; I134-A159 HydrophobicContact CD1-CB 3.56Å; A159-A172 HydrophobicContact CB-CB 4.16Å; A159-S174 CarbonylContact C-O 3.47Å; A159-S174 WeakPolarHBondContact CA-O 3.42Å; A159-S174 WeakPolarHBondContact CB-O 3.11Å; A159-V175 HydrophobicContact CB-CG2 4.06Å
160	E	92.6	Very high	86	Confident	79 Å²	79	52.7 Å²	52.7	37%	0.369	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	129.9	165.1	-72.7	-179.3	-168.7	0	0	108.8	P117 R118 V119 A172 T173 S174	P117-E160 HydrophobicContact CB-CB 3.99Å; P117-E160 HydrophobicContact CB-CG 4.38Å; R118-E160 CarbonylContact O-C 3.28Å; R118-E160 VanDerWaalsContact O-CA 3.22Å; R118-E160 WeakPolarHBondContact O-CA 3.3Å; V119-E160 HydrophobicContact CG2-CG 4.41Å; E160-A172 CarbonylContact O-C 3.59Å; E160-A172 WeakPolarHBondContact O-CA 3.36Å; E160-T173 PolarHBondContact O-N 2.84Å; E160-T173 PolarHBondContact O-OG1 2.79Å; E160-S174 PolarHBondContact N-O 2.79Å; E160-S174 PolarHBondContact O-N 2.99Å
161	Y	90.6	Very high	86.1	Confident	5 Å²	5	50.6 Å²	50.6	2%	0.02	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	157.1	-179.2	79.7	-83.2	0	0	0	113	R118 L120 I163 E171 L515 A522	R118-Y161 HydrophobicContact CB-CD1 4.04Å; R118-Y161 HydrophobicContact CB-CE1 3.55Å; R118-Y161 PolarHBondContact N-O 3.43Å; R118-Y161 WeakPolarHBondContact O-CD1 3.41Å; R118-Y161 PolarHBondContact O-N 2.64Å; L120-Y161 HydrophobicContact CB-CD1 3.52Å; L120-Y161 HydrophobicContact CB-CE1 3.87Å; Y161-I163 HydrophobicContact CD2-CD1 4.21Å; Y161-I163 HydrophobicContact CE2-CD1 3.91Å; Y161-I163 HydrophobicContact CE2-CG1 4.47Å; Y161-E171 CarbonylContact C-O 3.26Å; Y161-E171 VanDerWaalsContact CA-O 3.23Å; Y161-E171 WeakPolarHBondContact CA-O 3.21Å; Y161-E171 WeakPolarHBondContact CB-O 3.47Å; Y161-L515 HydrophobicContact CD2-CD1 4.49Å; Y161-L515 HydrophobicContact CE1-CD1 4.46Å; Y161-L515 HydrophobicContact CE2-CB 4.13Å; Y161-L515 HydrophobicContact CE2-CD1 4.05Å; Y161-A522 HydrophobicContact CE1-CB 4.04Å
162	R	87.7	Confident	86.2	Confident	118 Å²	118	50.5 Å²	50.5	45%	0.445	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	150.5	171.6	-61.7	-176.4	-173.7	-179.2	1.9	109.6	E171 T173	R162-E171 PolarHBondContact N-O 2.72Å; R162-E171 PolarHBondContact O-N 2.86Å; R162-T173 HydrophobicContact CG-CG2 4.25Å
163	I	84.7	Confident	86.4	Confident	42 Å²	42	52.3 Å²	52.3	22%	0.215	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	121.2	172.2	-56.9	-57.9	0	0	0	108.1	Y161 P165 W168 L515 T516	Y161-I163 HydrophobicContact CD2-CD1 4.21Å; Y161-I163 HydrophobicContact CE2-CD1 3.91Å; Y161-I163 HydrophobicContact CE2-CG1 4.47Å; I163-P165 VanDerWaalsContact O-CD 3.31Å; I163-P165 WeakPolarHBondContact O-CD 3.42Å; I163-W168 HydrophobicContact CG2-CE3 3.96Å; I163-L515 HydrophobicContact CD1-CB 4.38Å; I163-T516 HydrophobicContact CG2-CG2 4.44Å
164	R	78.1	Confident	86.8	Confident	88 Å²	88	52.6 Å²	52.6	33%	0.332	28%	0.277	S	S	.	.	P	Polyproline II helix	trans	-67.1	121.4	177.7	-79.6	-162.3	-98	-136.2	-9.6	110.8	G166 T167 W168 S169 E171	R164-G166 PolarHBondContact O-N 3.1Å; R164-T167 WeakPolarHBondContact CB-OG1 3.27Å; R164-W168 PolarHBondContact O-N 2.85Å; R164-S169 PolarHBondContact N-O 2.8Å; R164-E171 WeakPolarHBondContact CD-OE2 3.42Å; R164-E171 HydrophobicContact CG-CB 4.25Å; R164-E171 WeakPolarHBondContact CG-OE2 3.29Å; R164-E171 IonicContact CZ-OE1 2.68Å; R164-E171 IonicContact CZ-OE2 3.89Å; R164-E171 IonicContact NE-OE2 3.83Å; R164-E171 PolarHBondContact NE-OE2 3.42Å; R164-E171 IonicContact NH1-OE1 2.66Å; R164-E171 PolarHBondContact NH1-OE1 3.01Å; R164-E171 IonicContact NH1-OE2 2.72Å; R164-E171 PolarHBondContact NH1-OE2 2.88Å; R164-E171 IonicContact NH2-OE1 2.76Å; R164-E171 PolarHBondContact NH2-OE1 2.85Å; R164-E171 IonicContact NH2-OE2 2.65Å
165	P	73.8	Confident	87.1	Confident	120 Å²	120	52.5 Å²	52.5	78%	0.779	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	124.1	171	-19.5	32.3	0	0	0	109.6	I163	I163-P165 VanDerWaalsContact O-CD 3.31Å; I163-P165 WeakPolarHBondContact O-CD 3.42Å
166	G	74.5	Confident	87.2	Confident	65 Å²	65	56.6 Å²	56.6	67%	0.67	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.9	-61.7	-179.6	0	0	0	0	0	113.5	R164	R164-G166 PolarHBondContact O-N 3.1Å
167	T	76.6	Confident	87.3	Confident	97 Å²	97	53.2 Å²	53.2	60%	0.595	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-18.9	177.4	58.8	0	0	0	0	113.1	R164 S169	R164-T167 WeakPolarHBondContact CB-OG1 3.27Å; T167-S169 PolarHBondContact O-N 3.44Å; T167-S169 VanDerWaalsContact O-N 3.16Å; T167-S169 PolarHBondContact OG1-OG 2.87Å
168	W	74.5	Confident	87.2	Confident	144 Å²	144	55 Å²	55	55%	0.545	29%	0.293	S	S	.	.			trans	52.1	34.3	-176.5	-64.2	99	0	0	0	113.1	I163 R164 I512 D513 T516	I163-W168 HydrophobicContact CG2-CE3 3.96Å; R164-W168 PolarHBondContact O-N 2.85Å; W168-I512 HydrophobicContact CB-CG2 3.89Å; W168-D513 VanDerWaalsContact O-CB 3.26Å; W168-D513 WeakPolarHBondContact O-CB 3.39Å; W168-T516 HydrophobicContact CD2-CG2 4.3Å; W168-T516 HydrophobicContact CE3-CG2 3.34Å; W168-T516 HydrophobicContact CZ3-CG2 3.8Å; W168-T516 PolarHBondContact O-OG1 3.3Å
169	S	82.4	Confident	87.1	Confident	36 Å²	36	59.3 Å²	59.3	25%	0.252	31%	0.307	S	S	.	.			trans	-108.5	140.6	177.8	62.3	0	0	0	0	110.2	R164 T167	R164-S169 PolarHBondContact N-O 2.8Å; T167-S169 PolarHBondContact O-N 3.44Å; T167-S169 VanDerWaalsContact O-N 3.16Å; T167-S169 PolarHBondContact OG1-OG 2.87Å
170	S	86.1	Confident	87.2	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	132.3	172.6	61.8	0	0	0	0	111.7	T138 Y139 D513	T138-S170 VanDerWaalsContact CA-OG 3.27Å; T138-S170 WeakPolarHBondContact CA-OG 3.35Å; T138-S170 WeakPolarHBondContact CB-OG 3.27Å; T138-S170 PolarHBondContact OG1-OG 2.84Å; Y139-S170 PolarHBondContact N-O 2.79Å; Y139-S170 VanDerWaalsContact N-O 3.14Å; S170-D513 WeakPolarHBondContact CA-OD2 3.46Å; S170-D513 WeakPolarHBondContact CB-OD2 3.24Å; S170-D513 PolarHBondContact N-OD2 3.39Å; S170-D513 PolarHBondContact OG-OD2 2.86Å
171	E	90.2	Very high	87.1	Confident	52 Å²	52	67.5 Å²	67.5	24%	0.243	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	127.1	174.8	175.6	168	-128.8	0	0	108.9	Y139 Y161 R162 R164	Y139-E171 HydrophobicContact CD1-CG 4.28Å; Y139-E171 CarbonylContact O-C 3.57Å; Y139-E171 WeakPolarHBondContact O-CA 3.48Å; Y161-E171 CarbonylContact C-O 3.26Å; Y161-E171 VanDerWaalsContact CA-O 3.23Å; Y161-E171 WeakPolarHBondContact CA-O 3.21Å; Y161-E171 WeakPolarHBondContact CB-O 3.47Å; R162-E171 PolarHBondContact N-O 2.72Å; R162-E171 PolarHBondContact O-N 2.86Å; R164-E171 WeakPolarHBondContact CD-OE2 3.42Å; R164-E171 HydrophobicContact CG-CB 4.25Å; R164-E171 WeakPolarHBondContact CG-OE2 3.29Å; R164-E171 IonicContact CZ-OE1 2.68Å; R164-E171 IonicContact CZ-OE2 3.89Å; R164-E171 IonicContact NE-OE2 3.83Å; R164-E171 PolarHBondContact NE-OE2 3.42Å; R164-E171 IonicContact NH1-OE1 2.66Å; R164-E171 PolarHBondContact NH1-OE1 3.01Å; R164-E171 IonicContact NH1-OE2 2.72Å; R164-E171 PolarHBondContact NH1-OE2 2.88Å; R164-E171 IonicContact NH2-OE1 2.76Å; R164-E171 PolarHBondContact NH2-OE1 2.85Å; R164-E171 IonicContact NH2-OE2 2.65Å
172	A	92.3	Very high	87.3	Confident	4 Å²	4	75.2 Å²	75.2	3%	0.033	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	130.8	174.2	0	0	0	0	0	110.4	I134 T138 Y139 F140 A159 E160 V175	I134-A172 HydrophobicContact CD1-CB 4.43Å; T138-A172 HydrophobicContact CG2-CB 4.19Å; Y139-A172 PolarHBondContact O-N 3.48Å; F140-A172 HydrophobicContact CB-CB 3.7Å; A159-A172 HydrophobicContact CB-CB 4.16Å; E160-A172 CarbonylContact O-C 3.59Å; E160-A172 WeakPolarHBondContact O-CA 3.36Å; A172-V175 HydrophobicContact CB-CG2 3.87Å
173	T	90.8	Very high	87.5	Confident	63 Å²	63	70.5 Å²	70.5	39%	0.387	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	-21.6	176.2	52.4	0	0	0	0	112.8	E160 R162	E160-T173 PolarHBondContact O-N 2.84Å; E160-T173 PolarHBondContact O-OG1 2.79Å; R162-T173 HydrophobicContact CG-CG2 4.25Å
174	S	93.2	Very high	87.9	Confident	44 Å²	44	72.6 Å²	72.6	31%	0.308	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	137.1	176.2	177.7	0	0	0	0	109.2	S144 A159 E160	S144-S174 CarbonylContact O-C 3.5Å; S144-S174 VanDerWaalsContact O-CA 3.28Å; S144-S174 WeakPolarHBondContact O-CA 3.21Å; A159-S174 CarbonylContact C-O 3.47Å; A159-S174 WeakPolarHBondContact CA-O 3.42Å; A159-S174 WeakPolarHBondContact CB-O 3.11Å; E160-S174 PolarHBondContact N-O 2.79Å; E160-S174 PolarHBondContact O-N 2.99Å
175	V	95.3	Very high	88.5	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	123.9	178.9	-176.5	0	0	0	0	109.9	I134 F140 S144 V145 C146 V157 A159 A172	I134-V175 HydrophobicContact CD1-CG1 4.46Å; I134-V175 HydrophobicContact CD1-CG2 4.21Å; F140-V175 HydrophobicContact CB-CG2 3.84Å; F140-V175 HydrophobicContact CD2-CG2 4.12Å; F140-V175 HydrophobicContact CG-CG2 4.02Å; S144-V175 PolarHBondContact O-N 2.85Å; V145-V175 WeakPolarHBondContact CA-O 3.48Å; V145-V175 HydrophobicContact CG2-CB 4.21Å; C146-V175 PolarHBondContact N-O 3.04Å; V157-V175 HydrophobicContact CB-CG1 3.83Å; V157-V175 HydrophobicContact CG1-CG1 3.93Å; V157-V175 HydrophobicContact CG2-CG1 4.03Å; A159-V175 HydrophobicContact CB-CG2 4.06Å; A172-V175 HydrophobicContact CB-CG2 3.87Å
176	K	94.6	Very high	89.4	Confident	87 Å²	87	70.2 Å²	70.2	38%	0.378	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.2	176.7	68	-178.2	180	-170.1	0	111	C146 V157 E158 L178	C146-K176 HydrophobicContact CB-CB 4.25Å; V157-K176 CarbonylContact C-O 3.52Å; V157-K176 VanDerWaalsContact CA-O 3.23Å; V157-K176 WeakPolarHBondContact CA-O 3.31Å; V157-K176 WeakPolarHBondContact CB-O 3.32Å; E158-K176 HydrophobicContact CB-CG 4.12Å; E158-K176 PolarHBondContact N-O 2.93Å; E158-K176 WeakPolarHBondContact O-CG 3.37Å; E158-K176 PolarHBondContact O-N 2.63Å; E158-K176 WeakPolarHBondContact OE1-CE 3.41Å; E158-K176 IonicContact OE1-NZ 3.64Å; E158-K176 PolarHBondContact OE1-NZ 2.91Å; E158-K176 IonicContact OE2-NZ 2.62Å; K176-L178 PolarHBondContact O-N 2.73Å
177	P	95	Very high	90.2	Very high	22 Å²	22	69.5 Å²	69.5	14%	0.143	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.1	137.5	176	26.1	-33.8	0	0	0	110.6	F149 Y180 V228	F149-P177 HydrophobicContact CD2-CG 4.48Å; F149-P177 HydrophobicContact CE1-CB 4.43Å; F149-P177 HydrophobicContact CE2-CB 4.26Å; F149-P177 HydrophobicContact CG-CG 4.41Å; F149-P177 HydrophobicContact CZ-CB 4.21Å; P177-Y180 HydrophobicContact CG-CD1 4.44Å; P177-V228 HydrophobicContact CB-CB 4.38Å; P177-V228 HydrophobicContact CB-CG1 3.77Å; P177-V228 HydrophobicContact CG-CG1 4.35Å
178	L	92.2	Very high	90.9	Very high	36 Å²	36	64.9 Å²	64.9	19%	0.188	30%	0.299	C	S	.	.	S	Bend	trans	-62	-46.4	-179.6	177.8	63.7	0	0	0	111.2	I121 W156 E158 K176	I121-L178 HydrophobicContact CB-CD1 4.47Å; I121-L178 HydrophobicContact CD1-CD1 3.58Å; I121-L178 HydrophobicContact CG1-CD1 3.82Å; I121-L178 HydrophobicContact CG2-CD1 3.81Å; I121-L178 HydrophobicContact CG2-CD2 3.75Å; I121-L178 HydrophobicContact CG2-CG 4.35Å; W156-L178 HydrophobicContact CB-CB 3.96Å; W156-L178 HydrophobicContact CB-CD2 3.96Å; W156-L178 WeakPolarHBondContact O-CB 3.35Å; W156-L178 PolarHBondContact O-N 3.1Å; E158-L178 HydrophobicContact CB-CD1 4.34Å; K176-L178 PolarHBondContact O-N 2.73Å
179	R	91.5	Very high	91.5	Very high	141 Å²	141	58.8 Å²	58.8	53%	0.532	28%	0.278	S	S	.	.			trans	-142.1	144.6	173.5	-60.5	-178.5	-137.8	-138.1	-7	109.5	V228 E229 W237	R179-V228 WeakPolarHBondContact O-CA 3.2Å; R179-E229 HydrophobicContact CB-CB 4.15Å; R179-E229 WeakPolarHBondContact CD-OE2 3.47Å; R179-E229 WeakPolarHBondContact CG-OE2 3.28Å; R179-E229 IonicContact CZ-OE2 2.7Å; R179-E229 IonicContact NE-OE2 3.96Å; R179-E229 PolarHBondContact NE-OE2 3.47Å; R179-E229 PolarHBondContact O-N 3.24Å; R179-W237 HydrophobicContact CB-CH2 4.32Å
180	Y	93.5	Very high	91.6	Very high	166 Å²	166	57.7 Å²	57.7	65%	0.651	27%	0.27	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	155.7	170.3	73.3	-83.3	0	0	0	109.8	P177 V227	P177-Y180 HydrophobicContact CG-CD1 4.44Å; Y180-V227 CarbonylContact C-O 3.55Å; Y180-V227 WeakPolarHBondContact CA-O 3.48Å; Y180-V227 WeakPolarHBondContact CB-O 3.48Å
181	K	92.3	Very high	91.4	Very high	87 Å²	87	60 Å²	60	38%	0.378	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	156.2	173	63.3	-179.5	179.9	179.2	0	110.1	V183 V227 W237	K181-V183 HydrophobicContact CD-CG1 4.37Å; K181-V183 HydrophobicContact CG-CG1 4.32Å; K181-V227 HydrophobicContact CD-CG2 4.25Å; K181-V227 HydrophobicContact CG-CG2 3.4Å; K181-V227 PolarHBondContact N-O 3.03Å; K181-V227 WeakPolarHBondContact O-CG2 3.46Å; K181-V227 PolarHBondContact O-N 2.73Å; K181-W237 HydrophobicContact CD-CH2 4.11Å; K181-W237 HydrophobicContact CD-CZ2 4.2Å; K181-W237 HydrophobicContact CD-CZ3 4.33Å; K181-W237 HydrophobicContact CG-CE3 4.42Å; K181-W237 HydrophobicContact CG-CH2 4.27Å; K181-W237 HydrophobicContact CG-CZ3 4.06Å
182	R	93.4	Very high	90.8	Very high	168 Å²	168	58.2 Å²	58.2	63%	0.634	28%	0.276	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.1	133.8	168.1	-177.4	174.4	168.5	171	-1.8	108.7	D184	R182-D184 IonicContact CZ-OD1 2.7Å; R182-D184 IonicContact NE-OD1 2.73Å; R182-D184 PolarHBondContact NE-OD1 2.76Å; R182-D184 IonicContact NE-OD2 2.69Å; R182-D184 IonicContact NH2-OD1 3.58Å; R182-D184 PolarHBondContact NH2-OD1 3.49Å
183	V	92.1	Very high	89.9	Confident	19 Å²	19	59.4 Å²	59.4	12%	0.115	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	127.3	172.3	-63.3	0	0	0	0	108.4	K181 V186 I202 N224 A225 V227	K181-V183 HydrophobicContact CD-CG1 4.37Å; K181-V183 HydrophobicContact CG-CG1 4.32Å; V183-V186 HydrophobicContact CB-CG1 3.89Å; V183-V186 HydrophobicContact CG2-CG1 4.06Å; V183-V186 HydrophobicContact CG2-CG2 3.95Å; V183-I202 HydrophobicContact CG1-CD1 4.19Å; V183-I202 HydrophobicContact CG2-CD1 3.97Å; V183-N224 CarbonylContact O-C 3.59Å; V183-N224 WeakPolarHBondContact O-CA 3.34Å; V183-A225 HydrophobicContact CG2-CB 3.83Å; V183-A225 WeakPolarHBondContact CG2-O 3.44Å; V183-A225 PolarHBondContact N-O 3.37Å; V183-A225 PolarHBondContact O-N 2.67Å; V183-V227 HydrophobicContact CG1-CG2 4.19Å; V183-V227 HydrophobicContact CG2-CG1 3.92Å
184	D	93.5	Very high	89.3	Confident	85 Å²	85	63 Å²	63	46%	0.455	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	140.7	-177.6	-66.3	-56.5	0	0	0	109.9	R182 N224	R182-D184 IonicContact CZ-OD1 2.7Å; R182-D184 IonicContact NE-OD1 2.73Å; R182-D184 PolarHBondContact NE-OD1 2.76Å; R182-D184 IonicContact NE-OD2 2.69Å; R182-D184 IonicContact NH2-OD1 3.58Å; R182-D184 PolarHBondContact NH2-OD1 3.49Å; D184-N224 VanDerWaalsContact CA-OD1 3.23Å; D184-N224 WeakPolarHBondContact CA-OD1 3.42Å
185	K	91.3	Very high	89	Confident	154 Å²	154	62.2 Å²	62.2	67%	0.67	29%	0.287	S	S	*	.	E	Extended strand (participates in β ladder)	trans	58.7	42.3	176.5	-56.7	178.9	180	174.8	0	115.2	V222 V223 N224	K185-V222 HydrophobicContact CB-CG1 4.1Å; K185-V223 CarbonylContact C-O 3.46Å; K185-V223 PolarHBondContact N-O 2.98Å; K185-N224 PolarHBondContact N-OD1 3.39Å
186	V	91.8	Very high	88.6	Confident	5 Å²	5	62.3 Å²	62.3	3%	0.03	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	145.9	176.7	-62.3	0	0	0	0	111.8	V183 L198 E199 V222 V223	V183-V186 HydrophobicContact CB-CG1 3.89Å; V183-V186 HydrophobicContact CG2-CG1 4.06Å; V183-V186 HydrophobicContact CG2-CG2 3.95Å; V186-L198 HydrophobicContact CB-CB 4.48Å; V186-L198 HydrophobicContact CG2-CB 4.07Å; V186-L198 HydrophobicContact CG2-CD1 3.9Å; V186-L198 HydrophobicContact CG2-CG 4.47Å; V186-E199 WeakPolarHBondContact CA-OE1 3.35Å; V186-E199 HydrophobicContact CB-CG 3.89Å; V186-E199 HydrophobicContact CG1-CG 4.23Å; V186-V222 CarbonylContact O-C 3.48Å; V186-V222 WeakPolarHBondContact O-CA 3.49Å; V186-V223 HydrophobicContact CG2-CG2 3.92Å; V186-V223 WeakPolarHBondContact CG2-O 3.39Å; V186-V223 PolarHBondContact N-O 2.99Å; V186-V223 PolarHBondContact O-N 3.29Å
187	C	92.1	Very high	88.4	Confident	49 Å²	49	58.4 Å²	58.4	33%	0.331	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	138.3	-176.8	-176.5	0	0	0	0	112.8	S189 L198 E199 D221	C187-S189 PolarHBondContact O-N 3.05Å; C187-L198 CarbonylContact O-C 3.58Å; C187-L198 WeakPolarHBondContact O-CA 3.39Å; C187-E199 PolarHBondContact O-N 3.48Å; C187-D221 CarbonylContact C-O 3.58Å; C187-D221 WeakPolarHBondContact CA-O 3.42Å
188	I	91.8	Very high	88.1	Confident	0 Å²	0	57.3 Å²	57.3	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.6	101.6	169.2	-54.4	-169.1	0	0	0	109.2	L191 L198 F204 P217 R218 G220 D221 V223 M242	I188-L191 HydrophobicContact CG2-CB 4.48Å; I188-L198 HydrophobicContact CB-CD2 4.36Å; I188-L198 HydrophobicContact CD1-CD2 4.47Å; I188-L198 HydrophobicContact CG1-CD2 3.65Å; I188-F204 HydrophobicContact CD1-CZ 4.34Å; I188-F204 HydrophobicContact CG2-CE1 4.19Å; I188-F204 HydrophobicContact CG2-CZ 4.09Å; I188-P217 HydrophobicContact CD1-CB 3.61Å; I188-R218 WeakPolarHBondContact CB-O 3.35Å; I188-R218 WeakPolarHBondContact CD1-O 3.35Å; I188-G220 PolarHBondContact O-N 3.46Å; I188-D221 HydrophobicContact CD1-CB 4Å; I188-D221 HydrophobicContact CG1-CB 4.19Å; I188-D221 PolarHBondContact N-O 3.48Å; I188-V223 HydrophobicContact CD1-CG1 4.25Å; I188-V223 HydrophobicContact CG1-CG1 4.34Å; I188-M242 HydrophobicContact CD1-SD 4.34Å
189	S	86	Confident	87.8	Confident	17 Å²	17	60.6 Å²	60.6	12%	0.119	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	-40	-175.6	60.9	0	0	0	0	113.2	C187 V197 E200 R219	C187-S189 PolarHBondContact O-N 3.05Å; S189-V197 PolarHBondContact N-O 3.45Å; S189-V197 PolarHBondContact OG-O 3.36Å; S189-E200 WeakPolarHBondContact CB-OE1 3.23Å; S189-E200 PolarHBondContact OG-N 2.98Å; S189-E200 VanDerWaalsContact OG-N 3.12Å; S189-R219 PolarHBondContact O-NE 3.13Å
190	S	84.2	Confident	87.3	Confident	12 Å²	12	56.1 Å²	56.1	8%	0.084	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	151.2	177.1	65.4	0	0	0	0	110.9	G196 V197	S190-G196 CarbonylContact O-C 3.51Å; S190-G196 VanDerWaalsContact O-CA 3.23Å; S190-G196 WeakPolarHBondContact O-CA 3.38Å; S190-V197 PolarHBondContact N-O 3.18Å; S190-V197 PolarHBondContact O-N 3.47Å; S190-V197 WeakPolarHBondContact OG-CB 3.48Å; S190-V197 VanDerWaalsContact OG-CG2 3.29Å; S190-V197 WeakPolarHBondContact OG-CG2 3.18Å
191	L	83.1	Confident	86.8	Confident	48 Å²	48	50.7 Å²	50.7	25%	0.251	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	113.5	174.1	-176.1	71	0	0	0	107.6	I188 F204 P217	I188-L191 HydrophobicContact CG2-CB 4.48Å; L191-F204 HydrophobicContact CD1-CE2 3.84Å; L191-F204 HydrophobicContact CD1-CZ 3.82Å; L191-P217 WeakPolarHBondContact CD2-O 3.3Å
192	C	76.3	Confident	86.8	Confident	15 Å²	15	46.8 Å²	46.8	10%	0.101	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	105.4	-175.7	-178.4	0	0	0	0	109.2	R194 N195 L1180	C192-R194 PolarHBondContact O-N 3.34Å; C192-N195 CarbonylContact C-O 3.49Å; C192-N195 PolarHBondContact N-O 3.38Å; C192-N195 PolarHBondContact O-N 2.93Å; C192-N195 VanDerWaalsContact O-O 3.09Å; C192-L1180 WeakPolarHBondContact SG-CD2 3.4Å
193	G	74.1	Confident	86.7	Confident	29 Å²	29	39.2 Å²	39.2	30%	0.299	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.9	-116.4	-174.3	0	0	0	0	0	112.6
194	R	78.8	Confident	86.7	Confident	138 Å²	138	38.3 Å²	38.3	52%	0.521	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96	-1.2	177.4	-69.8	-164.2	151.4	-174.5	-7.2	113.9	C192 T205 L206 D207	C192-R194 PolarHBondContact O-N 3.34Å; R194-T205 CarbonylContact O-C 3.59Å; R194-T205 WeakPolarHBondContact O-CA 3.4Å; R194-L206 HydrophobicContact CB-CB 4.41Å; R194-L206 PolarHBondContact O-N 2.9Å; R194-D207 WeakPolarHBondContact CD-OD1 3.31Å; R194-D207 IonicContact CZ-OD1 3.79Å; R194-D207 VanDerWaalsContact CZ-OD1 3.29Å; R194-D207 IonicContact NE-OD1 2.98Å; R194-D207 IonicContact NH1-OD1 2.77Å; R194-D207 PolarHBondContact NH1-OD1 3.01Å
195	N	85.5	Confident	86.4	Confident	28 Å²	28	35.3 Å²	35.3	15%	0.15	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	148.8	-177.5	-63.4	-18.2	0	0	0	110	C192 F203 F204 T205	C192-N195 CarbonylContact C-O 3.49Å; C192-N195 PolarHBondContact N-O 3.38Å; C192-N195 PolarHBondContact O-N 2.93Å; C192-N195 VanDerWaalsContact O-O 3.09Å; N195-F203 HydrophobicContact CB-CE2 3.9Å; N195-F203 HydrophobicContact CB-CZ 3.94Å; N195-F204 CarbonylContact C-O 3.54Å; N195-F204 WeakPolarHBondContact CA-O 3Å; N195-T205 PolarHBondContact OD1-OG1 2.8Å
196	G	88	Confident	86.1	Confident	2 Å²	2	30.5 Å²	30.5	2%	0.021	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	172.8	175.6	0	0	0	0	0	112.5	S190 F204	S190-G196 CarbonylContact O-C 3.51Å; S190-G196 VanDerWaalsContact O-CA 3.23Å; S190-G196 WeakPolarHBondContact O-CA 3.38Å; G196-F204 PolarHBondContact N-O 3.44Å; G196-F204 WeakPolarHBondContact O-CD1 3.43Å; G196-F204 PolarHBondContact O-N 3.27Å
197	V	89.2	Confident	85.7	Confident	5 Å²	5	35.2 Å²	35.2	3%	0.03	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	130.7	-175.8	-172.8	0	0	0	0	110.5	S189 S190 I202 Y235	S189-V197 PolarHBondContact N-O 3.45Å; S189-V197 PolarHBondContact OG-O 3.36Å; S190-V197 PolarHBondContact N-O 3.18Å; S190-V197 PolarHBondContact O-N 3.47Å; S190-V197 WeakPolarHBondContact OG-CB 3.48Å; S190-V197 VanDerWaalsContact OG-CG2 3.29Å; S190-V197 WeakPolarHBondContact OG-CG2 3.18Å; V197-I202 CarbonylContact C-O 3.57Å; V197-I202 VanDerWaalsContact CA-O 3.22Å; V197-I202 WeakPolarHBondContact CA-O 3.25Å; V197-I202 WeakPolarHBondContact CG1-O 3.16Å; V197-Y235 HydrophobicContact CG1-CD1 4.23Å; V197-Y235 HydrophobicContact CG1-CE1 3.67Å; V197-Y235 HydrophobicContact CG2-CE1 4.14Å; V197-Y235 HydrophobicContact CG2-CE2 3.88Å
198	L	90	Very high	85.4	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	131.7	170	-41.3	174.3	0	0	0	109.4	V186 C187 I188 E200 S201 I202 F204 V223 A225 A239 M242	V186-L198 HydrophobicContact CB-CB 4.48Å; V186-L198 HydrophobicContact CG2-CB 4.07Å; V186-L198 HydrophobicContact CG2-CD1 3.9Å; V186-L198 HydrophobicContact CG2-CG 4.47Å; C187-L198 CarbonylContact O-C 3.58Å; C187-L198 WeakPolarHBondContact O-CA 3.39Å; I188-L198 HydrophobicContact CB-CD2 4.36Å; I188-L198 HydrophobicContact CD1-CD2 4.47Å; I188-L198 HydrophobicContact CG1-CD2 3.65Å; L198-E200 PolarHBondContact O-N 2.99Å; L198-S201 PolarHBondContact O-N 2.96Å; L198-I202 HydrophobicContact CB-CB 4.05Å; L198-I202 HydrophobicContact CB-CD1 4.36Å; L198-I202 HydrophobicContact CD1-CG2 4.09Å; L198-I202 HydrophobicContact CG-CB 4.44Å; L198-I202 HydrophobicContact CG-CG2 4.38Å; L198-I202 PolarHBondContact N-O 3.45Å; L198-I202 PolarHBondContact O-N 3.47Å; L198-F204 HydrophobicContact CD2-CD1 3.89Å; L198-F204 HydrophobicContact CD2-CE1 3.63Å; L198-F204 HydrophobicContact CG-CD1 3.98Å; L198-F204 HydrophobicContact CG-CE1 4.19Å; L198-V223 HydrophobicContact CD1-CG2 4.17Å; L198-V223 HydrophobicContact CD2-CG2 3.86Å; L198-A225 HydrophobicContact CD1-CB 3.74Å; L198-A239 HydrophobicContact CD1-CB 4.27Å; L198-M242 HydrophobicContact CD1-CE 4.3Å; L198-M242 HydrophobicContact CD2-CE 4.01Å
199	E	84.7	Confident	85.2	Confident	105 Å²	105	34.4 Å²	34.4	49%	0.491	19%	0.185	S	C	.	.	T	Hydrogen-bonded Turn	trans	43.6	39.2	178.3	-71.7	-172.9	171.1	0	0	114.4	V186 C187 S201	V186-E199 WeakPolarHBondContact CA-OE1 3.35Å; V186-E199 HydrophobicContact CB-CG 3.89Å; V186-E199 HydrophobicContact CG1-CG 4.23Å; C187-E199 PolarHBondContact O-N 3.48Å; E199-S201 PolarHBondContact O-N 3.23Å; E199-S201 PolarHBondContact O-OG 3.27Å
200	E	81.3	Confident	85.4	Confident	46 Å²	46	37.9 Å²	37.9	22%	0.215	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	58	9.4	179.1	-54.9	-71.8	174.1	0	0	115.5	S189 L198 Y235 R989	S189-E200 WeakPolarHBondContact CB-OE1 3.23Å; S189-E200 PolarHBondContact OG-N 2.98Å; S189-E200 VanDerWaalsContact OG-N 3.12Å; L198-E200 PolarHBondContact O-N 2.99Å; E200-Y235 WeakPolarHBondContact O-CE1 3.47Å; E200-R989 VanDerWaalsContact CD-NH2 3.35Å; E200-R989 IonicContact OE1-CZ 2.67Å; E200-R989 IonicContact OE1-NH2 2.9Å; E200-R989 PolarHBondContact OE1-NH2 2.85Å
201	S	84	Confident	85.7	Confident	53 Å²	53	39.9 Å²	39.9	37%	0.371	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-133.4	-24.3	-170.6	60.1	0	0	0	0	114.7	L198 E199	L198-S201 PolarHBondContact O-N 2.96Å; E199-S201 PolarHBondContact O-N 3.23Å; E199-S201 PolarHBondContact O-OG 3.27Å
202	I	90.5	Very high	85.9	Confident	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	117.7	-176.6	-60.6	154.2	0	0	0	109.2	V183 V197 L198 V227 W237 A239	V183-I202 HydrophobicContact CG1-CD1 4.19Å; V183-I202 HydrophobicContact CG2-CD1 3.97Å; V197-I202 CarbonylContact C-O 3.57Å; V197-I202 VanDerWaalsContact CA-O 3.22Å; V197-I202 WeakPolarHBondContact CA-O 3.25Å; V197-I202 WeakPolarHBondContact CG1-O 3.16Å; L198-I202 HydrophobicContact CB-CB 4.05Å; L198-I202 HydrophobicContact CB-CD1 4.36Å; L198-I202 HydrophobicContact CD1-CG2 4.09Å; L198-I202 HydrophobicContact CG-CB 4.44Å; L198-I202 HydrophobicContact CG-CG2 4.38Å; L198-I202 PolarHBondContact N-O 3.45Å; L198-I202 PolarHBondContact O-N 3.47Å; I202-V227 HydrophobicContact CD1-CG1 4.12Å; I202-V227 HydrophobicContact CG1-CG1 4.32Å; I202-V227 HydrophobicContact CG2-CB 4.3Å; I202-V227 HydrophobicContact CG2-CG1 3.51Å; I202-W237 HydrophobicContact CB-CB 4.34Å; I202-W237 HydrophobicContact CG1-CB 3.86Å; I202-W237 HydrophobicContact CG2-CB 4.36Å; I202-A239 HydrophobicContact CG2-CB 4.05Å
203	F	91.9	Very high	86.3	Confident	9 Å²	9	47.8 Å²	47.8	4%	0.039	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	147.8	177.2	-178	-100.4	0	0	0	112	N195 T205 Q232 Y235 W237 R238 A239 P1156	N195-F203 HydrophobicContact CB-CE2 3.9Å; N195-F203 HydrophobicContact CB-CZ 3.94Å; F203-T205 VanDerWaalsContact CE1-OG1 3.24Å; F203-T205 WeakPolarHBondContact CE1-OG1 2.94Å; F203-T205 WeakPolarHBondContact CZ-OG1 3.31Å; F203-Q232 HydrophobicContact CB-CB 3.89Å; F203-Q232 HydrophobicContact CB-CG 4.28Å; F203-Q232 HydrophobicContact CD1-CB 3.72Å; F203-Q232 HydrophobicContact CD1-CG 3.72Å; F203-Q232 HydrophobicContact CE1-CB 4.43Å; F203-Q232 HydrophobicContact CE1-CG 4.45Å; F203-Q232 HydrophobicContact CG-CB 3.83Å; F203-Q232 HydrophobicContact CG-CG 4.26Å; F203-Y235 HydrophobicContact CB-CD2 3.83Å; F203-Y235 HydrophobicContact CB-CG 3.97Å; F203-Y235 AromaticContact CD2-CD2 3.87Å; F203-Y235 HydrophobicContact CD2-CD2 3.87Å; F203-Y235 HydrophobicContact CD2-CE2 4.16Å; F203-Y235 HydrophobicContact CG-CD2 4.22Å; F203-W237 PolarHBondContact N-O 2.93Å; F203-R238 CarbonylContact O-C 3.49Å; F203-R238 VanDerWaalsContact O-CA 3.23Å; F203-R238 WeakPolarHBondContact O-CA 3.2Å; F203-A239 PolarHBondContact O-N 3.45Å; F203-P1156 HydrophobicContact CD2-CB 4.42Å; F203-P1156 HydrophobicContact CD2-CG 4.18Å; F203-P1156 HydrophobicContact CE2-CB 4.06Å; F203-P1156 HydrophobicContact CE2-CG 3.58Å; F203-P1156 HydrophobicContact CZ-CG 4.08Å
204	F	92.2	Very high	86.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	151.1	166.3	69.1	-93.7	0	0	0	111.6	I188 L191 N195 G196 L198 L206 L209 P217 A239 M242	I188-F204 HydrophobicContact CD1-CZ 4.34Å; I188-F204 HydrophobicContact CG2-CE1 4.19Å; I188-F204 HydrophobicContact CG2-CZ 4.09Å; L191-F204 HydrophobicContact CD1-CE2 3.84Å; L191-F204 HydrophobicContact CD1-CZ 3.82Å; N195-F204 CarbonylContact C-O 3.54Å; N195-F204 WeakPolarHBondContact CA-O 3Å; G196-F204 PolarHBondContact N-O 3.44Å; G196-F204 WeakPolarHBondContact O-CD1 3.43Å; G196-F204 PolarHBondContact O-N 3.27Å; L198-F204 HydrophobicContact CD2-CD1 3.89Å; L198-F204 HydrophobicContact CD2-CE1 3.63Å; L198-F204 HydrophobicContact CG-CD1 3.98Å; L198-F204 HydrophobicContact CG-CE1 4.19Å; F204-L206 HydrophobicContact CE2-CD2 4.23Å; F204-L209 HydrophobicContact CB-CD1 4.36Å; F204-L209 HydrophobicContact CB-CD2 4.37Å; F204-L209 HydrophobicContact CD2-CD2 3.7Å; F204-L209 HydrophobicContact CE2-CD2 4.3Å; F204-L209 HydrophobicContact CG-CD2 4.26Å; F204-P217 HydrophobicContact CE2-CB 4.46Å; F204-A239 HydrophobicContact CB-CB 3.94Å; F204-M242 HydrophobicContact CB-CE 4.25Å; F204-M242 HydrophobicContact CD1-CE 3.76Å; F204-M242 HydrophobicContact CD2-CE 3.93Å; F204-M242 HydrophobicContact CE1-CE 3.97Å; F204-M242 HydrophobicContact CE2-CE 4.14Å; F204-M242 HydrophobicContact CG-CE 3.72Å; F204-M242 HydrophobicContact CZ-CE 4.14Å
205	T	87.4	Confident	87.1	Confident	22 Å²	22	45.2 Å²	45.2	14%	0.135	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	128.7	172.6	-79.4	0	0	0	0	108.2	R194 N195 F203 D207 S208 L209	R194-T205 CarbonylContact O-C 3.59Å; R194-T205 WeakPolarHBondContact O-CA 3.4Å; N195-T205 PolarHBondContact OD1-OG1 2.8Å; F203-T205 VanDerWaalsContact CE1-OG1 3.24Å; F203-T205 WeakPolarHBondContact CE1-OG1 2.94Å; F203-T205 WeakPolarHBondContact CZ-OG1 3.31Å; T205-D207 HydrophobicContact CG2-CB 3.67Å; T205-D207 WeakPolarHBondContact CG2-OD2 3.25Å; T205-D207 PolarHBondContact O-N 2.66Å; T205-D207 VanDerWaalsContact O-N 3.12Å; T205-S208 PolarHBondContact O-N 2.78Å; T205-S208 PolarHBondContact O-OG 2.99Å; T205-S208 VanDerWaalsContact O-OG 3.11Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 3.27Å; T205-L209 VanDerWaalsContact O-N 3.15Å
206	L	86	Confident	87.1	Confident	54 Å²	54	47.5 Å²	47.5	28%	0.283	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-24.3	-179.9	-65.8	-179.1	0	0	0	113.1	R194 F204 S208 L209 L211 P217	R194-L206 HydrophobicContact CB-CB 4.41Å; R194-L206 PolarHBondContact O-N 2.9Å; F204-L206 HydrophobicContact CE2-CD2 4.23Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 3.09Å; L206-L209 HydrophobicContact CD2-CD2 4.22Å; L206-L211 HydrophobicContact CD2-CD1 4.04Å; L206-P217 HydrophobicContact CD2-CG 3.88Å
207	D	83.2	Confident	87.2	Confident	104 Å²	104	47.6 Å²	47.6	56%	0.556	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.6	-23.6	176.6	-53.6	-51.2	0	0	0	113.3	R194 T205	R194-D207 WeakPolarHBondContact CD-OD1 3.31Å; R194-D207 IonicContact CZ-OD1 3.79Å; R194-D207 VanDerWaalsContact CZ-OD1 3.29Å; R194-D207 IonicContact NE-OD1 2.98Å; R194-D207 IonicContact NH1-OD1 2.77Å; R194-D207 PolarHBondContact NH1-OD1 3.01Å; T205-D207 HydrophobicContact CG2-CB 3.67Å; T205-D207 WeakPolarHBondContact CG2-OD2 3.25Å; T205-D207 PolarHBondContact O-N 2.66Å; T205-D207 VanDerWaalsContact O-N 3.12Å
208	S	84.2	Confident	87	Confident	19 Å²	19	50.9 Å²	50.9	13%	0.133	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	1.2	-174.7	66.4	0	0	0	0	113.8	C152 T205 L206 R238	C152-S208 VanDerWaalsContact SG-CB 3.53Å; T205-S208 PolarHBondContact O-N 2.78Å; T205-S208 PolarHBondContact O-OG 2.99Å; T205-S208 VanDerWaalsContact O-OG 3.11Å; L206-S208 VanDerWaalsContact C-N 3.3Å; L206-S208 PolarHBondContact O-N 3.09Å; S208-R238 PolarHBondContact OG-NH1 3.05Å
209	L	89.1	Confident	86.7	Confident	13 Å²	13	57.2 Å²	57.2	7%	0.068	31%	0.312	C	S	.	.			trans	-104.2	122.1	-169.4	178.3	74	0	0	0	110.2	F204 T205 L206 L211 A239 M242	F204-L209 HydrophobicContact CB-CD1 4.36Å; F204-L209 HydrophobicContact CB-CD2 4.37Å; F204-L209 HydrophobicContact CD2-CD2 3.7Å; F204-L209 HydrophobicContact CE2-CD2 4.3Å; F204-L209 HydrophobicContact CG-CD2 4.26Å; T205-L209 WeakPolarHBondContact O-CB 3.24Å; T205-L209 PolarHBondContact O-N 3.27Å; T205-L209 VanDerWaalsContact O-N 3.15Å; L206-L209 HydrophobicContact CD2-CD2 4.22Å; L209-L211 HydrophobicContact CD2-CD1 4.22Å; L209-L211 HydrophobicContact CD2-CD2 3.75Å; L209-L211 HydrophobicContact CD2-CG 3.98Å; L209-L211 HydrophobicContact CG-CD2 4.16Å; L209-L211 HydrophobicContact CG-CG 4.12Å; L209-L211 PolarHBondContact O-N 2.79Å; L209-A239 HydrophobicContact CD1-CB 4.01Å; L209-M242 HydrophobicContact CD1-CB 4.47Å; L209-M242 HydrophobicContact CD1-CE 3.88Å; L209-M242 HydrophobicContact CD1-CG 4.16Å; L209-M242 HydrophobicContact CD2-CE 3.37Å; L209-M242 HydrophobicContact CD2-CG 3.92Å; L209-M242 HydrophobicContact CD2-SD 3.74Å; L209-M242 HydrophobicContact CG-CE 4.23Å; L209-M242 HydrophobicContact CG-CG 4.29Å
210	K	89.5	Confident	86.8	Confident	90 Å²	90	52.8 Å²	52.8	39%	0.391	29%	0.294	S	S	.	.	B	Isolated β-bridge	trans	-78	118.7	174.2	-63.5	179.8	-179.3	179.3	0	110.1	E150 L240 C241 M242	E150-K210 WeakPolarHBondContact OE1-CE 3.1Å; E150-K210 IonicContact OE1-NZ 2.69Å; E150-K210 PolarHBondContact OE1-NZ 2.87Å; K210-L240 PolarHBondContact N-O 3.22Å; K210-C241 HydrophobicContact CB-CB 3.85Å; K210-C241 VanDerWaalsContact O-CA 3.26Å; K210-C241 WeakPolarHBondContact O-CA 3.36Å; K210-C241 WeakPolarHBondContact O-CB 3.47Å; K210-M242 PolarHBondContact O-N 2.83Å
211	L	90.2	Very high	87.3	Confident	53 Å²	53	50.7 Å²	50.7	28%	0.277	29%	0.285	S	S	.	.			trans	-118.3	146	-178.6	-68.6	168.5	0	0	0	110.5	L206 L209 Y215 P217 M242	L206-L211 HydrophobicContact CD2-CD1 4.04Å; L209-L211 HydrophobicContact CD2-CD1 4.22Å; L209-L211 HydrophobicContact CD2-CD2 3.75Å; L209-L211 HydrophobicContact CD2-CG 3.98Å; L209-L211 HydrophobicContact CG-CD2 4.16Å; L209-L211 HydrophobicContact CG-CG 4.12Å; L209-L211 PolarHBondContact O-N 2.79Å; L211-Y215 HydrophobicContact CD2-CD1 3.8Å; L211-Y215 HydrophobicContact CD2-CE1 4.02Å; L211-P217 HydrophobicContact CD1-CG 3.83Å; L211-P217 HydrophobicContact CD2-CG 3.65Å; L211-P217 HydrophobicContact CG-CG 4.42Å; L211-M242 HydrophobicContact CD2-CG 3.29Å; L211-M242 HydrophobicContact CD2-SD 3.82Å
212	P	87.8	Confident	87.7	Confident	57 Å²	57	50 Å²	50	37%	0.37	28%	0.278	S	S	.	.			trans	-58.3	147.7	167.7	-23.6	32.6	0	0	0	112	G214 Y215 M242 T243	P212-G214 PolarHBondContact O-N 2.78Å; P212-Y215 PolarHBondContact O-N 2.84Å; P212-Y215 VanDerWaalsContact O-N 3.08Å; P212-M242 WeakPolarHBondContact CD-O 3.48Å; P212-T243 HydrophobicContact CG-CG2 4.1Å
213	D	85.3	Confident	87.9	Confident	172 Å²	172	49.8 Å²	49.8	92%	0.92	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	128.5	179.5	-66.3	-33.6	0	0	0	111.8	Y215	D213-Y215 VanDerWaalsContact C-N 3.27Å; D213-Y215 PolarHBondContact O-N 2.88Å
214	G	82.9	Confident	88.1	Confident	88 Å²	88	50.9 Å²	50.9	91%	0.907	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	-5.7	178.9	0	0	0	0	0	115.9	P212	P212-G214 PolarHBondContact O-N 2.78Å
215	Y	86.8	Confident	88.2	Confident	25 Å²	25	51 Å²	51	10%	0.098	28%	0.284	C	S	.	.			trans	-85.3	122.4	176	177.1	-122.7	0	0	0	111.7	L211 P212 D213 P217 D221 M242 L244	L211-Y215 HydrophobicContact CD2-CD1 3.8Å; L211-Y215 HydrophobicContact CD2-CE1 4.02Å; P212-Y215 PolarHBondContact O-N 2.84Å; P212-Y215 VanDerWaalsContact O-N 3.08Å; D213-Y215 VanDerWaalsContact C-N 3.27Å; D213-Y215 PolarHBondContact O-N 2.88Å; Y215-P217 HydrophobicContact CE1-CB 4.45Å; Y215-P217 HydrophobicContact CE1-CG 3.98Å; Y215-D221 WeakPolarHBondContact CE2-OD2 3.36Å; Y215-D221 WeakPolarHBondContact OH-CB 3.3Å; Y215-D221 PolarHBondContact OH-OD2 3.47Å; Y215-M242 HydrophobicContact CE1-CG 4.46Å; Y215-M242 HydrophobicContact CE1-SD 4.31Å; Y215-L244 HydrophobicContact CD1-CB 4.5Å; Y215-L244 HydrophobicContact CD2-CB 4.13Å; Y215-L244 HydrophobicContact CD2-CD2 4.05Å; Y215-L244 HydrophobicContact CE1-CB 4.25Å; Y215-L244 HydrophobicContact CE2-CB 3.88Å; Y215-L244 HydrophobicContact CE2-CD1 3.87Å; Y215-L244 HydrophobicContact CE2-CD2 3.84Å; Y215-L244 HydrophobicContact CE2-CG 4.07Å; Y215-L244 HydrophobicContact CG-CB 4.45Å
216	T	85.9	Confident	88.5	Confident	77 Å²	77	52.1 Å²	52.1	47%	0.472	29%	0.291	S	S	.	.			trans	-110.3	119.6	168.2	-59.1	0	0	0	0	109.5
217	P	89.5	Confident	88.9	Confident	3 Å²	3	49.5 Å²	49.5	2%	0.019	28%	0.277	C	S	.	.			trans	-56.7	136.4	178.1	-27.3	35.6	0	0	0	113	I188 L191 F204 L206 L211 Y215 M242	I188-P217 HydrophobicContact CD1-CB 3.61Å; L191-P217 WeakPolarHBondContact CD2-O 3.3Å; F204-P217 HydrophobicContact CE2-CB 4.46Å; L206-P217 HydrophobicContact CD2-CG 3.88Å; L211-P217 HydrophobicContact CD1-CG 3.83Å; L211-P217 HydrophobicContact CD2-CG 3.65Å; L211-P217 HydrophobicContact CG-CG 4.42Å; Y215-P217 HydrophobicContact CE1-CB 4.45Å; Y215-P217 HydrophobicContact CE1-CG 3.98Å; P217-M242 HydrophobicContact CB-SD 4.16Å; P217-M242 HydrophobicContact CG-SD 3.76Å
218	R	84.8	Confident	89.5	Confident	74 Å²	74	44.6 Å²	44.6	28%	0.279	25%	0.251	S	S	.	.			trans	-128.6	149.2	174.2	-61.2	-176.1	-176.8	-175.5	1.5	111.1	I188 G220 D221 E255	I188-R218 WeakPolarHBondContact CB-O 3.35Å; I188-R218 WeakPolarHBondContact CD1-O 3.35Å; R218-G220 PolarHBondContact O-N 3.42Å; R218-D221 PolarHBondContact N-OD2 3.18Å; R218-D221 WeakPolarHBondContact O-CB 3.28Å; R218-D221 PolarHBondContact O-N 2.89Å; R218-E255 IonicContact CZ-OE1 3.78Å; R218-E255 IonicContact NE-OE1 2.86Å; R218-E255 IonicContact NH2-OE1 3.84Å; R218-E255 PolarHBondContact NH2-OE1 3.41Å; R218-E255 IonicContact NH2-OE2 2.63Å
219	R	84.1	Confident	89.9	Confident	133 Å²	133	45.3 Å²	45.3	50%	0.502	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	128.2	174.5	-173.1	178.4	177.9	-166.1	-9.6	110.4	S189 E1163	S189-R219 PolarHBondContact O-NE 3.13Å; R219-E1163 IonicContact CZ-OE1 3.76Å; R219-E1163 IonicContact NH1-OE1 3.73Å; R219-E1163 PolarHBondContact NH1-OE1 3.05Å
220	G	86	Confident	90	Very high	12 Å²	12	44.8 Å²	44.8	12%	0.124	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	92	-6.4	-178.2	0	0	0	0	0	115.4	I188 R218	I188-G220 PolarHBondContact O-N 3.46Å; R218-G220 PolarHBondContact O-N 3.42Å
221	D	92.2	Very high	89.8	Confident	3 Å²	3	43.2 Å²	43.2	2%	0.016	25%	0.25	C	S	.	.			trans	-63.2	141.1	170.6	-74	-14.7	0	0	0	110.2	C187 I188 Y215 R218 V223 L244 R247	C187-D221 CarbonylContact C-O 3.58Å; C187-D221 WeakPolarHBondContact CA-O 3.42Å; I188-D221 HydrophobicContact CD1-CB 4Å; I188-D221 HydrophobicContact CG1-CB 4.19Å; I188-D221 PolarHBondContact N-O 3.48Å; Y215-D221 WeakPolarHBondContact CE2-OD2 3.36Å; Y215-D221 WeakPolarHBondContact OH-CB 3.3Å; Y215-D221 PolarHBondContact OH-OD2 3.47Å; R218-D221 PolarHBondContact N-OD2 3.18Å; R218-D221 WeakPolarHBondContact O-CB 3.28Å; R218-D221 PolarHBondContact O-N 2.89Å; D221-V223 HydrophobicContact CB-CG1 4.28Å; D221-L244 HydrophobicContact CB-CD1 3.84Å; D221-R247 WeakPolarHBondContact OD1-CG 3.17Å
222	V	93.1	Very high	89.6	Confident	38 Å²	38	41.3 Å²	41.3	23%	0.23	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	123.3	170.8	-177.5	0	0	0	0	108	K185 V186 V245 K246	K185-V222 HydrophobicContact CB-CG1 4.1Å; V186-V222 CarbonylContact O-C 3.48Å; V186-V222 WeakPolarHBondContact O-CA 3.49Å; V222-V245 HydrophobicContact CG1-CB 4.39Å; V222-V245 WeakPolarHBondContact O-CA 3.5Å; V222-V245 WeakPolarHBondContact O-CB 3.42Å; V222-V245 PolarHBondContact O-N 3.48Å; V222-K246 HydrophobicContact CB-CB 4.09Å; V222-K246 HydrophobicContact CG2-CB 4.44Å; V222-K246 PolarHBondContact N-O 3.02Å; V222-K246 PolarHBondContact O-N 3.41Å
223	V	94.6	Very high	89.4	Confident	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	156.8	-173.7	-56.3	0	0	0	0	111	K185 V186 I188 L198 D221 M242 T243 L244	K185-V223 CarbonylContact C-O 3.46Å; K185-V223 PolarHBondContact N-O 2.98Å; V186-V223 HydrophobicContact CG2-CG2 3.92Å; V186-V223 WeakPolarHBondContact CG2-O 3.39Å; V186-V223 PolarHBondContact N-O 2.99Å; V186-V223 PolarHBondContact O-N 3.29Å; I188-V223 HydrophobicContact CD1-CG1 4.25Å; I188-V223 HydrophobicContact CG1-CG1 4.34Å; L198-V223 HydrophobicContact CD1-CG2 4.17Å; L198-V223 HydrophobicContact CD2-CG2 3.86Å; D221-V223 HydrophobicContact CB-CG1 4.28Å; V223-M242 HydrophobicContact CB-CB 4.36Å; V223-M242 HydrophobicContact CG1-SD 4.41Å; V223-M242 HydrophobicContact CG2-CB 4.32Å; V223-T243 CarbonylContact C-O 3.48Å; V223-T243 VanDerWaalsContact CA-O 3.24Å; V223-T243 WeakPolarHBondContact CA-O 3.28Å; V223-T243 WeakPolarHBondContact CB-O 3.13Å; V223-L244 HydrophobicContact CG1-CD1 4.46Å
224	N	95.2	Very high	89.3	Confident	31 Å²	31	33 Å²	33	17%	0.166	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97	145.6	158.2	-60	-31.4	0	0	0	107.5	V183 D184 K185 M242 T243 V245	V183-N224 CarbonylContact O-C 3.59Å; V183-N224 WeakPolarHBondContact O-CA 3.34Å; D184-N224 VanDerWaalsContact CA-OD1 3.23Å; D184-N224 WeakPolarHBondContact CA-OD1 3.42Å; K185-N224 PolarHBondContact N-OD1 3.39Å; N224-M242 CarbonylContact O-C 3.58Å; N224-M242 WeakPolarHBondContact O-CA 3.31Å; N224-T243 PolarHBondContact N-O 2.92Å; N224-T243 PolarHBondContact O-N 3.25Å; N224-V245 HydrophobicContact CB-CG2 4.26Å; N224-V245 VanDerWaalsContact ND2-CG2 3.32Å; N224-V245 WeakPolarHBondContact ND2-CG2 3.41Å; N224-V245 VanDerWaalsContact OD1-CG2 3.28Å; N224-V245 WeakPolarHBondContact OD1-CG2 3.47Å
225	A	94.7	Very high	89.6	Confident	3 Å²	3	29.5 Å²	29.5	3%	0.025	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	151.7	178.5	0	0	0	0	0	112.2	V183 L198 V227 A239 C241 M242	V183-A225 HydrophobicContact CG2-CB 3.83Å; V183-A225 WeakPolarHBondContact CG2-O 3.44Å; V183-A225 PolarHBondContact N-O 3.37Å; V183-A225 PolarHBondContact O-N 2.67Å; L198-A225 HydrophobicContact CD1-CB 3.74Å; A225-V227 HydrophobicContact CB-CG1 4.29Å; A225-A239 HydrophobicContact CB-CB 4.39Å; A225-C241 WeakPolarHBondContact CA-O 3.44Å; A225-C241 WeakPolarHBondContact CB-O 3.32Å; A225-M242 HydrophobicContact CB-CB 4.15Å
226	V	94.2	Very high	89.6	Confident	45 Å²	45	32.3 Å²	32.3	27%	0.273	18%	0.175	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	128.1	164.9	-179.8	0	0	0	0	107.5	L240 C241	V226-L240 PolarHBondContact O-N 2.57Å; V226-C241 PolarHBondContact N-O 3.17Å; V226-C241 VanDerWaalsContact N-O 3.14Å
227	V	94.6	Very high	89.9	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	147.2	-173.5	-53.7	0	0	0	0	111.4	Y180 K181 V183 I202 A225 W237 R238 A239	Y180-V227 CarbonylContact C-O 3.55Å; Y180-V227 WeakPolarHBondContact CA-O 3.48Å; Y180-V227 WeakPolarHBondContact CB-O 3.48Å; K181-V227 HydrophobicContact CD-CG2 4.25Å; K181-V227 HydrophobicContact CG-CG2 3.4Å; K181-V227 PolarHBondContact N-O 3.03Å; K181-V227 WeakPolarHBondContact O-CG2 3.46Å; K181-V227 PolarHBondContact O-N 2.73Å; V183-V227 HydrophobicContact CG1-CG2 4.19Å; V183-V227 HydrophobicContact CG2-CG1 3.92Å; I202-V227 HydrophobicContact CD1-CG1 4.12Å; I202-V227 HydrophobicContact CG1-CG1 4.32Å; I202-V227 HydrophobicContact CG2-CB 4.3Å; I202-V227 HydrophobicContact CG2-CG1 3.51Å; A225-V227 HydrophobicContact CB-CG1 4.29Å; V227-W237 HydrophobicContact CB-CE3 4.3Å; V227-W237 HydrophobicContact CG2-CD2 4.25Å; V227-W237 HydrophobicContact CG2-CE3 3.68Å; V227-W237 HydrophobicContact CG2-CZ3 4.31Å; V227-R238 CarbonylContact C-O 3.53Å; V227-R238 WeakPolarHBondContact CA-O 3.26Å; V227-R238 WeakPolarHBondContact CB-O 3.32Å; V227-A239 HydrophobicContact CG1-CB 4.2Å
228	V	94.3	Very high	90.1	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.006	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	150.4	176.4	-69.1	0	0	0	0	111	F149 P177 R179 S230 W237 R238 L240	F149-V228 HydrophobicContact CD2-CG1 4.48Å; F149-V228 HydrophobicContact CE2-CG1 4.18Å; F149-V228 HydrophobicContact CE2-CG2 4.37Å; P177-V228 HydrophobicContact CB-CB 4.38Å; P177-V228 HydrophobicContact CB-CG1 3.77Å; P177-V228 HydrophobicContact CG-CG1 4.35Å; R179-V228 WeakPolarHBondContact O-CA 3.2Å; V228-S230 PolarHBondContact O-N 3.4Å; V228-W237 VanDerWaalsContact C-CE3 3.4Å; V228-W237 CarbonylContact O-C 3.57Å; V228-W237 WeakPolarHBondContact O-CA 3.23Å; V228-R238 HydrophobicContact CG2-CB 4.22Å; V228-R238 PolarHBondContact N-O 3.41Å; V228-R238 PolarHBondContact O-N 3.17Å; V228-L240 HydrophobicContact CG1-CD1 3.49Å; V228-L240 VanDerWaalsContact CG1-CD1 3.49Å; V228-L240 HydrophobicContact CG1-CD2 4.21Å; V228-L240 HydrophobicContact CG1-CG 3.85Å; V228-L240 HydrophobicContact CG2-CD2 3.83Å; V228-L240 HydrophobicContact CG2-CG 4.09Å
229	E	92.9	Very high	90.5	Very high	34 Å²	34	27.7 Å²	27.7	16%	0.159	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	125.1	172.9	-173.6	173.3	-169.2	0	0	109.7	W156 R179 V236 W237	W156-E229 HydrophobicContact CB-CB 4.45Å; W156-E229 HydrophobicContact CB-CG 4.27Å; W156-E229 HydrophobicContact CG-CG 4.37Å; W156-E229 PolarHBondContact N-O 2.82Å; R179-E229 HydrophobicContact CB-CB 4.15Å; R179-E229 WeakPolarHBondContact CD-OE2 3.47Å; R179-E229 WeakPolarHBondContact CG-OE2 3.28Å; R179-E229 IonicContact CZ-OE2 2.7Å; R179-E229 IonicContact NE-OE2 3.96Å; R179-E229 PolarHBondContact NE-OE2 3.47Å; R179-E229 PolarHBondContact O-N 3.24Å; E229-V236 WeakPolarHBondContact CA-O 3.37Å; E229-V236 HydrophobicContact CG-CG1 4.48Å; E229-W237 HydrophobicContact CB-CE3 4.47Å; E229-W237 HydrophobicContact CB-CH2 4.36Å; E229-W237 HydrophobicContact CB-CZ3 4.09Å
230	S	91.4	Very high	90.9	Very high	1 Å²	1	22.6 Å²	22.6	1%	0.007	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.8	140.4	-170.2	-166	0	0	0	0	111.2	G154 D155 V228 Q232 V236	G154-S230 VanDerWaalsContact C-OG 3.31Å; G154-S230 CarbonylContact O-C 3.57Å; G154-S230 WeakPolarHBondContact O-CA 3.27Å; G154-S230 PolarHBondContact O-OG 3.15Å; D155-S230 WeakPolarHBondContact CA-OG 3.12Å; D155-S230 PolarHBondContact N-OG 3.39Å; D155-S230 VanDerWaalsContact OD1-CB 3.28Å; D155-S230 WeakPolarHBondContact OD1-CB 3.3Å; D155-S230 PolarHBondContact OD1-OG 3.12Å; V228-S230 PolarHBondContact O-N 3.4Å; S230-Q232 PolarHBondContact O-N 3.48Å; S230-Q232 PolarHBondContact OG-NE2 2.65Å; S230-V236 PolarHBondContact N-O 3.49Å; S230-V236 CarbonylContact O-C 3.45Å; S230-V236 WeakPolarHBondContact O-CA 3.17Å
231	S	85.8	Confident	91.2	Very high	58 Å²	58	24 Å²	24	41%	0.406	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	90.6	172.9	-170.3	0	0	0	0	110.2	G154 R1120	G154-S231 PolarHBondContact O-N 3.29Å; S231-R1120 PolarHBondContact O-NH1 2.74Å
232	Q	85.4	Confident	91.3	Very high	13 Å²	13	24 Å²	24	6%	0.061	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	80.9	179.4	-59.6	-60.9	-23.7	0	0	110	K153 F203 S230 C234 Y235 R238	K153-Q232 PolarHBondContact O-NE2 2.98Å; F203-Q232 HydrophobicContact CB-CB 3.89Å; F203-Q232 HydrophobicContact CB-CG 4.28Å; F203-Q232 HydrophobicContact CD1-CB 3.72Å; F203-Q232 HydrophobicContact CD1-CG 3.72Å; F203-Q232 HydrophobicContact CE1-CB 4.43Å; F203-Q232 HydrophobicContact CE1-CG 4.45Å; F203-Q232 HydrophobicContact CG-CB 3.83Å; F203-Q232 HydrophobicContact CG-CG 4.26Å; S230-Q232 PolarHBondContact O-N 3.48Å; S230-Q232 PolarHBondContact OG-NE2 2.65Å; Q232-C234 PolarHBondContact O-N 3.38Å; Q232-Y235 PolarHBondContact N-O 3.28Å; Q232-Y235 WeakPolarHBondContact O-CD2 3.47Å; Q232-Y235 PolarHBondContact O-N 3.4Å; Q232-R238 HydrophobicContact CG-CB 4.19Å; Q232-R238 HydrophobicContact CG-CG 4.5Å
233	S	84.3	Confident	91.3	Very high	22 Å²	22	25.3 Å²	25.3	15%	0.154	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-97.9	-175.3	-167.5	0	0	0	0	112.5	S1129 D1155 C1157	S233-S1129 WeakPolarHBondContact O-CB 3.43Å; S233-S1129 PolarHBondContact O-OG 3.08Å; S233-D1155 PolarHBondContact OG-OD1 2.98Å; S233-C1157 PolarHBondContact OG-SG 2.88Å; S233-C1157 VanDerWaalsContact OG-SG 3.34Å
234	C	83.9	Confident	91.2	Very high	32 Å²	32	28.4 Å²	28.4	22%	0.216	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.8	-5.8	173.8	61.1	0	0	0	0	114	Q232 F986	Q232-C234 PolarHBondContact O-N 3.38Å; C234-F986 HydrophobicContact CB-CD1 4.26Å; C234-F986 HydrophobicContact CB-CE1 3.72Å; C234-F986 HydrophobicContact CB-CZ 4.37Å
235	Y	88	Confident	91	Very high	15 Å²	15	30.1 Å²	30.1	6%	0.059	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	141.1	-178.4	-54.1	-71.7	0	0	0	111.4	V197 E200 F203 Q232 P1156	V197-Y235 HydrophobicContact CG1-CD1 4.23Å; V197-Y235 HydrophobicContact CG1-CE1 3.67Å; V197-Y235 HydrophobicContact CG2-CE1 4.14Å; V197-Y235 HydrophobicContact CG2-CE2 3.88Å; E200-Y235 WeakPolarHBondContact O-CE1 3.47Å; F203-Y235 HydrophobicContact CB-CD2 3.83Å; F203-Y235 HydrophobicContact CB-CG 3.97Å; F203-Y235 AromaticContact CD2-CD2 3.87Å; F203-Y235 HydrophobicContact CD2-CD2 3.87Å; F203-Y235 HydrophobicContact CD2-CE2 4.16Å; F203-Y235 HydrophobicContact CG-CD2 4.22Å; Q232-Y235 PolarHBondContact N-O 3.28Å; Q232-Y235 WeakPolarHBondContact O-CD2 3.47Å; Q232-Y235 PolarHBondContact O-N 3.4Å; Y235-P1156 HydrophobicContact CD2-CB 4.45Å; Y235-P1156 HydrophobicContact CE2-CB 3.94Å
236	V	87.1	Confident	90.6	Very high	84 Å²	84	36.7 Å²	36.7	51%	0.509	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	-9.2	-178	-169.9	0	0	0	0	112.1	E229 S230	E229-V236 WeakPolarHBondContact CA-O 3.37Å; E229-V236 HydrophobicContact CG-CG1 4.48Å; S230-V236 PolarHBondContact N-O 3.49Å; S230-V236 CarbonylContact O-C 3.45Å; S230-V236 WeakPolarHBondContact O-CA 3.17Å
237	W	92	Very high	90.1	Very high	53 Å²	53	39.9 Å²	39.9	20%	0.201	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	139.3	179.8	-65.8	97.8	0	0	0	110.8	R179 K181 I202 F203 V227 V228 E229	R179-W237 HydrophobicContact CB-CH2 4.32Å; K181-W237 HydrophobicContact CD-CH2 4.11Å; K181-W237 HydrophobicContact CD-CZ2 4.2Å; K181-W237 HydrophobicContact CD-CZ3 4.33Å; K181-W237 HydrophobicContact CG-CE3 4.42Å; K181-W237 HydrophobicContact CG-CH2 4.27Å; K181-W237 HydrophobicContact CG-CZ3 4.06Å; I202-W237 HydrophobicContact CB-CB 4.34Å; I202-W237 HydrophobicContact CG1-CB 3.86Å; I202-W237 HydrophobicContact CG2-CB 4.36Å; F203-W237 PolarHBondContact N-O 2.93Å; V227-W237 HydrophobicContact CB-CE3 4.3Å; V227-W237 HydrophobicContact CG2-CD2 4.25Å; V227-W237 HydrophobicContact CG2-CE3 3.68Å; V227-W237 HydrophobicContact CG2-CZ3 4.31Å; V228-W237 VanDerWaalsContact C-CE3 3.4Å; V228-W237 CarbonylContact O-C 3.57Å; V228-W237 WeakPolarHBondContact O-CA 3.23Å; E229-W237 HydrophobicContact CB-CE3 4.47Å; E229-W237 HydrophobicContact CB-CH2 4.36Å; E229-W237 HydrophobicContact CB-CZ3 4.09Å
238	R	93.9	Very high	89	Confident	3 Å²	3	48 Å²	48	1%	0.011	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	134	172.2	-176.1	-179.5	71.7	88.8	-7.4	110.7	E150 C152 D155 F203 S208 V227 V228 Q232	E150-R238 PolarHBondContact O-NH2 3.33Å; C152-R238 VanDerWaalsContact SG-CZ 3.52Å; D155-R238 IonicContact OD1-CZ 2.8Å; D155-R238 IonicContact OD1-NE 3.31Å; D155-R238 PolarHBondContact OD1-NE 2.63Å; D155-R238 IonicContact OD1-NH2 2.79Å; D155-R238 IonicContact OD2-CZ 3.85Å; D155-R238 IonicContact OD2-NE 3.8Å; D155-R238 PolarHBondContact OD2-NE 2.99Å; D155-R238 IonicContact OD2-NH2 3.16Å; D155-R238 PolarHBondContact OD2-NH2 3.42Å; F203-R238 CarbonylContact O-C 3.49Å; F203-R238 VanDerWaalsContact O-CA 3.23Å; F203-R238 WeakPolarHBondContact O-CA 3.2Å; S208-R238 PolarHBondContact OG-NH1 3.05Å; V227-R238 CarbonylContact C-O 3.53Å; V227-R238 WeakPolarHBondContact CA-O 3.26Å; V227-R238 WeakPolarHBondContact CB-O 3.32Å; V228-R238 HydrophobicContact CG2-CB 4.22Å; V228-R238 PolarHBondContact N-O 3.41Å; V228-R238 PolarHBondContact O-N 3.17Å; Q232-R238 HydrophobicContact CG-CB 4.19Å; Q232-R238 HydrophobicContact CG-CG 4.5Å
239	A	94	Very high	87.1	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	132.4	172.9	0	0	0	0	0	111.7	L198 I202 F203 F204 L209 A225 V227	L198-A239 HydrophobicContact CD1-CB 4.27Å; I202-A239 HydrophobicContact CG2-CB 4.05Å; F203-A239 PolarHBondContact O-N 3.45Å; F204-A239 HydrophobicContact CB-CB 3.94Å; L209-A239 HydrophobicContact CD1-CB 4.01Å; A225-A239 HydrophobicContact CB-CB 4.39Å; V227-A239 HydrophobicContact CG1-CB 4.2Å
240	L	92.1	Very high	84.9	Confident	26 Å²	26	57.3 Å²	57.3	14%	0.136	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	-42.5	174.5	-65	-176.6	0	0	0	112	F149 K210 V226 V228	F149-L240 HydrophobicContact CD2-CD1 3.97Å; F149-L240 HydrophobicContact CD2-CD2 4.02Å; F149-L240 HydrophobicContact CE2-CD2 4.06Å; K210-L240 PolarHBondContact N-O 3.22Å; V226-L240 PolarHBondContact O-N 2.57Å; V228-L240 HydrophobicContact CG1-CD1 3.49Å; V228-L240 VanDerWaalsContact CG1-CD1 3.49Å; V228-L240 HydrophobicContact CG1-CD2 4.21Å; V228-L240 HydrophobicContact CG1-CG 3.85Å; V228-L240 HydrophobicContact CG2-CD2 3.83Å; V228-L240 HydrophobicContact CG2-CG 4.09Å
241	C	92.7	Very high	82.3	Confident	42 Å²	42	61 Å²	61	28%	0.284	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	154.2	177.8	67.6	0	0	0	0	109.7	K210 A225 V226	K210-C241 HydrophobicContact CB-CB 3.85Å; K210-C241 VanDerWaalsContact O-CA 3.26Å; K210-C241 WeakPolarHBondContact O-CA 3.36Å; K210-C241 WeakPolarHBondContact O-CB 3.47Å; A225-C241 WeakPolarHBondContact CA-O 3.44Å; A225-C241 WeakPolarHBondContact CB-O 3.32Å; V226-C241 PolarHBondContact N-O 3.17Å; V226-C241 VanDerWaalsContact N-O 3.14Å
242	M	93.5	Very high	79.9	Confident	2 Å²	2	64.5 Å²	64.5	1%	0.01	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	148.4	173	67.5	174.9	58.9	0	0	111.9	I188 L198 F204 L209 K210 L211 P212 Y215 P217 V223 N224 A225	I188-M242 HydrophobicContact CD1-SD 4.34Å; L198-M242 HydrophobicContact CD1-CE 4.3Å; L198-M242 HydrophobicContact CD2-CE 4.01Å; F204-M242 HydrophobicContact CB-CE 4.25Å; F204-M242 HydrophobicContact CD1-CE 3.76Å; F204-M242 HydrophobicContact CD2-CE 3.93Å; F204-M242 HydrophobicContact CE1-CE 3.97Å; F204-M242 HydrophobicContact CE2-CE 4.14Å; F204-M242 HydrophobicContact CG-CE 3.72Å; F204-M242 HydrophobicContact CZ-CE 4.14Å; L209-M242 HydrophobicContact CD1-CB 4.47Å; L209-M242 HydrophobicContact CD1-CE 3.88Å; L209-M242 HydrophobicContact CD1-CG 4.16Å; L209-M242 HydrophobicContact CD2-CE 3.37Å; L209-M242 HydrophobicContact CD2-CG 3.92Å; L209-M242 HydrophobicContact CD2-SD 3.74Å; L209-M242 HydrophobicContact CG-CE 4.23Å; L209-M242 HydrophobicContact CG-CG 4.29Å; K210-M242 PolarHBondContact O-N 2.83Å; L211-M242 HydrophobicContact CD2-CG 3.29Å; L211-M242 HydrophobicContact CD2-SD 3.82Å; P212-M242 WeakPolarHBondContact CD-O 3.48Å; Y215-M242 HydrophobicContact CE1-CG 4.46Å; Y215-M242 HydrophobicContact CE1-SD 4.31Å; P217-M242 HydrophobicContact CB-SD 4.16Å; P217-M242 HydrophobicContact CG-SD 3.76Å; V223-M242 HydrophobicContact CB-CB 4.36Å; V223-M242 HydrophobicContact CG1-SD 4.41Å; V223-M242 HydrophobicContact CG2-CB 4.32Å; N224-M242 CarbonylContact O-C 3.58Å; N224-M242 WeakPolarHBondContact O-CA 3.31Å; A225-M242 HydrophobicContact CB-CB 4.15Å
243	T	92.9	Very high	77.6	Confident	67 Å²	67	69.3 Å²	69.3	41%	0.411	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	131.4	177	58.2	0	0	0	0	109.8	P212 V223 N224 V245	P212-T243 HydrophobicContact CG-CG2 4.1Å; V223-T243 CarbonylContact C-O 3.48Å; V223-T243 VanDerWaalsContact CA-O 3.24Å; V223-T243 WeakPolarHBondContact CA-O 3.28Å; V223-T243 WeakPolarHBondContact CB-O 3.13Å; N224-T243 PolarHBondContact N-O 2.92Å; N224-T243 PolarHBondContact O-N 3.25Å; T243-V245 PolarHBondContact O-N 3.19Å
244	L	92.9	Very high	75.1	Confident	64 Å²	64	77.2 Å²	77.2	34%	0.335	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	130.6	177.4	-176.3	67	0	0	0	111.3	Y215 D221 V223 R247	Y215-L244 HydrophobicContact CD1-CB 4.5Å; Y215-L244 HydrophobicContact CD2-CB 4.13Å; Y215-L244 HydrophobicContact CD2-CD2 4.05Å; Y215-L244 HydrophobicContact CE1-CB 4.25Å; Y215-L244 HydrophobicContact CE2-CB 3.88Å; Y215-L244 HydrophobicContact CE2-CD1 3.87Å; Y215-L244 HydrophobicContact CE2-CD2 3.84Å; Y215-L244 HydrophobicContact CE2-CG 4.07Å; Y215-L244 HydrophobicContact CG-CB 4.45Å; D221-L244 HydrophobicContact CB-CD1 3.84Å; V223-L244 HydrophobicContact CG1-CD1 4.46Å; L244-R247 HydrophobicContact CD2-CB 4.29Å; L244-R247 HydrophobicContact CD2-CG 4.33Å
245	V	90.2	Very high	72.5	Confident	68 Å²	68	82 Å²	82	41%	0.412	44%	0.437	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	-46.9	173.6	-180	0	0	0	0	110.6	V222 N224 T243	V222-V245 HydrophobicContact CG1-CB 4.39Å; V222-V245 WeakPolarHBondContact O-CA 3.5Å; V222-V245 WeakPolarHBondContact O-CB 3.42Å; V222-V245 PolarHBondContact O-N 3.48Å; N224-V245 HydrophobicContact CB-CG2 4.26Å; N224-V245 VanDerWaalsContact ND2-CG2 3.32Å; N224-V245 WeakPolarHBondContact ND2-CG2 3.41Å; N224-V245 VanDerWaalsContact OD1-CG2 3.28Å; N224-V245 WeakPolarHBondContact OD1-CG2 3.47Å; T243-V245 PolarHBondContact O-N 3.19Å
246	K	87.1	Confident	70	Confident	140 Å²	140	84 Å²	84	61%	0.609	46%	0.456	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-145.5	123.8	179.4	-177.7	178.8	179.3	179.6	0	109.6	V222	V222-K246 HydrophobicContact CB-CB 4.09Å; V222-K246 HydrophobicContact CG2-CB 4.44Å; V222-K246 PolarHBondContact N-O 3.02Å; V222-K246 PolarHBondContact O-N 3.41Å
247	R	82.5	Confident	67.8	Low	113 Å²	113	84.9 Å²	84.9	43%	0.426	46%	0.462	S	S	.	.			trans	-77.9	141	171.1	-142.5	169.2	-163.8	174.6	2	109	D221 L244 D249	D221-R247 WeakPolarHBondContact OD1-CG 3.17Å; L244-R247 HydrophobicContact CD2-CB 4.29Å; L244-R247 HydrophobicContact CD2-CG 4.33Å; R247-D249 PolarHBondContact O-N 3.39Å
248	R	72.8	Confident	65.1	Low	169 Å²	169	89 Å²	89	64%	0.638	48%	0.483	S	S	*	.			trans	-70.4	126.7	166.5	-171.6	174.2	-175.3	172.2	2.5	107.9	A250	R248-A250 PolarHBondContact O-N 2.83Å
249	D	52.9	Low	62.4	Low	159 Å²	159	97 Å²	97	85%	0.85	52%	0.518	S	S	*	.			trans	-59.7	112.7	169.7	-63.4	-42.7	0	0	0	107.7	R247	R247-D249 PolarHBondContact O-N 3.39Å
250	A	47.6	Very low	59.9	Low	72 Å²	72	104.3 Å²	104.3	60%	0.595	55%	0.547	S	S	*	.			trans	-121.4	139.1	-176	0	0	0	0	0	110.2	R248	R248-A250 PolarHBondContact O-N 2.83Å
251	A	36.1	Very low	58	Low	80 Å²	80	104.3 Å²	104.3	66%	0.661	55%	0.554	S	S	*	*			trans	-55.1	151.1	159.8	0	0	0	0	0	110.3	V253	A251-V253 PolarHBondContact O-N 2.88Å
252	P	35.4	Very low	56.3	Low	131 Å²	131	106.8 Å²	106.8	85%	0.851	57%	0.568	S	S	*	*			trans	-64.4	112.8	-170.9	25.3	-32.3	0	0	0	110.4
253	V	37.3	Very low	55.2	Low	114 Å²	114	110.3 Å²	110.3	69%	0.691	59%	0.585	S	S	*	*			trans	-102.3	122.3	165.4	179.1	0	0	0	0	106.7	A251 E255	A251-V253 PolarHBondContact O-N 2.88Å; V253-E255 PolarHBondContact O-N 3.25Å; V253-E255 VanDerWaalsContact O-N 3.11Å
254	H	33.2	Very low	54.6	Low	187 Å²	187	108.9 Å²	108.9	87%	0.866	58%	0.575	S	S	*	*			trans	-55.6	111.5	177.3	-75.8	-85.9	0	0	0	110.8
255	E	28.9	Very low	54	Low	134 Å²	134	108.2 Å²	108.2	63%	0.626	57%	0.572	S	S	*	*			trans	-70.9	131	163.1	-79.6	178.3	154.2	0	0	109.3	R218 V253	R218-E255 IonicContact CZ-OE1 3.78Å; R218-E255 IonicContact NE-OE1 2.86Å; R218-E255 IonicContact NH2-OE1 3.84Å; R218-E255 PolarHBondContact NH2-OE1 3.41Å; R218-E255 IonicContact NH2-OE2 2.63Å; V253-E255 PolarHBondContact O-N 3.25Å; V253-E255 VanDerWaalsContact O-N 3.11Å
256	A	34.3	Very low	53.7	Low	55 Å²	55	111 Å²	111	46%	0.455	58%	0.579	S	S	.	*			trans	126.3	95	152.2	0	0	0	0	0	113.8	Y260	A256-Y260 HydrophobicContact CB-CD2 3.78Å; A256-Y260 HydrophobicContact CB-CE2 3.62Å; A256-Y260 VanDerWaalsContact O-CD2 3.3Å; A256-Y260 WeakPolarHBondContact O-CD2 3.34Å
257	T	40.9	Very low	53.8	Low	103 Å²	103	107.2 Å²	107.2	63%	0.632	57%	0.565	S	S	*	*	S	Bend	trans	-116.3	-12.5	163.5	-14	0	0	0	0	113
258	H	36.5	Very low	54	Low	141 Å²	141	104.3 Å²	104.3	65%	0.653	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-25.7	-174.4	-125	-70.8	0	0	0	114.7
259	F	36.7	Very low	54.5	Low	169 Å²	169	97.8 Å²	97.8	74%	0.741	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	-29	178.1	-119.2	-93.5	0	0	0	113.2	I263	F259-I263 HydrophobicContact CD1-CD1 4.21Å
260	Y	41.7	Very low	56.1	Low	154 Å²	154	95.5 Å²	95.5	60%	0.604	53%	0.528	S	S	*	.	H	α-helix	trans	-71.2	-31	-178.3	-78.1	-79.7	0	0	0	113.3	A256 T262 I263 L264	A256-Y260 HydrophobicContact CB-CD2 3.78Å; A256-Y260 HydrophobicContact CB-CE2 3.62Å; A256-Y260 VanDerWaalsContact O-CD2 3.3Å; A256-Y260 WeakPolarHBondContact O-CD2 3.34Å; Y260-T262 PolarHBondContact O-N 3.32Å; Y260-I263 PolarHBondContact O-N 3.38Å; Y260-L264 WeakPolarHBondContact O-CB 3.08Å; Y260-L264 PolarHBondContact O-N 3.24Å
261	G	51.7	Low	58	Low	27 Å²	27	92.1 Å²	92.1	28%	0.278	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-48.8	-177.2	0	0	0	0	0	113.8	I263 L264 L265	G261-I263 VanDerWaalsContact C-N 3.32Å; G261-I263 PolarHBondContact O-N 2.7Å; G261-L264 PolarHBondContact O-N 2.93Å; G261-L265 VanDerWaalsContact O-CG 3.3Å; G261-L265 WeakPolarHBondContact O-CG 3.39Å; G261-L265 PolarHBondContact O-N 2.72Å; G261-L265 VanDerWaalsContact O-N 3.15Å
262	T	57	Low	60.5	Low	94 Å²	94	92.3 Å²	92.3	58%	0.577	49%	0.488	S	S	*	.	H	α-helix	trans	-69.5	-32.6	-179.6	-31.8	0	0	0	0	112	Y260 K266	Y260-T262 PolarHBondContact O-N 3.32Å; T262-K266 VanDerWaalsContact O-CG 3.3Å; T262-K266 WeakPolarHBondContact O-CG 3.44Å
263	I	71.5	Confident	63	Low	75 Å²	75	86.1 Å²	86.1	39%	0.385	45%	0.447	S	S	.	.	H	α-helix	trans	-74.1	-41.4	176.4	-64.5	171.8	0	0	0	110.1	F259 Y260 G261 L265 K266 K268	F259-I263 HydrophobicContact CD1-CD1 4.21Å; Y260-I263 PolarHBondContact O-N 3.38Å; G261-I263 VanDerWaalsContact C-N 3.32Å; G261-I263 PolarHBondContact O-N 2.7Å; I263-L265 VanDerWaalsContact C-N 3.33Å; I263-L265 PolarHBondContact O-N 3.25Å; I263-K266 PolarHBondContact O-N 3.16Å; I263-K268 WeakPolarHBondContact O-CE 2.95Å; I263-K268 PolarHBondContact O-NZ 3.14Å
264	L	78.6	Confident	65.2	Low	38 Å²	38	82.5 Å²	82.5	20%	0.199	43%	0.426	C	S	.	.	H	α-helix	trans	-60.8	-40.3	179.8	-178.1	66	0	0	0	111.6	Y260 G261 K266 L428 L430 L437 I438 G439	Y260-L264 WeakPolarHBondContact O-CB 3.08Å; Y260-L264 PolarHBondContact O-N 3.24Å; G261-L264 PolarHBondContact O-N 2.93Å; L264-K266 VanDerWaalsContact C-N 3.32Å; L264-K266 PolarHBondContact O-N 3.05Å; L264-L428 HydrophobicContact CD2-CD2 4.11Å; L264-L430 HydrophobicContact CD1-CD2 4.25Å; L264-L430 HydrophobicContact CD2-CD2 4.06Å; L264-L437 HydrophobicContact CD1-CB 3.83Å; L264-I438 CarbonylContact O-C 3.57Å; L264-G439 PolarHBondContact O-N 2.87Å
265	L	81.5	Confident	67.1	Low	50 Å²	50	79.8 Å²	79.8	26%	0.262	41%	0.413	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-9.6	-178.8	-61.8	170.1	0	0	0	114	G261 I263 L428 G439 R440 Y441	G261-L265 VanDerWaalsContact O-CG 3.3Å; G261-L265 WeakPolarHBondContact O-CG 3.39Å; G261-L265 PolarHBondContact O-N 2.72Å; G261-L265 VanDerWaalsContact O-N 3.15Å; I263-L265 VanDerWaalsContact C-N 3.33Å; I263-L265 PolarHBondContact O-N 3.25Å; L265-L428 HydrophobicContact CD2-CD1 4.34Å; L265-G439 WeakPolarHBondContact CD2-O 3.36Å; L265-R440 PolarHBondContact O-NH1 2.92Å; L265-Y441 HydrophobicContact CD1-CD2 4.14Å; L265-Y441 HydrophobicContact CD1-CE2 3.35Å; L265-Y441 HydrophobicContact CD2-CD2 4.1Å; L265-Y441 HydrophobicContact CD2-CE1 4.5Å; L265-Y441 HydrophobicContact CD2-CE2 3.94Å; L265-Y441 HydrophobicContact CD2-CG 4.47Å; L265-Y441 HydrophobicContact CG-CE2 4.28Å
266	K	84.7	Confident	69.1	Low	127 Å²	127	78.3 Å²	78.3	55%	0.552	41%	0.413	S	S	*	.	S	Bend	trans	-77.3	146.3	176.2	-78.6	173.5	-177.9	-171.4	0	110.6	T262 I263 L264	T262-K266 VanDerWaalsContact O-CG 3.3Å; T262-K266 WeakPolarHBondContact O-CG 3.44Å; I263-K266 PolarHBondContact O-N 3.16Å; L264-K266 VanDerWaalsContact C-N 3.32Å; L264-K266 PolarHBondContact O-N 3.05Å
267	N	87.4	Confident	71.3	Confident	60 Å²	60	76.7 Å²	76.7	32%	0.321	40%	0.398	S	S	.	.			trans	-57	139.2	161.7	-71.3	-12.6	0	0	0	108.9	I271 V273 R440	N267-I271 WeakPolarHBondContact CB-O 3.49Å; N267-I271 VanDerWaalsContact CG-O 3.26Å; N267-I271 PolarHBondContact OD1-O 3.14Å; N267-V273 PolarHBondContact OD1-N 3.14Å; N267-R440 PolarHBondContact OD1-NH2 2.93Å
268	K	88	Confident	73.3	Confident	52 Å²	52	75.8 Å²	75.8	23%	0.226	39%	0.386	C	S	.	.	B	Isolated β-bridge	trans	-138.7	153	-178.5	-68	178.3	-168.3	163.9	0	109.8	I263 D270 I271 F436 L437 I438	I263-K268 WeakPolarHBondContact O-CE 2.95Å; I263-K268 PolarHBondContact O-NZ 3.14Å; K268-D270 PolarHBondContact O-N 3.07Å; K268-I271 WeakPolarHBondContact O-CB 3.2Å; K268-I271 PolarHBondContact O-N 3.41Å; K268-F436 HydrophobicContact CB-CB 4.47Å; K268-F436 HydrophobicContact CB-CD2 3.59Å; K268-F436 HydrophobicContact CB-CE2 3.9Å; K268-F436 HydrophobicContact CB-CG 3.97Å; K268-F436 HydrophobicContact CD-CB 4.01Å; K268-F436 HydrophobicContact CD-CD2 4.25Å; K268-F436 HydrophobicContact CD-CG 4.37Å; K268-F436 WeakPolarHBondContact O-CE2 3.47Å; K268-F436 WeakPolarHBondContact O-CZ 3.36Å; K268-L437 PolarHBondContact NZ-O 3.17Å; K268-I438 HydrophobicContact CB-CD1 4.36Å; K268-I438 HydrophobicContact CB-CG1 4.2Å
269	G	82.6	Confident	75.7	Confident	32 Å²	32	69.1 Å²	69.1	33%	0.33	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	35.8	178.5	0	0	0	0	0	113.1	I271 Q302	G269-I271 PolarHBondContact O-N 3.1Å; G269-I271 VanDerWaalsContact O-N 3.08Å; G269-Q302 PolarHBondContact O-NE2 3.41Å
270	D	85.9	Confident	78	Confident	110 Å²	110	62 Å²	62	59%	0.588	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	19.3	-175.5	-52.6	-45.6	0	0	0	115	K268 K297 G298	K268-D270 PolarHBondContact O-N 3.07Å; D270-K297 HydrophobicContact CB-CB 4.41Å; D270-K297 WeakPolarHBondContact O-CA 3.41Å; D270-K297 VanDerWaalsContact O-CB 3.32Å; D270-K297 WeakPolarHBondContact O-CB 3.44Å; D270-K297 PolarHBondContact O-N 2.79Å; D270-G298 VanDerWaalsContact CB-CA 3.41Å; D270-G298 VanDerWaalsContact CB-N 3.27Å
271	I	89	Confident	80	Confident	1 Å²	1	59.1 Å²	59.1	1%	0.005	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	118	172.1	-63.3	-73.1	0	0	0	109.7	N267 K268 G269 V273 I294 E295 N296 Q302 F433 F436 I438	N267-I271 WeakPolarHBondContact CB-O 3.49Å; N267-I271 VanDerWaalsContact CG-O 3.26Å; N267-I271 PolarHBondContact OD1-O 3.14Å; K268-I271 WeakPolarHBondContact O-CB 3.2Å; K268-I271 PolarHBondContact O-N 3.41Å; G269-I271 PolarHBondContact O-N 3.1Å; G269-I271 VanDerWaalsContact O-N 3.08Å; I271-V273 HydrophobicContact CG2-CG2 3.96Å; I271-I294 HydrophobicContact CG2-CG2 3.56Å; I271-E295 CarbonylContact C-O 3.54Å; I271-E295 WeakPolarHBondContact CA-O 3.38Å; I271-N296 HydrophobicContact CD1-CB 3.56Å; I271-Q302 HydrophobicContact CD1-CB 3.65Å; I271-Q302 HydrophobicContact CD1-CG 3.76Å; I271-Q302 HydrophobicContact CG1-CB 4.02Å; I271-Q302 HydrophobicContact CG1-CG 3.81Å; I271-F433 HydrophobicContact CB-CZ 4.39Å; I271-F433 HydrophobicContact CD1-CE1 4.06Å; I271-F433 HydrophobicContact CD1-CZ 4.41Å; I271-F433 HydrophobicContact CG1-CE1 4.04Å; I271-F433 HydrophobicContact CG1-CZ 4.16Å; I271-F433 HydrophobicContact CG2-CE1 4.35Å; I271-F433 HydrophobicContact CG2-CE2 4.2Å; I271-F433 HydrophobicContact CG2-CZ 3.69Å; I271-F436 HydrophobicContact CG1-CE2 4.39Å; I271-F436 HydrophobicContact CG1-CZ 4.02Å; I271-I438 HydrophobicContact CB-CD1 3.83Å; I271-I438 HydrophobicContact CG2-CD1 3.8Å
272	E	88.4	Confident	81.7	Confident	85 Å²	85	58.4 Å²	58.4	40%	0.397	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	120.1	173.1	-174.5	169.6	-165	0	0	110.7	E295 K297	E272-E295 PolarHBondContact N-O 2.91Å; E272-E295 PolarHBondContact O-N 2.81Å; E272-K297 HydrophobicContact CB-CG 4.23Å; E272-K297 WeakPolarHBondContact OE2-CE 3.38Å
273	V	87	Confident	83	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	136	176.4	-174.8	0	0	0	0	109.6	N267 I271 Q275 I292 W293 I294 L431 I438 R440	N267-V273 PolarHBondContact OD1-N 3.14Å; I271-V273 HydrophobicContact CG2-CG2 3.96Å; V273-Q275 PolarHBondContact O-N 2.74Å; V273-I292 HydrophobicContact CG1-CG2 3.66Å; V273-W293 WeakPolarHBondContact CA-O 3.48Å; V273-I294 HydrophobicContact CG1-CG1 4.32Å; V273-I294 HydrophobicContact CG2-CG1 4.27Å; V273-I294 HydrophobicContact CG2-CG2 4.38Å; V273-L431 HydrophobicContact CB-CD1 4.33Å; V273-L431 HydrophobicContact CG1-CD1 3.8Å; V273-L431 HydrophobicContact CG2-CD1 3.63Å; V273-I438 HydrophobicContact CG2-CD1 4.33Å; V273-I438 HydrophobicContact CG2-CG2 4.02Å; V273-R440 HydrophobicContact CB-CG 4.45Å; V273-R440 HydrophobicContact CG1-CG 3.8Å; V273-R440 PolarHBondContact O-NH2 3.35Å
274	T	84	Confident	83.6	Confident	39 Å²	39	60.4 Å²	60.4	24%	0.239	32%	0.317	C	S	.	.			trans	-41.5	131	179.5	-55.9	0	0	0	0	112	V276 W293 R440	T274-V276 HydrophobicContact CG2-CB 4.41Å; T274-W293 PolarHBondContact N-O 2.9Å; T274-W293 WeakPolarHBondContact OG1-CA 3.43Å; T274-W293 VanDerWaalsContact OG1-CB 3.3Å; T274-W293 WeakPolarHBondContact OG1-CB 3.21Å; T274-W293 PolarHBondContact OG1-N 3.09Å; T274-W293 PolarHBondContact OG1-O 2.98Å; T274-R440 PolarHBondContact O-NE 3.34Å
275	Q	73.6	Confident	83.8	Confident	129 Å²	129	62 Å²	62	60%	0.603	34%	0.342	S	S	*	.	S	Bend	trans	-81.7	-29	-178.5	-62.1	-62.7	-22.4	0	0	112.9	V273 T277	V273-Q275 PolarHBondContact O-N 2.74Å; Q275-T277 PolarHBondContact O-N 3.3Å
276	V	70.9	Confident	84.2	Confident	103 Å²	103	67.8 Å²	67.8	62%	0.624	36%	0.36	S	S	*	.			trans	-79	105	179.2	-175.6	0	0	0	0	109.3	T274	T274-V276 HydrophobicContact CG2-CB 4.41Å
277	T	79.4	Confident	84.5	Confident	22 Å²	22	65.2 Å²	65.2	14%	0.135	36%	0.359	C	S	.	.			trans	-126.4	21.4	-179	56.1	0	0	0	0	112.6	Q275 R440 Y441 L442 E443	Q275-T277 PolarHBondContact O-N 3.3Å; T277-R440 HydrophobicContact CG2-CB 4.24Å; T277-Y441 WeakPolarHBondContact CB-O 3.28Å; T277-Y441 PolarHBondContact OG1-O 3.32Å; T277-L442 WeakPolarHBondContact O-CA 3.24Å; T277-E443 PolarHBondContact O-N 2.99Å
278	H	84.2	Confident	84.7	Confident	84 Å²	84	66.8 Å²	66.8	39%	0.389	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	113.4	-177.6	-157.6	81.4	0	0	0	110.8	G280 M290 E443	H278-G280 PolarHBondContact CD2-N 3.26Å; H278-G280 VanDerWaalsContact CD2-N 3.32Å; H278-G280 PolarHBondContact O-N 3.17Å; H278-M290 VanDerWaalsContact C-CE 3.44Å; H278-M290 VanDerWaalsContact O-CE 3.25Å; H278-M290 WeakPolarHBondContact O-CE 3.21Å; H278-E443 CarbonylContact C-O 3.54Å; H278-E443 WeakPolarHBondContact CA-O 3.29Å; H278-E443 IonicContact CE1-OE2 2.74Å; H278-E443 WeakPolarHBondContact ND1-CB 3.33Å; H278-E443 IonicContact ND1-OE2 3.98Å; H278-E443 PolarHBondContact ND1-OE2 3.3Å
279	F	85.7	Confident	84.8	Confident	0 Å²	0	67.8 Å²	67.8	0%	0	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	-13.5	177.6	-75.2	-98.8	0	0	0	112.5	K288 M290 F318 V415 C417 E443 V444	F279-K288 HydrophobicContact CB-CD 4.44Å; F279-K288 HydrophobicContact CD1-CB 4.03Å; F279-K288 HydrophobicContact CD1-CD 4.32Å; F279-K288 HydrophobicContact CD1-CG 4.03Å; F279-K288 VanDerWaalsContact CE1-O 3.26Å; F279-K288 WeakPolarHBondContact CE1-O 3.35Å; F279-K288 VanDerWaalsContact O-CD 3.3Å; F279-K288 WeakPolarHBondContact O-CD 3.33Å; F279-K288 WeakPolarHBondContact O-CE 3.49Å; F279-K288 PolarHBondContact O-NZ 2.99Å; F279-M290 HydrophobicContact CD1-CB 4.15Å; F279-M290 HydrophobicContact CD1-CE 4.48Å; F279-M290 HydrophobicContact CD2-CE 4.21Å; F279-M290 HydrophobicContact CE1-CB 3.47Å; F279-M290 VanDerWaalsContact CE1-CB 3.47Å; F279-M290 HydrophobicContact CE2-CB 4.19Å; F279-M290 HydrophobicContact CE2-CE 4.5Å; F279-M290 HydrophobicContact CE2-SD 4.3Å; F279-M290 HydrophobicContact CG-CE 4.2Å; F279-M290 HydrophobicContact CZ-CB 3.5Å; F279-M290 VanDerWaalsContact CZ-CB 3.5Å; F279-F318 AromaticContact CD2-CE1 3.93Å; F279-F318 HydrophobicContact CD2-CE1 3.93Å; F279-F318 HydrophobicContact CE2-CD1 4.06Å; F279-F318 AromaticContact CE2-CE1 3.76Å; F279-F318 HydrophobicContact CE2-CE1 3.76Å; F279-V415 HydrophobicContact CZ-CB 4.19Å; F279-V415 HydrophobicContact CZ-CG1 4.06Å; F279-C417 HydrophobicContact CD1-CB 3.7Å; F279-C417 HydrophobicContact CD2-CB 4.25Å; F279-C417 HydrophobicContact CE1-CB 3.65Å; F279-C417 HydrophobicContact CE2-CB 4.21Å; F279-C417 HydrophobicContact CG-CB 4.01Å; F279-C417 HydrophobicContact CZ-CB 3.91Å; F279-E443 PolarHBondContact N-O 3.3Å; F279-V444 HydrophobicContact CB-CB 4.03Å; F279-V444 HydrophobicContact CB-CG2 3.89Å
280	G	85.3	Confident	85.1	Confident	21 Å²	21	67.4 Å²	67.4	22%	0.216	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	74.7	-149.6	-175.7	0	0	0	0	0	111.6	H278 N445	H278-G280 PolarHBondContact CD2-N 3.26Å; H278-G280 VanDerWaalsContact CD2-N 3.32Å; H278-G280 PolarHBondContact O-N 3.17Å; G280-N445 PolarHBondContact O-N 2.81Å
281	T	83.4	Confident	85.2	Confident	92 Å²	92	65.1 Å²	65.1	56%	0.564	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.2	127.1	-179.1	-60.9	0	0	0	0	111.2	N445 I447	T281-N445 CarbonylContact C-O 3.57Å; T281-N445 VanDerWaalsContact CA-O 3.3Å; T281-N445 WeakPolarHBondContact CA-O 3.48Å; T281-I447 HydrophobicContact CG2-CD1 3.25Å; T281-I447 HydrophobicContact CG2-CG1 3.72Å
282	L	87.3	Confident	85.2	Confident	13 Å²	13	65 Å²	65	7%	0.068	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	137.4	179.5	-171.9	59.4	0	0	0	109.5	R286 K288 V444 N445 V446 I447	L282-R286 HydrophobicContact CD1-CB 3.77Å; L282-R286 WeakPolarHBondContact CD2-O 3.19Å; L282-R286 HydrophobicContact CG-CB 4.34Å; L282-K288 HydrophobicContact CD1-CB 3.94Å; L282-K288 HydrophobicContact CD2-CB 4.48Å; L282-V444 HydrophobicContact CB-CG2 3.94Å; L282-V444 HydrophobicContact CD2-CG2 4.25Å; L282-N445 PolarHBondContact N-O 3.08Å; L282-V446 CarbonylContact O-C 2.9Å; L282-V446 VanDerWaalsContact O-CA 3.23Å; L282-V446 WeakPolarHBondContact O-CA 3.37Å; L282-I447 PolarHBondContact O-N 2.63Å
283	K	84.7	Confident	85.3	Confident	150 Å²	150	66.9 Å²	66.9	65%	0.652	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	143.3	172.4	-68.7	-173.1	177.6	-174.5	0	110	G285 R286 I447	K283-G285 PolarHBondContact O-N 3.16Å; K283-R286 HydrophobicContact CB-CG 4.05Å; K283-R286 VanDerWaalsContact O-CB 3.3Å; K283-R286 WeakPolarHBondContact O-CB 3.48Å; K283-R286 PolarHBondContact O-N 2.91Å; K283-I447 WeakPolarHBondContact CA-O 3.25Å
284	E	83.8	Confident	85.4	Confident	61 Å²	61	66.9 Å²	66.9	29%	0.285	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	138	174.1	-169.7	175.1	-163.6	0	0	111.3	R286 G419 V446 I447 S448 R1045	E284-R286 VanDerWaalsContact C-N 3.26Å; E284-R286 PolarHBondContact O-N 3.43Å; E284-G419 CarbonylContact C-O 3.59Å; E284-G419 WeakPolarHBondContact CA-O 3.06Å; E284-V446 HydrophobicContact CB-CG1 4.12Å; E284-I447 PolarHBondContact N-O 2.53Å; E284-S448 WeakPolarHBondContact OE2-CB 3.43Å; E284-R1045 IonicContact OE1-CZ 2.75Å; E284-R1045 VanDerWaalsContact OE1-CZ 3.27Å; E284-R1045 IonicContact OE1-NH1 2.68Å; E284-R1045 PolarHBondContact OE1-NH1 3.44Å; E284-R1045 IonicContact OE1-NH2 2.95Å; E284-R1045 PolarHBondContact OE1-NH2 3.17Å; E284-R1045 IonicContact OE2-CZ 3.59Å; E284-R1045 IonicContact OE2-NH2 2.64Å; E284-R1045 PolarHBondContact OE2-NH2 3.27Å
285	G	83.8	Confident	85.7	Confident	70 Å²	70	66.9 Å²	66.9	72%	0.722	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.3	-4	-174.4	0	0	0	0	0	115.4	K283 G419	K283-G285 PolarHBondContact O-N 3.16Å; G285-G419 PolarHBondContact N-O 3.15Å
286	R	89.1	Confident	86.6	Confident	173 Å²	173	60.7 Å²	60.7	65%	0.653	32%	0.324	S	S	*	.			trans	-95.6	157.6	173.5	-62.4	-68.4	-175.1	148.5	-2.3	111.1	L282 K283 E284 G419	L282-R286 HydrophobicContact CD1-CB 3.77Å; L282-R286 WeakPolarHBondContact CD2-O 3.19Å; L282-R286 HydrophobicContact CG-CB 4.34Å; K283-R286 HydrophobicContact CB-CG 4.05Å; K283-R286 VanDerWaalsContact O-CB 3.3Å; K283-R286 WeakPolarHBondContact O-CB 3.48Å; K283-R286 PolarHBondContact O-N 2.91Å; E284-R286 VanDerWaalsContact C-N 3.26Å; E284-R286 PolarHBondContact O-N 3.43Å; R286-G419 PolarHBondContact O-N 3.05Å
287	S	90.6	Very high	87.5	Confident	73 Å²	73	61.2 Å²	61.2	51%	0.51	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	146.1	174.4	-49	0	0	0	0	110.6	C417 D418	S287-C417 CarbonylContact C-O 3.53Å; S287-C417 WeakPolarHBondContact CA-O 3.33Å; S287-D418 VanDerWaalsContact CB-OD1 3.22Å; S287-D418 WeakPolarHBondContact CB-OD1 3.22Å; S287-D418 PolarHBondContact OG-OD1 3.07Å
288	K	91.2	Very high	87.8	Confident	93 Å²	93	60.5 Å²	60.5	40%	0.404	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	142.3	172.7	-173.3	173	-179.3	176.7	0	109.7	F279 L282 C417	F279-K288 HydrophobicContact CB-CD 4.44Å; F279-K288 HydrophobicContact CD1-CB 4.03Å; F279-K288 HydrophobicContact CD1-CD 4.32Å; F279-K288 HydrophobicContact CD1-CG 4.03Å; F279-K288 VanDerWaalsContact CE1-O 3.26Å; F279-K288 WeakPolarHBondContact CE1-O 3.35Å; F279-K288 VanDerWaalsContact O-CD 3.3Å; F279-K288 WeakPolarHBondContact O-CD 3.33Å; F279-K288 WeakPolarHBondContact O-CE 3.49Å; F279-K288 PolarHBondContact O-NZ 2.99Å; L282-K288 HydrophobicContact CD1-CB 3.94Å; L282-K288 HydrophobicContact CD2-CB 4.48Å; K288-C417 PolarHBondContact N-O 3.07Å; K288-C417 PolarHBondContact O-N 2.81Å
289	T	90.3	Very high	88	Confident	73 Å²	73	63.9 Å²	63.9	45%	0.448	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	140.9	-179.5	-54.5	0	0	0	0	109.9	V414 V415 I416	T289-V414 HydrophobicContact CG2-CG1 3.19Å; T289-V415 WeakPolarHBondContact CA-O 3.35Å; T289-I416 HydrophobicContact CG2-CG1 4.17Å
290	M	89.7	Confident	88	Confident	24 Å²	24	69.6 Å²	69.6	12%	0.118	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	137.1	175.4	-179.4	174.5	-71.2	0	0	109.8	H278 F279 I292 V415	H278-M290 VanDerWaalsContact C-CE 3.44Å; H278-M290 VanDerWaalsContact O-CE 3.25Å; H278-M290 WeakPolarHBondContact O-CE 3.21Å; F279-M290 HydrophobicContact CD1-CB 4.15Å; F279-M290 HydrophobicContact CD1-CE 4.48Å; F279-M290 HydrophobicContact CD2-CE 4.21Å; F279-M290 HydrophobicContact CE1-CB 3.47Å; F279-M290 VanDerWaalsContact CE1-CB 3.47Å; F279-M290 HydrophobicContact CE2-CB 4.19Å; F279-M290 HydrophobicContact CE2-CE 4.5Å; F279-M290 HydrophobicContact CE2-SD 4.3Å; F279-M290 HydrophobicContact CG-CE 4.2Å; F279-M290 HydrophobicContact CZ-CB 3.5Å; F279-M290 VanDerWaalsContact CZ-CB 3.5Å; M290-I292 HydrophobicContact CG-CG1 4.44Å; M290-V415 PolarHBondContact N-O 3.19Å; M290-V415 PolarHBondContact O-N 3.07Å
291	V	88.9	Confident	88	Confident	61 Å²	61	71.6 Å²	71.6	37%	0.37	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	124.5	174.2	-175.4	0	0	0	0	108.4	W293 F412 V414	V291-W293 HydrophobicContact CG1-CZ2 4.36Å; V291-F412 HydrophobicContact CG1-CB 3.76Å; V291-F412 HydrophobicContact CG1-CD2 3.84Å; V291-F412 HydrophobicContact CG1-CG 4.02Å; V291-V414 HydrophobicContact CG2-CG1 4.5Å; V291-V414 HydrophobicContact CG2-CG2 4.21Å
292	I	88.9	Confident	88.2	Confident	0 Å²	0	68.2 Å²	68.2	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113.3	177.3	-58.7	169.4	0	0	0	107.4	V273 M290 F412 I413 V415 L429 L442	V273-I292 HydrophobicContact CG1-CG2 3.66Å; M290-I292 HydrophobicContact CG-CG1 4.44Å; I292-F412 VanDerWaalsContact O-CA 3.25Å; I292-F412 WeakPolarHBondContact O-CA 3.47Å; I292-I413 HydrophobicContact CB-CD1 4.22Å; I292-I413 HydrophobicContact CB-CG1 3.72Å; I292-I413 HydrophobicContact CD1-CD1 4.2Å; I292-I413 HydrophobicContact CD1-CG1 4.39Å; I292-I413 HydrophobicContact CG2-CD1 4.44Å; I292-I413 HydrophobicContact CG2-CG1 4.3Å; I292-I413 PolarHBondContact N-O 2.81Å; I292-I413 PolarHBondContact O-N 3.35Å; I292-V415 HydrophobicContact CD1-CG2 3.86Å; I292-L429 HydrophobicContact CD1-CD2 3.52Å; I292-L442 HydrophobicContact CD1-CD2 3.62Å
293	W	89.2	Confident	88.2	Confident	123 Å²	123	70.4 Å²	70.4	47%	0.466	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	140.2	176.3	-63.6	90.9	0	0	0	111.4	V273 T274 V291 K410 F412	V273-W293 WeakPolarHBondContact CA-O 3.48Å; T274-W293 PolarHBondContact N-O 2.9Å; T274-W293 WeakPolarHBondContact OG1-CA 3.43Å; T274-W293 VanDerWaalsContact OG1-CB 3.3Å; T274-W293 WeakPolarHBondContact OG1-CB 3.21Å; T274-W293 PolarHBondContact OG1-N 3.09Å; T274-W293 PolarHBondContact OG1-O 2.98Å; V291-W293 HydrophobicContact CG1-CZ2 4.36Å; W293-K410 HydrophobicContact CE3-CB 4.38Å; W293-F412 HydrophobicContact CD2-CB 4.01Å; W293-F412 HydrophobicContact CE3-CB 3.79Å; W293-F412 HydrophobicContact CE3-CD1 4.31Å; W293-F412 HydrophobicContact CE3-CG 4.46Å; W293-F412 HydrophobicContact CH2-CB 4.47Å; W293-F412 AromaticContact CH2-CD1 3.88Å; W293-F412 HydrophobicContact CH2-CD1 3.88Å; W293-F412 HydrophobicContact CH2-CG 4.37Å; W293-F412 HydrophobicContact CZ3-CB 4.04Å; W293-F412 AromaticContact CZ3-CD1 3.69Å; W293-F412 HydrophobicContact CZ3-CD1 3.69Å; W293-F412 HydrophobicContact CZ3-CG 4.22Å
294	I	90.1	Very high	88.3	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	114.1	176.5	-57	171	0	0	0	106.3	I271 V273 L304 K410 T411 I413 L431 F433	I271-I294 HydrophobicContact CG2-CG2 3.56Å; V273-I294 HydrophobicContact CG1-CG1 4.32Å; V273-I294 HydrophobicContact CG2-CG1 4.27Å; V273-I294 HydrophobicContact CG2-CG2 4.38Å; I294-L304 HydrophobicContact CD1-CD2 3.76Å; I294-K410 WeakPolarHBondContact O-CA 3.2Å; I294-T411 HydrophobicContact CB-CG2 3.71Å; I294-T411 HydrophobicContact CD1-CG2 4.22Å; I294-T411 HydrophobicContact CG1-CG2 4.46Å; I294-T411 HydrophobicContact CG2-CG2 4.08Å; I294-T411 PolarHBondContact N-O 2.98Å; I294-T411 PolarHBondContact O-N 2.88Å; I294-T411 VanDerWaalsContact O-O 3.12Å; I294-I413 HydrophobicContact CD1-CG2 4.46Å; I294-L431 HydrophobicContact CD1-CD1 3.88Å; I294-L431 HydrophobicContact CD1-CD2 3.84Å; I294-L431 HydrophobicContact CD1-CG 4.46Å; I294-L431 HydrophobicContact CG1-CD1 4.16Å; I294-F433 HydrophobicContact CG2-CZ 3.96Å
295	E	90.4	Very high	88.3	Confident	39 Å²	39	63.7 Å²	63.7	18%	0.182	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	130.1	-178	180	169.2	-174.7	0	0	110.2	I271 E272 K297 G409 K410	I271-E295 CarbonylContact C-O 3.54Å; I271-E295 WeakPolarHBondContact CA-O 3.38Å; E272-E295 PolarHBondContact N-O 2.91Å; E272-E295 PolarHBondContact O-N 2.81Å; E295-K297 HydrophobicContact CG-CD 4.01Å; E295-K297 HydrophobicContact CG-CG 4.48Å; E295-K297 VanDerWaalsContact OE1-CE 3.32Å; E295-K297 WeakPolarHBondContact OE1-CE 3.3Å; E295-K297 IonicContact OE1-NZ 3.8Å; E295-K297 PolarHBondContact OE1-NZ 3.09Å; E295-K297 IonicContact OE2-NZ 2.91Å; E295-K297 PolarHBondContact OE2-NZ 2.86Å; E295-G409 WeakPolarHBondContact CA-O 3.19Å; E295-K410 HydrophobicContact CB-CG 4.12Å; E295-K410 HydrophobicContact CG-CG 3.9Å; E295-K410 WeakPolarHBondContact OE1-CE 3.44Å; E295-K410 IonicContact OE1-NZ 3.5Å; E295-K410 VanDerWaalsContact OE2-CE 3.23Å; E295-K410 WeakPolarHBondContact OE2-CE 3.43Å; E295-K410 IonicContact OE2-NZ 2.8Å; E295-K410 PolarHBondContact OE2-NZ 3.45Å; E295-K410 VanDerWaalsContact OE2-NZ 3.16Å
296	N	91.7	Very high	88.3	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	110.5	172.3	-173.5	-0.6	0	0	0	109.9	I271 G298 I300 V405 P406 G408 G409	I271-N296 HydrophobicContact CD1-CB 3.56Å; N296-G298 PolarHBondContact OD1-N 2.91Å; N296-I300 PolarHBondContact ND2-O 3.26Å; N296-V405 HydrophobicContact CB-CB 4.35Å; N296-V405 HydrophobicContact CB-CG1 3.62Å; N296-V405 PolarHBondContact ND2-O 2.85Å; N296-P406 WeakPolarHBondContact CB-O 3.34Å; N296-P406 PolarHBondContact ND2-O 2.89Å; N296-G408 WeakPolarHBondContact O-CA 3.36Å; N296-G408 PolarHBondContact O-N 3.34Å; N296-G409 PolarHBondContact N-O 3.28Å
297	K	89.4	Confident	88.1	Confident	114 Å²	114	52.8 Å²	52.8	50%	0.496	28%	0.278	S	S	.	.			trans	-92.7	-3.2	176	-60	-66	-168	179.7	0	113.1	D270 E272 E295	D270-K297 HydrophobicContact CB-CB 4.41Å; D270-K297 WeakPolarHBondContact O-CA 3.41Å; D270-K297 VanDerWaalsContact O-CB 3.32Å; D270-K297 WeakPolarHBondContact O-CB 3.44Å; D270-K297 PolarHBondContact O-N 2.79Å; E272-K297 HydrophobicContact CB-CG 4.23Å; E272-K297 WeakPolarHBondContact OE2-CE 3.38Å; E295-K297 HydrophobicContact CG-CD 4.01Å; E295-K297 HydrophobicContact CG-CG 4.48Å; E295-K297 VanDerWaalsContact OE1-CE 3.32Å; E295-K297 WeakPolarHBondContact OE1-CE 3.3Å; E295-K297 IonicContact OE1-NZ 3.8Å; E295-K297 PolarHBondContact OE1-NZ 3.09Å; E295-K297 IonicContact OE2-NZ 2.91Å; E295-K297 PolarHBondContact OE2-NZ 2.86Å
298	G	87	Confident	87.9	Confident	6 Å²	6	54.2 Å²	54.2	6%	0.062	28%	0.275	C	S	.	.	S	Bend	trans	-92	172.1	-179.6	0	0	0	0	0	113	D270 N296 P407	D270-G298 VanDerWaalsContact CB-CA 3.41Å; D270-G298 VanDerWaalsContact CB-N 3.27Å; N296-G298 PolarHBondContact OD1-N 2.91Å; G298-P407 WeakPolarHBondContact O-CA 3.27Å; G298-P407 WeakPolarHBondContact O-CB 3.46Å
299	D	86.8	Confident	87.6	Confident	155 Å²	155	51.9 Å²	51.9	83%	0.829	27%	0.267	S	S	*	.	S	Bend	trans	-86.4	-6.9	-180	-62.6	-38.6	0	0	0	113.4	P407	D299-P407 VanDerWaalsContact O-CG 3.22Å; D299-P407 WeakPolarHBondContact O-CG 3.23Å
300	I	86.5	Confident	87	Confident	120 Å²	120	50.4 Å²	50.4	62%	0.615	26%	0.262	S	S	*	.	S	Bend	trans	-111.8	132.1	-175.3	-56.4	173.6	0	0	0	109.1	N296 Q302	N296-I300 PolarHBondContact ND2-O 3.26Å; I300-Q302 PolarHBondContact O-N 3.33Å
301	P	85.2	Confident	86.3	Confident	63 Å²	63	51.6 Å²	51.6	41%	0.409	28%	0.281	S	S	.	.			trans	-62.9	133.8	174.8	25.4	-33.4	0	0	0	110.9	L404 V405	P301-L404 HydrophobicContact CB-CD1 3.92Å; P301-L404 HydrophobicContact CB-CD2 4.31Å; P301-L404 HydrophobicContact CB-CG 4.11Å; P301-V405 WeakPolarHBondContact CA-O 3.48Å
302	Q	87.9	Confident	85.5	Confident	22 Å²	22	51.4 Å²	51.4	10%	0.103	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	126.3	-179.8	-66.9	-69.4	-2.7	0	0	109.6	G269 I271 I300 V405 F433 F436	G269-Q302 PolarHBondContact O-NE2 3.41Å; I271-Q302 HydrophobicContact CD1-CB 3.65Å; I271-Q302 HydrophobicContact CD1-CG 3.76Å; I271-Q302 HydrophobicContact CG1-CB 4.02Å; I271-Q302 HydrophobicContact CG1-CG 3.81Å; I300-Q302 PolarHBondContact O-N 3.33Å; Q302-V405 PolarHBondContact N-O 3.44Å; Q302-V405 WeakPolarHBondContact O-CA 3.49Å; Q302-V405 WeakPolarHBondContact O-CB 3.11Å; Q302-V405 PolarHBondContact O-N 3.47Å; Q302-F433 HydrophobicContact CB-CD1 3.98Å; Q302-F433 HydrophobicContact CB-CE1 4.24Å; Q302-F436 HydrophobicContact CG-CZ 4.42Å
303	N	87.2	Confident	84.7	Confident	59 Å²	59	51.9 Å²	51.9	32%	0.316	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	115.3	179.5	-174.3	36.4	0	0	0	110.5	V305 L404 F433 S434	N303-V305 PolarHBondContact O-N 2.64Å; N303-L404 HydrophobicContact CB-CD1 4.15Å; N303-F433 VanDerWaalsContact O-CA 3.26Å; N303-F433 WeakPolarHBondContact O-CA 3.21Å; N303-S434 PolarHBondContact O-N 3Å
304	L	86.4	Confident	83.8	Confident	4 Å²	4	51.4 Å²	51.4	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	105.3	170	-178.5	62.4	0	0	0	107.5	I294 G402 G403 L431 F433	I294-L304 HydrophobicContact CD1-CD2 3.76Å; L304-G402 CarbonylContact O-C 3.42Å; L304-G402 WeakPolarHBondContact O-CA 3.35Å; L304-G403 PolarHBondContact N-O 2.97Å; L304-G403 VanDerWaalsContact N-O 3.09Å; L304-G403 PolarHBondContact O-N 3.37Å; L304-L431 HydrophobicContact CD1-CB 4.03Å; L304-L431 HydrophobicContact CD1-CD2 4.41Å; L304-F433 HydrophobicContact CB-CD1 4.32Å; L304-F433 HydrophobicContact CB-CE1 3.97Å; L304-F433 HydrophobicContact CB-CZ 4.47Å; L304-F433 HydrophobicContact CD1-CD1 4.46Å; L304-F433 HydrophobicContact CD1-CD2 4.37Å; L304-F433 HydrophobicContact CD1-CE1 4.08Å; L304-F433 HydrophobicContact CD1-CE2 3.98Å; L304-F433 HydrophobicContact CD1-CZ 3.82Å
305	V	84	Confident	82.9	Confident	65 Å²	65	52.7 Å²	52.7	39%	0.394	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.7	-47.2	-175.7	-179.2	0	0	0	0	110.5	N303 C432	N303-V305 PolarHBondContact O-N 2.64Å; V305-C432 WeakPolarHBondContact CA-O 3.42Å; V305-C432 WeakPolarHBondContact CB-O 3.21Å; V305-C432 PolarHBondContact N-O 3.28Å
306	S	84.3	Confident	82.4	Confident	7 Å²	7	58.5 Å²	58.5	5%	0.049	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	157.2	179.9	62.1	0	0	0	0	112.3	E400 C432	S306-E400 VanDerWaalsContact CB-CD 3.41Å; S306-E400 WeakPolarHBondContact CB-OE1 3.48Å; S306-E400 VanDerWaalsContact CB-OE2 3.29Å; S306-E400 WeakPolarHBondContact CB-OE2 3.45Å; S306-C432 PolarHBondContact N-O 2.77Å; S306-C432 WeakPolarHBondContact O-CB 3.35Å; S306-C432 PolarHBondContact O-N 2.94Å; S306-C432 WeakPolarHBondContact OG-CB 3.19Å
307	C	84.5	Confident	82.1	Confident	7 Å²	7	58.6 Å²	58.6	5%	0.047	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	128.3	167.5	-59.3	0	0	0	0	108.8	F320 P401 L430 L431	C307-F320 HydrophobicContact CB-CE1 4.1Å; C307-F320 HydrophobicContact CB-CE2 4.49Å; C307-F320 HydrophobicContact CB-CZ 3.85Å; C307-F320 WeakPolarHBondContact O-CE2 3.17Å; C307-P401 HydrophobicContact CB-CG 3.83Å; C307-L430 CarbonylContact C-O 3.6Å; C307-L430 WeakPolarHBondContact CA-O 3.49Å; C307-L431 HydrophobicContact CB-CD2 4.31Å; C307-L431 VanDerWaalsContact SG-CD2 3.54Å
308	K	87.1	Confident	82	Confident	103 Å²	103	53.5 Å²	53.5	45%	0.448	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	146.6	-177.4	-61.4	-174.9	-177.5	-177.5	0	110.7	E400 L430	K308-E400 WeakPolarHBondContact CE-OE1 3.43Å; K308-E400 IonicContact NZ-OE1 3.75Å; K308-L430 PolarHBondContact N-O 2.87Å; K308-L430 PolarHBondContact O-N 2.85Å
309	L	84.3	Confident	82.1	Confident	44 Å²	44	59.1 Å²	59.1	23%	0.23	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	134.5	165.2	-61	175.1	0	0	0	107.5	G311 F318 F320 E427 L429 L442	L309-G311 PolarHBondContact O-N 2.75Å; L309-F318 HydrophobicContact CD1-CB 3.79Å; L309-F318 VanDerWaalsContact CD1-O 3.3Å; L309-F318 WeakPolarHBondContact CD1-O 3.42Å; L309-F320 HydrophobicContact CD1-CE2 4.5Å; L309-F320 HydrophobicContact CD2-CZ 4.04Å; L309-F320 HydrophobicContact CG-CE2 3.92Å; L309-F320 HydrophobicContact CG-CZ 3.92Å; L309-E427 HydrophobicContact CB-CG 4.16Å; L309-E427 HydrophobicContact CD2-CG 3.97Å; L309-E427 HydrophobicContact CG-CG 4.48Å; L309-L429 HydrophobicContact CD2-CB 4.39Å; L309-L429 HydrophobicContact CD2-CD1 4.32Å; L309-L442 HydrophobicContact CD2-CD1 3.75Å
310	A	78	Confident	82.1	Confident	43 Å²	43	54 Å²	54	36%	0.355	28%	0.279	S	S	.	.			trans	-70.4	-9.4	-176.9	0	0	0	0	0	113.3	W312 E427 L428 L430	A310-W312 HydrophobicContact CB-CG 4.43Å; A310-E427 PolarHBondContact N-OE1 3.23Å; A310-L428 HydrophobicContact CB-CB 3.79Å; A310-L428 HydrophobicContact CB-CD2 4.23Å; A310-L428 HydrophobicContact CB-CG 4.25Å; A310-L428 WeakPolarHBondContact CB-O 3.21Å; A310-L428 PolarHBondContact N-O 3.17Å; A310-L430 HydrophobicContact CB-CD1 4.41Å
311	G	73.6	Confident	81.9	Confident	49 Å²	49	52.8 Å²	52.8	51%	0.505	27%	0.27	S	S	.	.			trans	76.2	26.3	178	0	0	0	0	0	112.9	L309 D313 E427	L309-G311 PolarHBondContact O-N 2.75Å; G311-D313 PolarHBondContact O-N 3.43Å; G311-E427 WeakPolarHBondContact CA-OE2 3.39Å; G311-E427 PolarHBondContact N-OE1 3.41Å; G311-E427 VanDerWaalsContact N-OE1 3.1Å; G311-E427 PolarHBondContact N-OE2 3.25Å
312	W	72.4	Confident	80.5	Confident	57 Å²	57	56.3 Å²	56.3	22%	0.216	28%	0.283	C	S	.	.			trans	-65.8	-29.4	173.7	-69	13	0	0	0	111.1	A310 E427 L428 Y441 D1175	A310-W312 HydrophobicContact CB-CG 4.43Å; W312-E427 WeakPolarHBondContact CB-OE1 3.41Å; W312-E427 VanDerWaalsContact N-CD 3.33Å; W312-E427 PolarHBondContact N-OE1 2.93Å; W312-E427 PolarHBondContact N-OE2 3Å; W312-L428 HydrophobicContact CD2-CB 4.04Å; W312-L428 HydrophobicContact CE3-CB 4.28Å; W312-L428 HydrophobicContact CH2-CB 4.36Å; W312-L428 HydrophobicContact CH2-CD2 4.34Å; W312-L428 HydrophobicContact CZ2-CB 4.12Å; W312-L428 HydrophobicContact CZ2-CD2 3.79Å; W312-L428 HydrophobicContact CZ3-CB 4.43Å; W312-Y441 AromaticContact CH2-CE1 3.7Å; W312-Y441 HydrophobicContact CH2-CE1 3.7Å; W312-Y441 HydrophobicContact CZ3-CD1 4.18Å; W312-Y441 AromaticContact CZ3-CE1 3.62Å; W312-Y441 HydrophobicContact CZ3-CE1 3.62Å; W312-D1175 HydrophobicContact CB-CB 4.07Å; W312-D1175 HydrophobicContact CE3-CB 4.49Å
313	D	73.8	Confident	78.8	Confident	9 Å²	9	60.5 Å²	60.5	5%	0.048	31%	0.306	C	S	.	.			trans	-91.4	98	173.3	174.6	26	0	0	0	112.1	G311 S315 K316 Q317 F318 C425 E427	G311-D313 PolarHBondContact O-N 3.43Å; D313-S315 PolarHBondContact O-N 3.06Å; D313-S315 WeakPolarHBondContact OD1-CB 3.33Å; D313-S315 PolarHBondContact OD1-N 3.23Å; D313-S315 VanDerWaalsContact OD1-N 3.07Å; D313-S315 PolarHBondContact OD1-OG 2.79Å; D313-K316 PolarHBondContact O-N 2.77Å; D313-K316 VanDerWaalsContact O-N 3.08Å; D313-Q317 VanDerWaalsContact OD2-CA 3.31Å; D313-Q317 WeakPolarHBondContact OD2-CA 3.48Å; D313-Q317 WeakPolarHBondContact OD2-CB 3.36Å; D313-Q317 VanDerWaalsContact OD2-CG 3.31Å; D313-Q317 WeakPolarHBondContact OD2-CG 3.37Å; D313-Q317 PolarHBondContact OD2-N 3.4Å; D313-F318 HydrophobicContact CB-CD2 4.03Å; D313-F318 HydrophobicContact CB-CE2 4.34Å; D313-F318 WeakPolarHBondContact OD2-CD2 3.33Å; D313-C425 VanDerWaalsContact CG-SG 3.54Å; D313-E427 HydrophobicContact CB-CB 4.49Å; D313-E427 PolarHBondContact N-OE2 3.45Å
314	K	69.3	Low	76.5	Confident	114 Å²	114	64 Å²	64	50%	0.496	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-24	178	-66.1	-166.8	178.9	-171.9	0	113.7	K316	K314-K316 PolarHBondContact O-N 3.03Å
315	S	71.2	Confident	74.1	Confident	26 Å²	26	73.9 Å²	73.9	18%	0.182	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-9.1	177.3	16.4	0	0	0	0	113.7	D313 Q317 K420 N421	D313-S315 PolarHBondContact O-N 3.06Å; D313-S315 WeakPolarHBondContact OD1-CB 3.33Å; D313-S315 PolarHBondContact OD1-N 3.23Å; D313-S315 VanDerWaalsContact OD1-N 3.07Å; D313-S315 PolarHBondContact OD1-OG 2.79Å; S315-Q317 VanDerWaalsContact C-N 3.26Å; S315-Q317 PolarHBondContact O-N 2.96Å; S315-K420 WeakPolarHBondContact O-CD 3.31Å; S315-K420 PolarHBondContact O-NZ 3.27Å; S315-K420 VanDerWaalsContact O-NZ 3.1Å; S315-N421 WeakPolarHBondContact CB-ND2 3.43Å; S315-N421 PolarHBondContact OG-ND2 3.15Å
316	K	79.7	Confident	71.7	Confident	162 Å²	162	78.2 Å²	78.2	70%	0.704	39%	0.388	S	S	*	.			trans	48.4	50.9	-173.4	-57.2	-174.4	178.3	-171.6	0	110.9	D313 K314 F318 K420	D313-K316 PolarHBondContact O-N 2.77Å; D313-K316 VanDerWaalsContact O-N 3.08Å; K314-K316 PolarHBondContact O-N 3.03Å; K316-F318 VanDerWaalsContact C-N 3.34Å; K316-K420 PolarHBondContact O-NZ 3.02Å
317	Q	85	Confident	69	Low	1 Å²	1	85.6 Å²	85.6	1%	0.005	42%	0.422	C	S	.	.			trans	-71.5	-34.7	172	-56.8	-172.7	118.4	0	0	109.9	D313 S315 C417 D418 K420 C425	D313-Q317 VanDerWaalsContact OD2-CA 3.31Å; D313-Q317 WeakPolarHBondContact OD2-CA 3.48Å; D313-Q317 WeakPolarHBondContact OD2-CB 3.36Å; D313-Q317 VanDerWaalsContact OD2-CG 3.31Å; D313-Q317 WeakPolarHBondContact OD2-CG 3.37Å; D313-Q317 PolarHBondContact OD2-N 3.4Å; S315-Q317 VanDerWaalsContact C-N 3.26Å; S315-Q317 PolarHBondContact O-N 2.96Å; Q317-C417 CarbonylContact O-C 3.56Å; Q317-C417 VanDerWaalsContact O-CA 3.26Å; Q317-C417 WeakPolarHBondContact O-CA 3.33Å; Q317-D418 WeakPolarHBondContact CB-O 3.39Å; Q317-D418 WeakPolarHBondContact CG-O 3.38Å; Q317-D418 PolarHBondContact O-N 3.32Å; Q317-K420 HydrophobicContact CG-CB 4.08Å; Q317-K420 HydrophobicContact CG-CD 4.26Å; Q317-K420 HydrophobicContact CG-CG 4.34Å; Q317-C425 VanDerWaalsContact NE2-CB 3.31Å; Q317-C425 PolarHBondContact NE2-SG 2.92Å
318	F	88.4	Confident	66.2	Low	8 Å²	8	94.3 Å²	94.3	4%	0.035	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	133	175.7	-56.9	-84.5	0	0	0	111.5	F279 L309 D313 K316 V415 I416 C417 E427 L442 V444	F279-F318 AromaticContact CD2-CE1 3.93Å; F279-F318 HydrophobicContact CD2-CE1 3.93Å; F279-F318 HydrophobicContact CE2-CD1 4.06Å; F279-F318 AromaticContact CE2-CE1 3.76Å; F279-F318 HydrophobicContact CE2-CE1 3.76Å; L309-F318 HydrophobicContact CD1-CB 3.79Å; L309-F318 VanDerWaalsContact CD1-O 3.3Å; L309-F318 WeakPolarHBondContact CD1-O 3.42Å; D313-F318 HydrophobicContact CB-CD2 4.03Å; D313-F318 HydrophobicContact CB-CE2 4.34Å; D313-F318 WeakPolarHBondContact OD2-CD2 3.33Å; K316-F318 VanDerWaalsContact C-N 3.34Å; F318-V415 HydrophobicContact CB-CG1 4.48Å; F318-V415 HydrophobicContact CD1-CG1 4.37Å; F318-I416 CarbonylContact C-O 3.54Å; F318-I416 WeakPolarHBondContact CA-O 3.31Å; F318-C417 HydrophobicContact CD1-CB 4.01Å; F318-C417 HydrophobicContact CE1-CB 4Å; F318-E427 HydrophobicContact CB-CG 4.43Å; F318-E427 HydrophobicContact CD2-CB 3.48Å; F318-E427 VanDerWaalsContact CD2-CB 3.48Å; F318-E427 HydrophobicContact CD2-CG 4.07Å; F318-E427 HydrophobicContact CE2-CB 3.68Å; F318-E427 HydrophobicContact CG-CB 4.07Å; F318-E427 HydrophobicContact CG-CG 4.4Å; F318-E427 HydrophobicContact CZ-CB 4.41Å; F318-L442 HydrophobicContact CD1-CB 4.06Å; F318-L442 HydrophobicContact CD1-CD1 4.07Å; F318-L442 HydrophobicContact CE1-CB 3.79Å; F318-L442 HydrophobicContact CG-CD1 4.43Å; F318-L442 HydrophobicContact CZ-CB 4.24Å; F318-V444 HydrophobicContact CE1-CG1 4.39Å; F318-V444 HydrophobicContact CE2-CG1 4.41Å; F318-V444 HydrophobicContact CZ-CB 4.25Å; F318-V444 HydrophobicContact CZ-CG1 3.71Å
319	R	87.9	Confident	63.2	Low	123 Å²	123	94.8 Å²	94.8	46%	0.464	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	150.3	174.2	61.2	-172.1	176.4	102	1	111.4	I416 D418	R319-I416 HydrophobicContact CG-CB 4.03Å; R319-I416 PolarHBondContact N-O 2.95Å; R319-I416 PolarHBondContact O-N 3.16Å; R319-D418 IonicContact CZ-OD2 3.75Å; R319-D418 IonicContact NE-OD2 3.97Å; R319-D418 PolarHBondContact NE-OD2 3.31Å; R319-D418 IonicContact NH2-OD1 3.87Å; R319-D418 IonicContact NH2-OD2 3.68Å
320	F	87.1	Confident	60.5	Low	47 Å²	47	97.7 Å²	97.7	21%	0.206	50%	0.501	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	140.9	171.6	-62.3	-66.3	0	0	0	110.3	C307 L309 I413 V415 L429	C307-F320 HydrophobicContact CB-CE1 4.1Å; C307-F320 HydrophobicContact CB-CE2 4.49Å; C307-F320 HydrophobicContact CB-CZ 3.85Å; C307-F320 WeakPolarHBondContact O-CE2 3.17Å; L309-F320 HydrophobicContact CD1-CE2 4.5Å; L309-F320 HydrophobicContact CD2-CZ 4.04Å; L309-F320 HydrophobicContact CG-CE2 3.92Å; L309-F320 HydrophobicContact CG-CZ 3.92Å; F320-I413 HydrophobicContact CE1-CD1 4.34Å; F320-V415 HydrophobicContact CD1-CG2 4.15Å; F320-V415 HydrophobicContact CE1-CG2 4.15Å; F320-L429 HydrophobicContact CE1-CD1 3.71Å; F320-L429 HydrophobicContact CZ-CD1 3.65Å
321	Q	82.6	Confident	57.9	Low	95 Å²	95	102.3 Å²	102.3	44%	0.444	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-80	124.3	166.2	-171.3	170.6	0.1	0	0	108.5	L323 V414 I416	Q321-L323 PolarHBondContact O-N 2.92Å; Q321-V414 HydrophobicContact CB-CB 3.99Å; Q321-V414 HydrophobicContact CB-CG1 3.98Å; Q321-V414 PolarHBondContact N-O 3.22Å; Q321-I416 HydrophobicContact CB-CD1 3.82Å; Q321-I416 HydrophobicContact CB-CG1 4.13Å; Q321-I416 HydrophobicContact CG-CD1 4Å
322	M	56.5	Low	55.6	Low	137 Å²	137	106 Å²	106	68%	0.675	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-67.5	116.6	173.9	-57.8	-174.9	83.5	0	0	108.6	D324 P399	M322-D324 PolarHBondContact O-N 3.4Å; M322-P399 VanDerWaalsContact CE-CD 3.46Å; M322-P399 HydrophobicContact CE-CG 3.23Å
323	L	52.3	Low	53.1	Low	110 Å²	110	107.5 Å²	107.5	58%	0.576	56%	0.556	S	S	*	*			trans	-79.1	104	165.1	-84.3	118	0	0	0	107.5	Q321 K325 F412	Q321-L323 PolarHBondContact O-N 2.92Å; L323-K325 PolarHBondContact O-N 3.46Å; L323-F412 HydrophobicContact CD1-CE2 4.36Å; L323-F412 HydrophobicContact CD2-CE2 4.32Å; L323-F412 HydrophobicContact CD2-CZ 4.28Å
324	D	39.2	Very low	50.7	Low	133 Å²	133	116.4 Å²	116.4	71%	0.711	59%	0.594	S	S	*	*			trans	-59.6	127.3	163.4	-94.4	-29.2	0	0	0	108.2	M322 D326	M322-D324 PolarHBondContact O-N 3.4Å; D324-D326 PolarHBondContact O-N 2.98Å
325	K	35.8	Very low	48.4	Very low	212 Å²	212	116.5 Å²	116.5	92%	0.922	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-2.2	179.6	-84.5	-174.6	174.3	179.2	0	114.1	L323	L323-K325 PolarHBondContact O-N 3.46Å
326	D	32.6	Very low	46	Very low	155 Å²	155	120.3 Å²	120.3	83%	0.829	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	12.2	-174.9	-70.4	-27.3	0	0	0	115.6	D324	D324-D326 PolarHBondContact O-N 2.98Å
327	Q	27.4	Very low	43.2	Very low	163 Å²	163	118.2 Å²	118.2	76%	0.762	63%	0.631	S	S	*	*			trans	-110.8	86.3	165.8	-74.7	-172.8	12.1	0	0	111.7	C329	Q327-C329 PolarHBondContact O-N 3.42Å
328	M	25.6	Very low	40.3	Very low	190 Å²	190	123.5 Å²	123.5	94%	0.936	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-54.5	122.6	150.9	-96.3	-165.2	152.9	0	0	108.3
329	C	25.8	Very low	37.1	Very low	113 Å²	113	132.5 Å²	132.5	76%	0.764	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-53.4	129.7	-174.9	-67.2	0	0	0	0	112.4	Q327 V331	Q327-C329 PolarHBondContact O-N 3.42Å; C329-V331 PolarHBondContact O-N 3.02Å
330	P	26.4	Very low	33.9	Very low	105 Å²	105	136 Å²	136	68%	0.682	73%	0.726	S	S	*	*	P	Polyproline II helix	trans	-68.6	129.6	151	29.3	-26.7	0	0	0	107.3	V332	P330-V332 PolarHBondContact O-N 3.06Å
331	V	23.7	Very low	30.6	Very low	140 Å²	140	142.3 Å²	142.3	85%	0.848	76%	0.757	S	S	*	*			trans	-50	100.4	173.8	177.3	0	0	0	0	109	C329 S333	C329-V331 PolarHBondContact O-N 3.02Å; V331-S333 VanDerWaalsContact C-N 3.3Å; V331-S333 PolarHBondContact O-N 3.45Å
332	V	24.4	Very low	27.7	Very low	125 Å²	125	145.4 Å²	145.4	76%	0.758	78%	0.776	S	S	*	*			trans	-75.9	94.5	166.7	-178.9	0	0	0	0	105.8	P330 F334	P330-V332 PolarHBondContact O-N 3.06Å; V332-F334 PolarHBondContact O-N 3.1Å; V332-F334 VanDerWaalsContact O-N 3.16Å
333	S	21.6	Very low	25.9	Very low	90 Å²	90	143.8 Å²	143.8	63%	0.629	78%	0.779	S	S	*	*			trans	-55.1	113.3	171.3	46.8	0	0	0	0	110.1	V331 V335	V331-S333 VanDerWaalsContact C-N 3.3Å; V331-S333 PolarHBondContact O-N 3.45Å; S333-V335 PolarHBondContact O-N 3.05Å
334	F	22.7	Very low	24.4	Very low	195 Å²	195	143.4 Å²	143.4	86%	0.855	79%	0.785	S	S	*	*			trans	-63.7	99.5	160.6	-80.2	-92.5	0	0	0	108.4	V332 S336	V332-F334 PolarHBondContact O-N 3.1Å; V332-F334 VanDerWaalsContact O-N 3.16Å; F334-S336 PolarHBondContact O-N 3.19Å
335	V	21.6	Very low	23.5	Very low	116 Å²	116	144.4 Å²	144.4	70%	0.703	79%	0.79	S	S	*	*			trans	-84.3	98.3	154.2	-179	0	0	0	0	106	S333 V337	S333-V335 PolarHBondContact O-N 3.05Å; V335-V337 HydrophobicContact CG1-CG2 3.92Å; V335-V337 PolarHBondContact O-N 3.39Å
336	S	20.2	Very low	22.8	Very low	106 Å²	106	142.2 Å²	142.2	74%	0.741	78%	0.783	S	S	*	*			trans	-61.1	100.2	166.6	-43.1	0	0	0	0	108.3	F334	F334-S336 PolarHBondContact O-N 3.19Å
337	V	21.4	Very low	22.3	Very low	118 Å²	118	140.5 Å²	140.5	72%	0.715	78%	0.775	S	S	*	*			trans	-97.6	122.1	164.6	-177.9	0	0	0	0	107.4	V335	V335-V337 HydrophobicContact CG1-CG2 3.92Å; V335-V337 PolarHBondContact O-N 3.39Å
338	P	23.1	Very low	21.9	Very low	112 Å²	112	139.3 Å²	139.3	73%	0.727	77%	0.772	S	S	*	*			trans	-73.6	137.5	-171.6	-6.6	22.3	0	0	0	111.7	K340	P338-K340 PolarHBondContact O-N 3.12Å
339	E	20.9	Very low	21.7	Very low	197 Å²	197	137.1 Å²	137.1	92%	0.921	76%	0.764	S	S	*	*			trans	-57.4	104.4	163.2	-68.9	174.6	156.8	0	0	109.2
340	K	20.2	Very low	21.5	Very low	196 Å²	196	136.4 Å²	136.4	85%	0.852	76%	0.76	S	S	*	*			trans	-107.7	104.7	154.5	-91.6	-172.5	174.8	-178.3	0	107.4	P338 N342	P338-K340 PolarHBondContact O-N 3.12Å; K340-N342 PolarHBondContact O-N 3.32Å
341	E	18.9	Very low	21.1	Very low	181 Å²	181	138.4 Å²	138.4	85%	0.846	77%	0.765	S	S	*	*			trans	-44.7	122.9	152.9	-64.5	178	146.7	0	0	108.8
342	N	20.4	Very low	21	Very low	159 Å²	159	138.4 Å²	138.4	85%	0.85	76%	0.76	S	S	*	*			trans	-158.9	129.2	142.6	-97.7	-16.2	0	0	0	109.9	K340	K340-N342 PolarHBondContact O-N 3.32Å
343	S	18.8	Very low	20.8	Very low	104 Å²	104	137.6 Å²	137.6	73%	0.727	76%	0.759	S	S	*	*			trans	-59.8	168.7	169.6	49	0	0	0	0	114.2
344	S	21.5	Very low	20.7	Very low	102 Å²	102	142 Å²	142	71%	0.713	77%	0.77	S	S	*	*			trans	80.4	107.9	162.9	60.6	0	0	0	0	118.7
345	D	20.5	Very low	20.6	Very low	153 Å²	153	139.4 Å²	139.4	82%	0.818	77%	0.77	S	S	*	*				57.7	128.4	119.5	-64.8	-26.7	0	0	0	122.2
346	E	21.3	Very low	20.4	Very low	166 Å²	166	142.3 Å²	142.3	78%	0.776	77%	0.773	S	S	*	*			trans	82.5	126.9	140.7	-78.3	-169.9	-177.9	0	0	122.7
347	N	21.7	Very low	20.4	Very low	120 Å²	120	144 Å²	144	64%	0.642	77%	0.774	S	S	*	*			trans	82.1	99.6	141.9	-64.8	-30.3	0	0	0	121.7
348	I	19.4	Very low	20.4	Very low	137 Å²	137	147 Å²	147	70%	0.703	78%	0.778	S	S	*	*				55.8	124.8	111.3	-63.9	172.6	0	0	0	119.6
349	N	20.5	Very low	20.2	Very low	144 Å²	144	147.7 Å²	147.7	77%	0.77	78%	0.78	S	S	*	*			trans	100.9	118.5	147	-78.9	-15.5	0	0	0	122.4
350	S	22.1	Very low	20.1	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	77%	0.767	S	S	*	*				80.5	115.9	126.6	68.9	0	0	0	0	122.7
351	L	19.2	Very low	20.1	Very low	148 Å²	148	141.7 Å²	141.7	78%	0.775	77%	0.765	S	S	*	*				48.7	130.4	128.5	-81.6	101.1	0	0	0	122.4
352	N	19.6	Very low	20	Very low	139 Å²	139	140.6 Å²	140.6	74%	0.743	76%	0.762	S	S	*	*			trans	96	131.7	131.3	-80.2	-10.8	0	0	0	122.2
353	S	21.2	Very low	20	Very low	108 Å²	108	137.1 Å²	137.1	76%	0.755	75%	0.75	S	S	*	*			trans	106.1	110	136.2	73.4	0	0	0	0	119.7
354	H	18.7	Very low	20	Very low	182 Å²	182	141.2 Å²	141.2	84%	0.843	76%	0.758	S	S	*	*			trans	6.9	130.4	135.6	-69.4	-72.6	0	0	0	118.3
355	T	21.5	Very low	19.9	Very low	141 Å²	141	141.1 Å²	141.1	87%	0.865	76%	0.757	S	S	*	*				-165.3	142.3	112.4	-19.4	0	0	0	0	113.6
356	K	18	Very low	19.9	Very low	177 Å²	177	138.5 Å²	138.5	77%	0.77	75%	0.75	S	S	*	*			trans	-40.2	151.4	164.9	-61.6	161.8	169.6	174.4	0	115.6
357	N	20.1	Very low	19.8	Very low	143 Å²	143	137.9 Å²	137.9	77%	0.765	75%	0.752	S	S	*	*				159.8	149.2	104.1	-99.7	-22.4	0	0	0	116.4
358	K	21	Very low	19.8	Very low	180 Å²	180	137.7 Å²	137.7	78%	0.783	75%	0.754	S	S	*	*			trans	90.6	107.2	149.8	-75.7	175.7	177.6	-177.2	0	120.3
359	T	18.8	Very low	19.9	Very low	126 Å²	126	138 Å²	138	77%	0.773	76%	0.757	S	S	*	*				78.4	136.9	95.4	-8.5	0	0	0	0	112.4
360	S	19.2	Very low	20	Very low	92 Å²	92	139.2 Å²	139.2	64%	0.643	76%	0.764	S	S	*	*			cis	-179.6	165.4	38.1	45.4	0	0	0	0	111.8
361	Q	19.7	Very low	19.9	Very low	176 Å²	176	146.5 Å²	146.5	82%	0.822	78%	0.777	S	S	*	*			trans	79.8	140	157.7	-73.3	178.1	-10.1	0	0	118.8
362	M	17.9	Very low	20	Very low	157 Å²	157	143.2 Å²	143.2	77%	0.773	78%	0.778	S	S	*	*			cis	-172.9	159.6	-10.2	-156.7	162.1	84	0	0	108.4
363	S	19.6	Very low	20	Very low	86 Å²	86	144.6 Å²	144.6	60%	0.601	78%	0.784	S	S	*	*			trans	72.4	108.3	159.4	27.1	0	0	0	0	119.3
364	E	18.3	Very low	20	Very low	191 Å²	191	144.6 Å²	144.6	89%	0.893	78%	0.784	S	S	*	*				77.5	123.9	98.3	-74.9	179.4	176.5	0	0	111.8
365	S	19.9	Very low	20.5	Very low	100 Å²	100	141.7 Å²	141.7	70%	0.699	78%	0.781	S	S	*	*			cis	-171.7	145.8	41.8	54.6	0	0	0	0	111
366	S	19.7	Very low	20.4	Very low	97 Å²	97	138.1 Å²	138.1	68%	0.678	77%	0.772	S	S	*	*			trans	37.1	141.5	135.9	65.1	0	0	0	0	120.9
367	L	20.9	Very low	20.5	Very low	154 Å²	154	137 Å²	137	81%	0.806	77%	0.774	S	S	*	*			cis	175.7	157.2	11.5	-120	156.5	0	0	0	106
368	V	21.5	Very low	20.4	Very low	115 Å²	115	136 Å²	136	70%	0.697	78%	0.778	S	S	*	*			trans	75.9	95.6	157.1	-177	0	0	0	0	116.3
369	N	20	Very low	20.4	Very low	143 Å²	143	133.7 Å²	133.7	77%	0.765	78%	0.779	S	S	*	*				53.3	109.3	91.9	-83.3	-14.6	0	0	0	114.8
370	N	23.6	Very low	20.3	Very low	171 Å²	171	133.6 Å²	133.6	91%	0.914	78%	0.782	S	S	*	*				-151.4	130.2	127.1	-103	-21.9	0	0	0	112.5
371	R	19.5	Very low	20.4	Very low	251 Å²	251	139.3 Å²	139.3	95%	0.947	80%	0.795	S	S	*	*			trans	-64.6	155.9	175.8	-69.5	172.1	176.1	-176.5	-2.7	111.3
372	G	21.7	Very low	20.4	Very low	78 Å²	78	134 Å²	134	80%	0.804	79%	0.788	S	S	*	*			trans	174.9	64.3	163	0	0	0	0	0	113.5
373	I	19.1	Very low	20.6	Very low	169 Å²	169	134.9 Å²	134.9	87%	0.867	79%	0.79	S	S	*	*			trans	-73.6	128.7	160.2	-67.1	165	0	0	0	107.2
374	S	21.9	Very low	20.6	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	80%	0.801	S	S	*	*				173.5	141.8	115.7	-155.1	0	0	0	0	112
375	P	28	Very low	20.8	Very low	120 Å²	120	132.7 Å²	132.7	78%	0.779	80%	0.796	S	S	*	*			trans	-95.1	164.4	176.1	37.9	-32.2	0	0	0	112.4
376	G	19.8	Very low	20.8	Very low	66 Å²	66	137.5 Å²	137.5	68%	0.68	81%	0.807	S	S	*	*			trans	134.9	133.5	176.1	0	0	0	0	0	109.7
377	D	20.9	Very low	21	Very low	153 Å²	153	141.7 Å²	141.7	82%	0.818	81%	0.813	S	S	*	*			cis	-156.2	141.5	8.9	-97.8	-39.2	0	0	0	108.1	T379	D377-T379 PolarHBondContact O-N 3.46Å
378	C	17.9	Very low	21	Very low	123 Å²	123	142.3 Å²	142.3	83%	0.831	82%	0.817	S	S	*	*			trans	-58.9	124.9	155.5	-73.5	0	0	0	0	109
379	T	20	Very low	21.2	Very low	131 Å²	131	143.3 Å²	143.3	80%	0.804	82%	0.819	S	S	*	*			trans	-127.6	106.2	160.8	15.4	0	0	0	0	109.6	D377	D377-T379 PolarHBondContact O-N 3.46Å
380	C	17.6	Very low	21.2	Very low	124 Å²	124	144.7 Å²	144.7	84%	0.838	83%	0.825	S	S	*	*			trans	-77.6	120.6	165.7	-55.4	0	0	0	0	109.3
381	K	21.1	Very low	21.3	Very low	212 Å²	212	144.2 Å²	144.2	92%	0.922	82%	0.821	S	S	*	*			trans	-152.3	135.9	156.1	-72.3	-172.6	177.5	179.9	0	104.6
382	G	20.5	Very low	21.5	Very low	66 Å²	66	136.7 Å²	136.7	68%	0.68	81%	0.807	S	S	*	*			cis	163.2	139.8	7.2	0	0	0	0	0	105.8
383	E	20.4	Very low	21.5	Very low	175 Å²	175	144.6 Å²	144.6	82%	0.818	81%	0.812	S	S	*	*			trans	71.8	114.1	149.8	-61.4	-175.7	161.4	0	0	121.7
384	N	20.2	Very low	21.7	Very low	154 Å²	154	145.4 Å²	145.4	82%	0.824	81%	0.81	S	S	*	*				65.9	106.1	122.1	-58.9	-10.7	0	0	0	119.5
385	G	23.1	Very low	21.8	Very low	76 Å²	76	148.1 Å²	148.1	78%	0.784	81%	0.81	S	S	*	*			trans	-159.1	75.2	158	0	0	0	0	0	110.3	K387	G385-K387 PolarHBondContact O-N 2.98Å; G385-K387 VanDerWaalsContact O-N 3.17Å
386	E	20.4	Very low	21.5	Very low	201 Å²	201	151.7 Å²	151.7	94%	0.939	82%	0.819	S	S	*	*			trans	-56.5	111.6	161.6	-78	177.6	152.6	0	0	109
387	K	23.3	Very low	21.7	Very low	185 Å²	185	154.8 Å²	154.8	80%	0.804	83%	0.825	S	S	*	*			trans	-137.9	100.2	154.6	-83.1	-170	177	175.7	0	108.3	G385 N389	G385-K387 PolarHBondContact O-N 2.98Å; G385-K387 VanDerWaalsContact O-N 3.17Å; K387-N389 PolarHBondContact O-N 3.08Å; K387-N389 VanDerWaalsContact O-N 3.08Å
388	D	21.6	Very low	22.1	Very low	167 Å²	167	155.4 Å²	155.4	89%	0.893	82%	0.823	S	S	*	*			trans	-47.2	109.8	155.4	-77.6	-36.8	0	0	0	109
389	N	23.8	Very low	22.8	Very low	136 Å²	136	154 Å²	154	73%	0.727	81%	0.812	S	S	*	*			trans	-140.4	109.3	157	-94.6	-29.9	0	0	0	106.6	K387 L391	K387-N389 PolarHBondContact O-N 3.08Å; K387-N389 VanDerWaalsContact O-N 3.08Å; N389-L391 VanDerWaalsContact C-N 3.29Å; N389-L391 PolarHBondContact O-N 2.95Å
390	I	21.9	Very low	23.8	Very low	173 Å²	173	152.7 Å²	152.7	89%	0.887	80%	0.797	S	S	*	*			trans	-45.6	94.5	167.6	-64.2	160.1	0	0	0	107.5	S392	I390-S392 PolarHBondContact O-N 2.86Å
391	L	24.6	Very low	25.4	Very low	161 Å²	161	149.3 Å²	149.3	84%	0.843	77%	0.773	S	S	*	*			trans	-74	99.6	171.8	-84.7	165.1	0	0	0	106.3	N389 R393	N389-L391 VanDerWaalsContact C-N 3.29Å; N389-L391 PolarHBondContact O-N 2.95Å; L391-R393 PolarHBondContact O-N 3.14Å
392	S	23.3	Very low	26.9	Very low	92 Å²	92	141.5 Å²	141.5	64%	0.643	75%	0.753	S	S	*	*			trans	-34.2	120.9	158.4	43.1	0	0	0	0	109.7	I390 K394	I390-S392 PolarHBondContact O-N 2.86Å; S392-K394 PolarHBondContact O-N 3.33Å
393	R	23	Very low	29.4	Very low	244 Å²	244	140 Å²	140	92%	0.921	74%	0.738	S	S	*	*			trans	-51.3	87.2	169.7	-171.6	-179.8	-158.3	165.7	4.7	108.5	L391 Q395	L391-R393 PolarHBondContact O-N 3.14Å; R393-Q395 PolarHBondContact O-N 2.89Å; R393-Q395 VanDerWaalsContact O-N 3.1Å
394	K	23.4	Very low	32.4	Very low	187 Å²	187	137.2 Å²	137.2	81%	0.813	73%	0.728	S	S	*	*			trans	-57.8	115.7	168	-82.5	-178.3	174.4	179.3	0	106.3	S392 M396	S392-K394 PolarHBondContact O-N 3.33Å; K394-M396 PolarHBondContact O-N 3.35Å; K394-M396 VanDerWaalsContact O-N 3.15Å
395	Q	23.5	Very low	35.5	Very low	165 Å²	165	130 Å²	130	77%	0.771	69%	0.689	S	S	*	*			trans	-45.8	120.6	163.4	-81.6	167.7	-35.8	0	0	107.5	R393 T397	R393-Q395 PolarHBondContact O-N 2.89Å; R393-Q395 VanDerWaalsContact O-N 3.1Å; Q395-T397 PolarHBondContact O-N 3.15Å
396	M	21.1	Very low	38.4	Very low	194 Å²	194	129.7 Å²	129.7	96%	0.956	67%	0.673	S	S	*	*			trans	-62.6	106.1	169.4	-86.1	177.7	157.7	0	0	107.6	K394	K394-M396 PolarHBondContact O-N 3.35Å; K394-M396 VanDerWaalsContact O-N 3.15Å
397	T	23.3	Very low	41.5	Very low	132 Å²	132	123 Å²	123	81%	0.81	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-75.6	117.7	165	-21.9	0	0	0	0	107.3	Q395	Q395-T397 PolarHBondContact O-N 3.15Å
398	E	30.1	Very low	44.4	Very low	166 Å²	166	116.9 Å²	116.9	78%	0.776	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-56.6	131.3	169.5	-72.6	-176	159.6	0	0	109.3	E400	E398-E400 PolarHBondContact O-N 3.42Å
399	P	32.9	Very low	47.5	Very low	92 Å²	92	109.5 Å²	109.5	60%	0.597	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-75	122.7	176.8	28	-29.1	0	0	0	110.2	M322	M322-P399 VanDerWaalsContact CE-CD 3.46Å; M322-P399 HydrophobicContact CE-CG 3.23Å
400	E	41.2	Very low	50.5	Low	105 Å²	105	109.3 Å²	109.3	49%	0.491	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-77.3	129.5	-176.1	-60.6	-166.4	144.8	0	0	111.2	S306 K308 E398 G402	S306-E400 VanDerWaalsContact CB-CD 3.41Å; S306-E400 WeakPolarHBondContact CB-OE1 3.48Å; S306-E400 VanDerWaalsContact CB-OE2 3.29Å; S306-E400 WeakPolarHBondContact CB-OE2 3.45Å; K308-E400 WeakPolarHBondContact CE-OE1 3.43Å; K308-E400 IonicContact NZ-OE1 3.75Å; E398-E400 PolarHBondContact O-N 3.42Å; E400-G402 PolarHBondContact O-N 3.24Å
401	P	50.1	Low	53.7	Low	52 Å²	52	103.3 Å²	103.3	34%	0.338	57%	0.565	S	S	.	*			trans	-70.2	86.9	165.9	28.3	-30.8	0	0	0	108.2	C307 I413	C307-P401 HydrophobicContact CB-CG 3.83Å; P401-I413 HydrophobicContact CB-CG2 4.38Å; P401-I413 HydrophobicContact CG-CG2 4.39Å
402	G	52.9	Low	56.7	Low	49 Å²	49	99.2 Å²	99.2	51%	0.505	54%	0.54	S	S	.	.			trans	-122.4	141.2	176.8	0	0	0	0	0	111.4	L304 E400	L304-G402 CarbonylContact O-C 3.42Å; L304-G402 WeakPolarHBondContact O-CA 3.35Å; E400-G402 PolarHBondContact O-N 3.24Å
403	G	74	Confident	59.8	Low	35 Å²	35	95 Å²	95	36%	0.361	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	179.9	152.2	-177	0	0	0	0	0	113.5	L304 V405	L304-G403 PolarHBondContact N-O 2.97Å; L304-G403 VanDerWaalsContact N-O 3.09Å; L304-G403 PolarHBondContact O-N 3.37Å; G403-V405 PolarHBondContact O-N 2.67Å
404	L	82.4	Confident	62.9	Low	115 Å²	115	84.1 Å²	84.1	60%	0.602	47%	0.471	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-67.8	121.3	176.4	-167.2	72	0	0	0	110	P301 N303 P406	P301-L404 HydrophobicContact CB-CD1 3.92Å; P301-L404 HydrophobicContact CB-CD2 4.31Å; P301-L404 HydrophobicContact CB-CG 4.11Å; N303-L404 HydrophobicContact CB-CD1 4.15Å; L404-P406 VanDerWaalsContact O-CD 3.27Å; L404-P406 WeakPolarHBondContact O-CD 3.34Å
405	V	84.7	Confident	66.1	Low	3 Å²	3	75.2 Å²	75.2	2%	0.018	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	101	170.8	-167.8	0	0	0	0	107.8	N296 P301 Q302 G403 G409 T411	N296-V405 HydrophobicContact CB-CB 4.35Å; N296-V405 HydrophobicContact CB-CG1 3.62Å; N296-V405 PolarHBondContact ND2-O 2.85Å; P301-V405 WeakPolarHBondContact CA-O 3.48Å; Q302-V405 PolarHBondContact N-O 3.44Å; Q302-V405 WeakPolarHBondContact O-CA 3.49Å; Q302-V405 WeakPolarHBondContact O-CB 3.11Å; Q302-V405 PolarHBondContact O-N 3.47Å; G403-V405 PolarHBondContact O-N 2.67Å; V405-G409 WeakPolarHBondContact CG1-O 3.22Å; V405-T411 HydrophobicContact CG2-CG2 3.65Å
406	P	85.7	Confident	69.2	Low	69 Å²	69	68.1 Å²	68.1	45%	0.448	40%	0.4	S	S	.	.			trans	-63.8	161.4	-178.8	27.3	-33.8	0	0	0	111.2	N296 L404 G408 G409	N296-P406 WeakPolarHBondContact CB-O 3.34Å; N296-P406 PolarHBondContact ND2-O 2.89Å; L404-P406 VanDerWaalsContact O-CD 3.27Å; L404-P406 WeakPolarHBondContact O-CD 3.34Å; P406-G408 PolarHBondContact O-N 3.28Å; P406-G409 WeakPolarHBondContact O-CA 3.21Å; P406-G409 PolarHBondContact O-N 2.9Å
407	P	84.8	Confident	72.6	Confident	62 Å²	62	58.9 Å²	58.9	40%	0.403	35%	0.354	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.8	128.4	171.4	-26.8	36.7	0	0	0	111.2	G298 D299 G409	G298-P407 WeakPolarHBondContact O-CA 3.27Å; G298-P407 WeakPolarHBondContact O-CB 3.46Å; D299-P407 VanDerWaalsContact O-CG 3.22Å; D299-P407 WeakPolarHBondContact O-CG 3.23Å; P407-G409 PolarHBondContact O-N 3.32Å
408	G	84.5	Confident	75.7	Confident	55 Å²	55	53.8 Å²	53.8	57%	0.567	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	-0.1	-173.4	0	0	0	0	0	115.3	N296 P406	N296-G408 WeakPolarHBondContact O-CA 3.36Å; N296-G408 PolarHBondContact O-N 3.34Å; P406-G408 PolarHBondContact O-N 3.28Å
409	G	85.7	Confident	78.3	Confident	13 Å²	13	46 Å²	46	13%	0.134	29%	0.286	C	S	.	.			trans	-76.8	150.9	-178.8	0	0	0	0	0	113.2	E295 N296 V405 P406 P407	E295-G409 WeakPolarHBondContact CA-O 3.19Å; N296-G409 PolarHBondContact N-O 3.28Å; V405-G409 WeakPolarHBondContact CG1-O 3.22Å; P406-G409 WeakPolarHBondContact O-CA 3.21Å; P406-G409 PolarHBondContact O-N 2.9Å; P407-G409 PolarHBondContact O-N 3.32Å
410	K	87.2	Confident	80.6	Confident	131 Å²	131	46 Å²	46	57%	0.57	28%	0.277	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.6	134.4	173.4	-62.1	-175.8	-175.8	-154.4	0	109.8	W293 I294 E295	W293-K410 HydrophobicContact CE3-CB 4.38Å; I294-K410 WeakPolarHBondContact O-CA 3.2Å; E295-K410 HydrophobicContact CB-CG 4.12Å; E295-K410 HydrophobicContact CG-CG 3.9Å; E295-K410 WeakPolarHBondContact OE1-CE 3.44Å; E295-K410 IonicContact OE1-NZ 3.5Å; E295-K410 VanDerWaalsContact OE2-CE 3.23Å; E295-K410 WeakPolarHBondContact OE2-CE 3.43Å; E295-K410 IonicContact OE2-NZ 2.8Å; E295-K410 PolarHBondContact OE2-NZ 3.45Å; E295-K410 VanDerWaalsContact OE2-NZ 3.16Å
411	T	88.9	Confident	82.3	Confident	48 Å²	48	44 Å²	44	29%	0.294	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	167.9	165.4	-168.6	0	0	0	0	109.2	I294 V405	I294-T411 HydrophobicContact CB-CG2 3.71Å; I294-T411 HydrophobicContact CD1-CG2 4.22Å; I294-T411 HydrophobicContact CG1-CG2 4.46Å; I294-T411 HydrophobicContact CG2-CG2 4.08Å; I294-T411 PolarHBondContact N-O 2.98Å; I294-T411 PolarHBondContact O-N 2.88Å; I294-T411 VanDerWaalsContact O-O 3.12Å; V405-T411 HydrophobicContact CG2-CG2 3.65Å
412	F	87.7	Confident	83.7	Confident	74 Å²	74	42.3 Å²	42.3	33%	0.325	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	153.6	177.6	65.1	-88.5	0	0	0	110.9	V291 I292 W293 L323 V414	V291-F412 HydrophobicContact CG1-CB 3.76Å; V291-F412 HydrophobicContact CG1-CD2 3.84Å; V291-F412 HydrophobicContact CG1-CG 4.02Å; I292-F412 VanDerWaalsContact O-CA 3.25Å; I292-F412 WeakPolarHBondContact O-CA 3.47Å; W293-F412 HydrophobicContact CD2-CB 4.01Å; W293-F412 HydrophobicContact CE3-CB 3.79Å; W293-F412 HydrophobicContact CE3-CD1 4.31Å; W293-F412 HydrophobicContact CE3-CG 4.46Å; W293-F412 HydrophobicContact CH2-CB 4.47Å; W293-F412 AromaticContact CH2-CD1 3.88Å; W293-F412 HydrophobicContact CH2-CD1 3.88Å; W293-F412 HydrophobicContact CH2-CG 4.37Å; W293-F412 HydrophobicContact CZ3-CB 4.04Å; W293-F412 AromaticContact CZ3-CD1 3.69Å; W293-F412 HydrophobicContact CZ3-CD1 3.69Å; W293-F412 HydrophobicContact CZ3-CG 4.22Å; L323-F412 HydrophobicContact CD1-CE2 4.36Å; L323-F412 HydrophobicContact CD2-CE2 4.32Å; L323-F412 HydrophobicContact CD2-CZ 4.28Å; F412-V414 HydrophobicContact CD2-CG2 3.72Å; F412-V414 HydrophobicContact CE2-CG2 3.76Å
413	I	88.6	Confident	84.8	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	147.7	167.9	60.1	175.4	0	0	0	108.6	I292 I294 F320 P401 L429 L431	I292-I413 HydrophobicContact CB-CD1 4.22Å; I292-I413 HydrophobicContact CB-CG1 3.72Å; I292-I413 HydrophobicContact CD1-CD1 4.2Å; I292-I413 HydrophobicContact CD1-CG1 4.39Å; I292-I413 HydrophobicContact CG2-CD1 4.44Å; I292-I413 HydrophobicContact CG2-CG1 4.3Å; I292-I413 PolarHBondContact N-O 2.81Å; I292-I413 PolarHBondContact O-N 3.35Å; I294-I413 HydrophobicContact CD1-CG2 4.46Å; F320-I413 HydrophobicContact CE1-CD1 4.34Å; P401-I413 HydrophobicContact CB-CG2 4.38Å; P401-I413 HydrophobicContact CG-CG2 4.39Å; I413-L429 HydrophobicContact CD1-CD1 3.89Å; I413-L429 HydrophobicContact CD1-CD2 3.45Å; I413-L429 VanDerWaalsContact CD1-CD2 3.45Å; I413-L429 HydrophobicContact CD1-CG 4.26Å; I413-L431 HydrophobicContact CD1-CD2 3.82Å
414	V	88.2	Confident	85.2	Confident	16 Å²	16	43 Å²	43	10%	0.097	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	121.2	179.9	-172.8	0	0	0	0	108.8	T289 V291 Q321 F412	T289-V414 HydrophobicContact CG2-CG1 3.19Å; V291-V414 HydrophobicContact CG2-CG1 4.5Å; V291-V414 HydrophobicContact CG2-CG2 4.21Å; Q321-V414 HydrophobicContact CB-CB 3.99Å; Q321-V414 HydrophobicContact CB-CG1 3.98Å; Q321-V414 PolarHBondContact N-O 3.22Å; F412-V414 HydrophobicContact CD2-CG2 3.72Å; F412-V414 HydrophobicContact CE2-CG2 3.76Å
415	V	90.2	Very high	85.1	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	128.8	-179.6	-174.9	0	0	0	0	109.1	F279 T289 M290 I292 F318 F320 L442	F279-V415 HydrophobicContact CZ-CB 4.19Å; F279-V415 HydrophobicContact CZ-CG1 4.06Å; T289-V415 WeakPolarHBondContact CA-O 3.35Å; M290-V415 PolarHBondContact N-O 3.19Å; M290-V415 PolarHBondContact O-N 3.07Å; I292-V415 HydrophobicContact CD1-CG2 3.86Å; F318-V415 HydrophobicContact CB-CG1 4.48Å; F318-V415 HydrophobicContact CD1-CG1 4.37Å; F320-V415 HydrophobicContact CD1-CG2 4.15Å; F320-V415 HydrophobicContact CE1-CG2 4.15Å; V415-L442 HydrophobicContact CG1-CD1 3.86Å; V415-L442 HydrophobicContact CG2-CD1 4.47Å
416	I	89.7	Confident	85	Confident	16 Å²	16	39.3 Å²	39.3	8%	0.082	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	133.8	174.7	-56.1	172.9	0	0	0	108	T289 F318 R319 Q321	T289-I416 HydrophobicContact CG2-CG1 4.17Å; F318-I416 CarbonylContact C-O 3.54Å; F318-I416 WeakPolarHBondContact CA-O 3.31Å; R319-I416 HydrophobicContact CG-CB 4.03Å; R319-I416 PolarHBondContact N-O 2.95Å; R319-I416 PolarHBondContact O-N 3.16Å; Q321-I416 HydrophobicContact CB-CD1 3.82Å; Q321-I416 HydrophobicContact CB-CG1 4.13Å; Q321-I416 HydrophobicContact CG-CD1 4Å
417	C	91	Very high	84.9	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	117.3	171.6	-175.4	0	0	0	0	109.6	F279 S287 K288 Q317 F318	F279-C417 HydrophobicContact CD1-CB 3.7Å; F279-C417 HydrophobicContact CD2-CB 4.25Å; F279-C417 HydrophobicContact CE1-CB 3.65Å; F279-C417 HydrophobicContact CE2-CB 4.21Å; F279-C417 HydrophobicContact CG-CB 4.01Å; F279-C417 HydrophobicContact CZ-CB 3.91Å; S287-C417 CarbonylContact C-O 3.53Å; S287-C417 WeakPolarHBondContact CA-O 3.33Å; K288-C417 PolarHBondContact N-O 3.07Å; K288-C417 PolarHBondContact O-N 2.81Å; Q317-C417 CarbonylContact O-C 3.56Å; Q317-C417 VanDerWaalsContact O-CA 3.26Å; Q317-C417 WeakPolarHBondContact O-CA 3.33Å; F318-C417 HydrophobicContact CD1-CB 4.01Å; F318-C417 HydrophobicContact CE1-CB 4Å
418	D	88.5	Confident	85	Confident	25 Å²	25	34 Å²	34	13%	0.134	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	112.3	173.9	-61.8	-40.4	0	0	0	109.3	S287 Q317 R319 K420	S287-D418 VanDerWaalsContact CB-OD1 3.22Å; S287-D418 WeakPolarHBondContact CB-OD1 3.22Å; S287-D418 PolarHBondContact OG-OD1 3.07Å; Q317-D418 WeakPolarHBondContact CB-O 3.39Å; Q317-D418 WeakPolarHBondContact CG-O 3.38Å; Q317-D418 PolarHBondContact O-N 3.32Å; R319-D418 IonicContact CZ-OD2 3.75Å; R319-D418 IonicContact NE-OD2 3.97Å; R319-D418 PolarHBondContact NE-OD2 3.31Å; R319-D418 IonicContact NH2-OD1 3.87Å; R319-D418 IonicContact NH2-OD2 3.68Å; D418-K420 HydrophobicContact CB-CG 4.48Å; D418-K420 PolarHBondContact O-N 3.37Å
419	G	85.2	Confident	85.2	Confident	2 Å²	2	31.3 Å²	31.3	2%	0.021	15%	0.153	C	C	.	.			trans	-71.9	93.9	-177.9	0	0	0	0	0	112.2	E284 G285 R286	E284-G419 CarbonylContact C-O 3.59Å; E284-G419 WeakPolarHBondContact CA-O 3.06Å; G285-G419 PolarHBondContact N-O 3.15Å; R286-G419 PolarHBondContact O-N 3.05Å
420	K	81.9	Confident	85.3	Confident	93 Å²	93	32.4 Å²	32.4	40%	0.404	16%	0.155	S	C	.	.			trans	-102.5	-42.6	-176.4	-65	172.8	-178.1	166.6	0	113.2	S315 K316 Q317 D418	S315-K420 WeakPolarHBondContact O-CD 3.31Å; S315-K420 PolarHBondContact O-NZ 3.27Å; S315-K420 VanDerWaalsContact O-NZ 3.1Å; K316-K420 PolarHBondContact O-NZ 3.02Å; Q317-K420 HydrophobicContact CG-CB 4.08Å; Q317-K420 HydrophobicContact CG-CD 4.26Å; Q317-K420 HydrophobicContact CG-CG 4.34Å; D418-K420 HydrophobicContact CB-CG 4.48Å; D418-K420 PolarHBondContact O-N 3.37Å
421	N	76.9	Confident	85.4	Confident	62 Å²	62	26.2 Å²	26.2	33%	0.332	13%	0.128	S	C	.	.	S	Bend	trans	-112.9	130.7	-177.1	-74.2	-18.9	0	0	0	110	S315 V446	S315-N421 WeakPolarHBondContact CB-ND2 3.43Å; S315-N421 PolarHBondContact OG-ND2 3.15Å; N421-V446 VanDerWaalsContact O-CB 3.25Å; N421-V446 WeakPolarHBondContact O-CB 3.17Å
422	P	78.2	Confident	85.3	Confident	17 Å²	17	25 Å²	25	11%	0.11	12%	0.121	C	C	.	.	S	Bend	trans	-66.7	152.1	178.1	26.7	-33.3	0	0	0	112.7	V446 E451	P422-V446 WeakPolarHBondContact CA-O 3.33Å; P422-E451 WeakPolarHBondContact CB-OE1 3.44Å
423	G	77.4	Confident	85.4	Confident	3 Å²	3	21.9 Å²	21.9	3%	0.031	11%	0.108	C	C	.	.	E	Extended strand (participates in β ladder)	trans	99.8	-174.2	-176.9	0	0	0	0	0	114.1	V446	G423-V446 PolarHBondContact N-O 3.17Å; G423-V446 PolarHBondContact O-N 2.87Å
424	R	81.6	Confident	85	Confident	95 Å²	95	25.1 Å²	25.1	36%	0.358	13%	0.131	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	126.7	178	-168.2	179.8	-176.4	178.1	2.7	110.1	E443 V444 R1022	R424-E443 IonicContact CZ-OE2 2.79Å; R424-E443 IonicContact NE-OE2 2.91Å; R424-E443 IonicContact NH2-OE1 3.93Å; R424-E443 IonicContact NH2-OE2 3.81Å; R424-E443 PolarHBondContact NH2-OE2 3.3Å; R424-V444 CarbonylContact C-O 3.54Å; R424-V444 WeakPolarHBondContact CA-O 3.44Å; R424-R1022 HydrophobicContact CB-CB 3.94Å; R424-R1022 WeakPolarHBondContact CB-O 3.49Å; R424-R1022 PolarHBondContact N-O 2.9Å; R424-R1022 WeakPolarHBondContact O-CB 3.36Å
425	C	80.6	Confident	84.7	Confident	11 Å²	11	31.1 Å²	31.1	7%	0.074	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.5	174	-174.4	0	0	0	0	109.7	D313 Q317 E443 V444	D313-C425 VanDerWaalsContact CG-SG 3.54Å; Q317-C425 VanDerWaalsContact NE2-CB 3.31Å; Q317-C425 PolarHBondContact NE2-SG 2.92Å; C425-E443 WeakPolarHBondContact O-CA 3.46Å; C425-V444 HydrophobicContact CB-CG1 3.83Å; C425-V444 PolarHBondContact N-O 3.43Å; C425-V444 PolarHBondContact O-N 3.3Å
426	K	81.9	Confident	84.6	Confident	30 Å²	30	32.6 Å²	32.6	13%	0.13	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	138.3	-179.7	-174.5	166.7	-178	143.7	0	110	Y441 L442 E443 R1022	K426-Y441 HydrophobicContact CD-CD1 4.35Å; K426-Y441 VanDerWaalsContact CE-CE1 3.5Å; K426-Y441 HydrophobicContact CG-CD1 4.43Å; K426-Y441 VanDerWaalsContact NZ-CD2 3.34Å; K426-L442 CarbonylContact C-O 3.53Å; K426-L442 WeakPolarHBondContact CA-O 3.19Å; K426-E443 HydrophobicContact CB-CG 4.3Å; K426-E443 HydrophobicContact CD-CG 4.15Å; K426-E443 WeakPolarHBondContact CE-OE1 3.39Å; K426-E443 HydrophobicContact CG-CG 3.91Å; K426-E443 IonicContact NZ-OE1 3.16Å; K426-E443 PolarHBondContact NZ-OE1 3.07Å; K426-R1022 VanDerWaalsContact CB-NH1 3.33Å
427	E	85	Confident	84.4	Confident	4 Å²	4	35.3 Å²	35.3	2%	0.019	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	155.1	175.1	-177.7	57.5	-91.4	0	0	109.7	L309 A310 G311 W312 D313 F318 Y441 L442	L309-E427 HydrophobicContact CB-CG 4.16Å; L309-E427 HydrophobicContact CD2-CG 3.97Å; L309-E427 HydrophobicContact CG-CG 4.48Å; A310-E427 PolarHBondContact N-OE1 3.23Å; G311-E427 WeakPolarHBondContact CA-OE2 3.39Å; G311-E427 PolarHBondContact N-OE1 3.41Å; G311-E427 VanDerWaalsContact N-OE1 3.1Å; G311-E427 PolarHBondContact N-OE2 3.25Å; W312-E427 WeakPolarHBondContact CB-OE1 3.41Å; W312-E427 VanDerWaalsContact N-CD 3.33Å; W312-E427 PolarHBondContact N-OE1 2.93Å; W312-E427 PolarHBondContact N-OE2 3Å; D313-E427 HydrophobicContact CB-CB 4.49Å; D313-E427 PolarHBondContact N-OE2 3.45Å; F318-E427 HydrophobicContact CB-CG 4.43Å; F318-E427 HydrophobicContact CD2-CB 3.48Å; F318-E427 VanDerWaalsContact CD2-CB 3.48Å; F318-E427 HydrophobicContact CD2-CG 4.07Å; F318-E427 HydrophobicContact CE2-CB 3.68Å; F318-E427 HydrophobicContact CG-CB 4.07Å; F318-E427 HydrophobicContact CG-CG 4.4Å; F318-E427 HydrophobicContact CZ-CB 4.41Å; E427-Y441 CarbonylContact O-C 3.57Å; E427-Y441 WeakPolarHBondContact O-CA 3.19Å; E427-L442 HydrophobicContact CB-CB 4.34Å; E427-L442 PolarHBondContact N-O 3.36Å; E427-L442 PolarHBondContact O-N 3.31Å
428	L	86.2	Confident	84.2	Confident	14 Å²	14	35.3 Å²	35.3	7%	0.073	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	112.6	174.6	177.1	65.8	0	0	0	109.6	L264 L265 A310 W312 L430 Y441	L264-L428 HydrophobicContact CD2-CD2 4.11Å; L265-L428 HydrophobicContact CD2-CD1 4.34Å; A310-L428 HydrophobicContact CB-CB 3.79Å; A310-L428 HydrophobicContact CB-CD2 4.23Å; A310-L428 HydrophobicContact CB-CG 4.25Å; A310-L428 WeakPolarHBondContact CB-O 3.21Å; A310-L428 PolarHBondContact N-O 3.17Å; W312-L428 HydrophobicContact CD2-CB 4.04Å; W312-L428 HydrophobicContact CE3-CB 4.28Å; W312-L428 HydrophobicContact CH2-CB 4.36Å; W312-L428 HydrophobicContact CH2-CD2 4.34Å; W312-L428 HydrophobicContact CZ2-CB 4.12Å; W312-L428 HydrophobicContact CZ2-CD2 3.79Å; W312-L428 HydrophobicContact CZ3-CB 4.43Å; L428-L430 HydrophobicContact CD2-CD2 3.92Å; L428-L430 HydrophobicContact CG-CD2 4Å; L428-L430 HydrophobicContact CG-CG 4.38Å; L428-Y441 HydrophobicContact CD1-CD1 3.96Å; L428-Y441 HydrophobicContact CD1-CE1 3.98Å
429	L	88.8	Confident	84.2	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	126.1	167.6	168.3	68.1	0	0	0	109.3	I292 L309 F320 I413 L431 G439 R440 L442	I292-L429 HydrophobicContact CD1-CD2 3.52Å; L309-L429 HydrophobicContact CD2-CB 4.39Å; L309-L429 HydrophobicContact CD2-CD1 4.32Å; F320-L429 HydrophobicContact CE1-CD1 3.71Å; F320-L429 HydrophobicContact CZ-CD1 3.65Å; I413-L429 HydrophobicContact CD1-CD1 3.89Å; I413-L429 HydrophobicContact CD1-CD2 3.45Å; I413-L429 VanDerWaalsContact CD1-CD2 3.45Å; I413-L429 HydrophobicContact CD1-CG 4.26Å; L429-L431 HydrophobicContact CD1-CD2 4.22Å; L429-L431 HydrophobicContact CD2-CD2 4.23Å; L429-L431 HydrophobicContact CG-CD2 4.22Å; L429-L431 HydrophobicContact CG-CG 4.4Å; L429-G439 CarbonylContact O-C 3.58Å; L429-G439 VanDerWaalsContact O-CA 3.24Å; L429-G439 WeakPolarHBondContact O-CA 3.37Å; L429-R440 HydrophobicContact CB-CB 4.37Å; L429-R440 WeakPolarHBondContact CB-O 3.25Å; L429-R440 HydrophobicContact CD2-CB 4.25Å; L429-R440 PolarHBondContact N-O 3.08Å; L429-R440 PolarHBondContact O-N 3.1Å; L429-L442 HydrophobicContact CB-CD1 4.12Å; L429-L442 HydrophobicContact CB-CG 4.14Å
430	L	87.5	Confident	84.3	Confident	36 Å²	36	34.5 Å²	34.5	19%	0.188	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	121.8	174.7	-62.7	174.2	0	0	0	109.7	L264 C307 K308 A310 L428 L437	L264-L430 HydrophobicContact CD1-CD2 4.25Å; L264-L430 HydrophobicContact CD2-CD2 4.06Å; C307-L430 CarbonylContact C-O 3.6Å; C307-L430 WeakPolarHBondContact CA-O 3.49Å; K308-L430 PolarHBondContact N-O 2.87Å; K308-L430 PolarHBondContact O-N 2.85Å; A310-L430 HydrophobicContact CB-CD1 4.41Å; L428-L430 HydrophobicContact CD2-CD2 3.92Å; L428-L430 HydrophobicContact CG-CD2 4Å; L428-L430 HydrophobicContact CG-CG 4.38Å; L430-L437 HydrophobicContact CB-CD2 4.38Å; L430-L437 HydrophobicContact CD2-CD2 4.29Å
431	L	89	Confident	84.4	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	107.9	172.5	-56.7	172.9	0	0	0	107.8	V273 I294 L304 C307 I413 L429 F433 L437 I438	V273-L431 HydrophobicContact CB-CD1 4.33Å; V273-L431 HydrophobicContact CG1-CD1 3.8Å; V273-L431 HydrophobicContact CG2-CD1 3.63Å; I294-L431 HydrophobicContact CD1-CD1 3.88Å; I294-L431 HydrophobicContact CD1-CD2 3.84Å; I294-L431 HydrophobicContact CD1-CG 4.46Å; I294-L431 HydrophobicContact CG1-CD1 4.16Å; L304-L431 HydrophobicContact CD1-CB 4.03Å; L304-L431 HydrophobicContact CD1-CD2 4.41Å; C307-L431 HydrophobicContact CB-CD2 4.31Å; C307-L431 VanDerWaalsContact SG-CD2 3.54Å; I413-L431 HydrophobicContact CD1-CD2 3.82Å; L429-L431 HydrophobicContact CD1-CD2 4.22Å; L429-L431 HydrophobicContact CD2-CD2 4.23Å; L429-L431 HydrophobicContact CG-CD2 4.22Å; L429-L431 HydrophobicContact CG-CG 4.4Å; L431-F433 HydrophobicContact CB-CE2 3.89Å; L431-L437 WeakPolarHBondContact O-CA 3.08Å; L431-I438 HydrophobicContact CB-CB 4.32Å; L431-I438 WeakPolarHBondContact CB-O 3.08Å; L431-I438 HydrophobicContact CD1-CG2 4.41Å; L431-I438 PolarHBondContact N-O 3.41Å; L431-I438 PolarHBondContact O-N 3.38Å
432	C	87.7	Confident	84.9	Confident	22 Å²	22	30.5 Å²	30.5	15%	0.149	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	108.9	-177	-58.3	0	0	0	0	109.3	V305 S306	V305-C432 WeakPolarHBondContact CA-O 3.42Å; V305-C432 WeakPolarHBondContact CB-O 3.21Å; V305-C432 PolarHBondContact N-O 3.28Å; S306-C432 PolarHBondContact N-O 2.77Å; S306-C432 WeakPolarHBondContact O-CB 3.35Å; S306-C432 PolarHBondContact O-N 2.94Å; S306-C432 WeakPolarHBondContact OG-CB 3.19Å
433	F	88.3	Confident	85.3	Confident	10 Å²	10	31 Å²	31	4%	0.044	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	165.8	167.9	-63.5	-94.2	0	0	0	109.9	I271 I294 Q302 N303 L304 L431 D435 F436 I438	I271-F433 HydrophobicContact CB-CZ 4.39Å; I271-F433 HydrophobicContact CD1-CE1 4.06Å; I271-F433 HydrophobicContact CD1-CZ 4.41Å; I271-F433 HydrophobicContact CG1-CE1 4.04Å; I271-F433 HydrophobicContact CG1-CZ 4.16Å; I271-F433 HydrophobicContact CG2-CE1 4.35Å; I271-F433 HydrophobicContact CG2-CE2 4.2Å; I271-F433 HydrophobicContact CG2-CZ 3.69Å; I294-F433 HydrophobicContact CG2-CZ 3.96Å; Q302-F433 HydrophobicContact CB-CD1 3.98Å; Q302-F433 HydrophobicContact CB-CE1 4.24Å; N303-F433 VanDerWaalsContact O-CA 3.26Å; N303-F433 WeakPolarHBondContact O-CA 3.21Å; L304-F433 HydrophobicContact CB-CD1 4.32Å; L304-F433 HydrophobicContact CB-CE1 3.97Å; L304-F433 HydrophobicContact CB-CZ 4.47Å; L304-F433 HydrophobicContact CD1-CD1 4.46Å; L304-F433 HydrophobicContact CD1-CD2 4.37Å; L304-F433 HydrophobicContact CD1-CE1 4.08Å; L304-F433 HydrophobicContact CD1-CE2 3.98Å; L304-F433 HydrophobicContact CD1-CZ 3.82Å; L431-F433 HydrophobicContact CB-CE2 3.89Å; F433-D435 VanDerWaalsContact C-N 3.25Å; F433-D435 PolarHBondContact O-N 3.42Å; F433-F436 WeakPolarHBondContact CA-O 3.23Å; F433-F436 HydrophobicContact CB-CD1 4.46Å; F433-F436 HydrophobicContact CB-CD2 3.99Å; F433-F436 HydrophobicContact CB-CE1 4.25Å; F433-F436 HydrophobicContact CB-CE2 3.77Å; F433-F436 HydrophobicContact CB-CG 4.34Å; F433-F436 HydrophobicContact CB-CZ 3.9Å; F433-F436 WeakPolarHBondContact CB-O 3.49Å; F433-F436 HydrophobicContact CD1-CE2 4.35Å; F433-F436 HydrophobicContact CD1-CZ 4.31Å; F433-F436 AromaticContact CD2-CD2 3.88Å; F433-F436 HydrophobicContact CD2-CD2 3.88Å; F433-F436 AromaticContact CD2-CE2 3.39Å; F433-F436 HydrophobicContact CD2-CE2 3.39Å; F433-F436 HydrophobicContact CD2-CZ 4.15Å; F433-F436 HydrophobicContact CE2-CE2 4.08Å; F433-F436 HydrophobicContact CG-CD2 4.16Å; F433-F436 AromaticContact CG-CE2 3.56Å; F433-F436 HydrophobicContact CG-CE2 3.56Å; F433-F436 AromaticContact CG-CZ 3.85Å; F433-F436 HydrophobicContact CG-CZ 3.85Å; F433-F436 PolarHBondContact N-O 2.89Å; F433-I438 HydrophobicContact CD2-CD1 4.42Å; F433-I438 HydrophobicContact CE2-CB 4.49Å; F433-I438 HydrophobicContact CE2-CD1 3.95Å; F433-I438 HydrophobicContact CE2-CG1 4.34Å
434	S	81.7	Confident	85.8	Confident	72 Å²	72	30.8 Å²	30.8	50%	0.503	16%	0.155	S	C	.	.	S	Bend	trans	-52	-42.7	-179.6	-61.9	0	0	0	0	113.3	N303	N303-S434 PolarHBondContact O-N 3Å
435	D	80.8	Confident	86	Confident	141 Å²	141	27.8 Å²	27.8	75%	0.754	15%	0.146	S	C	*	.	S	Bend	trans	-109.7	-10.9	-170.8	-57.4	-28.5	0	0	0	113.4	F433	F433-D435 VanDerWaalsContact C-N 3.25Å; F433-D435 PolarHBondContact O-N 3.42Å
436	F	87.6	Confident	86.1	Confident	32 Å²	32	27.2 Å²	27.2	14%	0.14	14%	0.142	C	C	.	.			trans	-157.2	159.2	-175.1	57.5	-94.8	0	0	0	113.4	K268 I271 Q302 F433 I438	K268-F436 HydrophobicContact CB-CB 4.47Å; K268-F436 HydrophobicContact CB-CD2 3.59Å; K268-F436 HydrophobicContact CB-CE2 3.9Å; K268-F436 HydrophobicContact CB-CG 3.97Å; K268-F436 HydrophobicContact CD-CB 4.01Å; K268-F436 HydrophobicContact CD-CD2 4.25Å; K268-F436 HydrophobicContact CD-CG 4.37Å; K268-F436 WeakPolarHBondContact O-CE2 3.47Å; K268-F436 WeakPolarHBondContact O-CZ 3.36Å; I271-F436 HydrophobicContact CG1-CE2 4.39Å; I271-F436 HydrophobicContact CG1-CZ 4.02Å; Q302-F436 HydrophobicContact CG-CZ 4.42Å; F433-F436 WeakPolarHBondContact CA-O 3.23Å; F433-F436 HydrophobicContact CB-CD1 4.46Å; F433-F436 HydrophobicContact CB-CD2 3.99Å; F433-F436 HydrophobicContact CB-CE1 4.25Å; F433-F436 HydrophobicContact CB-CE2 3.77Å; F433-F436 HydrophobicContact CB-CG 4.34Å; F433-F436 HydrophobicContact CB-CZ 3.9Å; F433-F436 WeakPolarHBondContact CB-O 3.49Å; F433-F436 HydrophobicContact CD1-CE2 4.35Å; F433-F436 HydrophobicContact CD1-CZ 4.31Å; F433-F436 AromaticContact CD2-CD2 3.88Å; F433-F436 HydrophobicContact CD2-CD2 3.88Å; F433-F436 AromaticContact CD2-CE2 3.39Å; F433-F436 HydrophobicContact CD2-CE2 3.39Å; F433-F436 HydrophobicContact CD2-CZ 4.15Å; F433-F436 HydrophobicContact CE2-CE2 4.08Å; F433-F436 HydrophobicContact CG-CD2 4.16Å; F433-F436 AromaticContact CG-CE2 3.56Å; F433-F436 HydrophobicContact CG-CE2 3.56Å; F433-F436 AromaticContact CG-CZ 3.85Å; F433-F436 HydrophobicContact CG-CZ 3.85Å; F433-F436 PolarHBondContact N-O 2.89Å; F436-I438 HydrophobicContact CD2-CD1 4.28Å; F436-I438 HydrophobicContact CD2-CG1 3.98Å; F436-I438 HydrophobicContact CE2-CD1 3.78Å; F436-I438 HydrophobicContact CE2-CG1 4Å
437	L	86.2	Confident	86.2	Confident	73 Å²	73	28.1 Å²	28.1	38%	0.382	15%	0.148	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.9	169.1	-85.7	92.9	0	0	0	112	L264 K268 L430 L431	L264-L437 HydrophobicContact CD1-CB 3.83Å; K268-L437 PolarHBondContact NZ-O 3.17Å; L430-L437 HydrophobicContact CB-CD2 4.38Å; L430-L437 HydrophobicContact CD2-CD2 4.29Å; L431-L437 WeakPolarHBondContact O-CA 3.08Å
438	I	87.5	Confident	86.1	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129	166.6	-62.8	176.2	0	0	0	108.9	L264 K268 I271 V273 L431 F433 F436	L264-I438 CarbonylContact O-C 3.57Å; K268-I438 HydrophobicContact CB-CD1 4.36Å; K268-I438 HydrophobicContact CB-CG1 4.2Å; I271-I438 HydrophobicContact CB-CD1 3.83Å; I271-I438 HydrophobicContact CG2-CD1 3.8Å; V273-I438 HydrophobicContact CG2-CD1 4.33Å; V273-I438 HydrophobicContact CG2-CG2 4.02Å; L431-I438 HydrophobicContact CB-CB 4.32Å; L431-I438 WeakPolarHBondContact CB-O 3.08Å; L431-I438 HydrophobicContact CD1-CG2 4.41Å; L431-I438 PolarHBondContact N-O 3.41Å; L431-I438 PolarHBondContact O-N 3.38Å; F433-I438 HydrophobicContact CD2-CD1 4.42Å; F433-I438 HydrophobicContact CE2-CB 4.49Å; F433-I438 HydrophobicContact CE2-CD1 3.95Å; F433-I438 HydrophobicContact CE2-CG1 4.34Å; F436-I438 HydrophobicContact CD2-CD1 4.28Å; F436-I438 HydrophobicContact CD2-CG1 3.98Å; F436-I438 HydrophobicContact CE2-CD1 3.78Å; F436-I438 HydrophobicContact CE2-CG1 4Å
439	G	87.4	Confident	85.8	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	148.8	174.7	0	0	0	0	0	112.7	L264 L265 L429	L264-G439 PolarHBondContact O-N 2.87Å; L265-G439 WeakPolarHBondContact CD2-O 3.36Å; L429-G439 CarbonylContact O-C 3.58Å; L429-G439 VanDerWaalsContact O-CA 3.24Å; L429-G439 WeakPolarHBondContact O-CA 3.37Å
440	R	87	Confident	85.5	Confident	10 Å²	10	33.4 Å²	33.4	4%	0.038	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	133.8	172.1	-76.3	-65.4	-178.5	-96.7	9.5	110.9	L265 N267 V273 T274 T277 L429	L265-R440 PolarHBondContact O-NH1 2.92Å; N267-R440 PolarHBondContact OD1-NH2 2.93Å; V273-R440 HydrophobicContact CB-CG 4.45Å; V273-R440 HydrophobicContact CG1-CG 3.8Å; V273-R440 PolarHBondContact O-NH2 3.35Å; T274-R440 PolarHBondContact O-NE 3.34Å; T277-R440 HydrophobicContact CG2-CB 4.24Å; L429-R440 HydrophobicContact CB-CB 4.37Å; L429-R440 WeakPolarHBondContact CB-O 3.25Å; L429-R440 HydrophobicContact CD2-CB 4.25Å; L429-R440 PolarHBondContact N-O 3.08Å; L429-R440 PolarHBondContact O-N 3.1Å
441	Y	85.3	Confident	85.3	Confident	71 Å²	71	32.6 Å²	32.6	28%	0.278	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	125.9	175.3	-68.7	-50.6	0	0	0	110.8	L265 T277 W312 K426 E427 L428	L265-Y441 HydrophobicContact CD1-CD2 4.14Å; L265-Y441 HydrophobicContact CD1-CE2 3.35Å; L265-Y441 HydrophobicContact CD2-CD2 4.1Å; L265-Y441 HydrophobicContact CD2-CE1 4.5Å; L265-Y441 HydrophobicContact CD2-CE2 3.94Å; L265-Y441 HydrophobicContact CD2-CG 4.47Å; L265-Y441 HydrophobicContact CG-CE2 4.28Å; T277-Y441 WeakPolarHBondContact CB-O 3.28Å; T277-Y441 PolarHBondContact OG1-O 3.32Å; W312-Y441 AromaticContact CH2-CE1 3.7Å; W312-Y441 HydrophobicContact CH2-CE1 3.7Å; W312-Y441 HydrophobicContact CZ3-CD1 4.18Å; W312-Y441 AromaticContact CZ3-CE1 3.62Å; W312-Y441 HydrophobicContact CZ3-CE1 3.62Å; K426-Y441 HydrophobicContact CD-CD1 4.35Å; K426-Y441 VanDerWaalsContact CE-CE1 3.5Å; K426-Y441 HydrophobicContact CG-CD1 4.43Å; K426-Y441 VanDerWaalsContact NZ-CD2 3.34Å; E427-Y441 CarbonylContact O-C 3.57Å; E427-Y441 WeakPolarHBondContact O-CA 3.19Å; L428-Y441 HydrophobicContact CD1-CD1 3.96Å; L428-Y441 HydrophobicContact CD1-CE1 3.98Å
442	L	87.5	Confident	84.9	Confident	0 Å²	0	36.4 Å²	36.4	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	129.9	168.1	-54.7	174	0	0	0	108.3	T277 I292 L309 F318 V415 K426 E427 L429	T277-L442 WeakPolarHBondContact O-CA 3.24Å; I292-L442 HydrophobicContact CD1-CD2 3.62Å; L309-L442 HydrophobicContact CD2-CD1 3.75Å; F318-L442 HydrophobicContact CD1-CB 4.06Å; F318-L442 HydrophobicContact CD1-CD1 4.07Å; F318-L442 HydrophobicContact CE1-CB 3.79Å; F318-L442 HydrophobicContact CG-CD1 4.43Å; F318-L442 HydrophobicContact CZ-CB 4.24Å; V415-L442 HydrophobicContact CG1-CD1 3.86Å; V415-L442 HydrophobicContact CG2-CD1 4.47Å; K426-L442 CarbonylContact C-O 3.53Å; K426-L442 WeakPolarHBondContact CA-O 3.19Å; E427-L442 HydrophobicContact CB-CB 4.34Å; E427-L442 PolarHBondContact N-O 3.36Å; E427-L442 PolarHBondContact O-N 3.31Å; L429-L442 HydrophobicContact CB-CD1 4.12Å; L429-L442 HydrophobicContact CB-CG 4.14Å
443	E	85.6	Confident	84.6	Confident	26 Å²	26	40.9 Å²	40.9	12%	0.121	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	140.5	-177.6	-69.8	-175.7	-174.1	0	0	111.6	T277 H278 F279 R424 C425 K426	T277-E443 PolarHBondContact O-N 2.99Å; H278-E443 CarbonylContact C-O 3.54Å; H278-E443 WeakPolarHBondContact CA-O 3.29Å; H278-E443 IonicContact CE1-OE2 2.74Å; H278-E443 WeakPolarHBondContact ND1-CB 3.33Å; H278-E443 IonicContact ND1-OE2 3.98Å; H278-E443 PolarHBondContact ND1-OE2 3.3Å; F279-E443 PolarHBondContact N-O 3.3Å; R424-E443 IonicContact CZ-OE2 2.79Å; R424-E443 IonicContact NE-OE2 2.91Å; R424-E443 IonicContact NH2-OE1 3.93Å; R424-E443 IonicContact NH2-OE2 3.81Å; R424-E443 PolarHBondContact NH2-OE2 3.3Å; C425-E443 WeakPolarHBondContact O-CA 3.46Å; K426-E443 HydrophobicContact CB-CG 4.3Å; K426-E443 HydrophobicContact CD-CG 4.15Å; K426-E443 WeakPolarHBondContact CE-OE1 3.39Å; K426-E443 HydrophobicContact CG-CG 3.91Å; K426-E443 IonicContact NZ-OE1 3.16Å; K426-E443 PolarHBondContact NZ-OE1 3.07Å
444	V	87.6	Confident	84.4	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	148.4	177.2	67.2	0	0	0	0	109.7	F279 L282 F318 R424 C425 V446	F279-V444 HydrophobicContact CB-CB 4.03Å; F279-V444 HydrophobicContact CB-CG2 3.89Å; L282-V444 HydrophobicContact CB-CG2 3.94Å; L282-V444 HydrophobicContact CD2-CG2 4.25Å; F318-V444 HydrophobicContact CE1-CG1 4.39Å; F318-V444 HydrophobicContact CE2-CG1 4.41Å; F318-V444 HydrophobicContact CZ-CB 4.25Å; F318-V444 HydrophobicContact CZ-CG1 3.71Å; R424-V444 CarbonylContact C-O 3.54Å; R424-V444 WeakPolarHBondContact CA-O 3.44Å; C425-V444 HydrophobicContact CB-CG1 3.83Å; C425-V444 PolarHBondContact N-O 3.43Å; C425-V444 PolarHBondContact O-N 3.3Å; V444-V446 HydrophobicContact CG1-CG2 4.21Å; V444-V446 HydrophobicContact CG2-CG2 4.22Å
445	N	86.3	Confident	84.5	Confident	31 Å²	31	39.3 Å²	39.3	17%	0.166	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	112.7	167.9	-175.2	38.8	0	0	0	109.3	G280 T281 L282	G280-N445 PolarHBondContact O-N 2.81Å; T281-N445 CarbonylContact C-O 3.57Å; T281-N445 VanDerWaalsContact CA-O 3.3Å; T281-N445 WeakPolarHBondContact CA-O 3.48Å; L282-N445 PolarHBondContact N-O 3.08Å
446	V	83.6	Confident	84.5	Confident	0 Å²	0	35 Å²	35	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.1	-179.4	-177.2	0	0	0	0	109.4	L282 E284 N421 P422 G423 V444	L282-V446 CarbonylContact O-C 2.9Å; L282-V446 VanDerWaalsContact O-CA 3.23Å; L282-V446 WeakPolarHBondContact O-CA 3.37Å; E284-V446 HydrophobicContact CB-CG1 4.12Å; N421-V446 VanDerWaalsContact O-CB 3.25Å; N421-V446 WeakPolarHBondContact O-CB 3.17Å; P422-V446 WeakPolarHBondContact CA-O 3.33Å; G423-V446 PolarHBondContact N-O 3.17Å; G423-V446 PolarHBondContact O-N 2.87Å; V444-V446 HydrophobicContact CG1-CG2 4.21Å; V444-V446 HydrophobicContact CG2-CG2 4.22Å
447	I	83.1	Confident	84.2	Confident	49 Å²	49	43.5 Å²	43.5	25%	0.251	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	126.3	178.8	-58.3	-178.5	0	0	0	109.5	T281 L282 K283 E284 E451	T281-I447 HydrophobicContact CG2-CD1 3.25Å; T281-I447 HydrophobicContact CG2-CG1 3.72Å; L282-I447 PolarHBondContact O-N 2.63Å; K283-I447 WeakPolarHBondContact CA-O 3.25Å; E284-I447 PolarHBondContact N-O 2.53Å; I447-E451 HydrophobicContact CG2-CB 3.97Å
448	S	82.8	Confident	83.8	Confident	1 Å²	1	45.2 Å²	45.2	1%	0.007	25%	0.245	C	C	.	.			trans	-78.2	160.6	174.3	62.3	0	0	0	0	113	E284 E450 E451	E284-S448 WeakPolarHBondContact OE2-CB 3.43Å; S448-E450 VanDerWaalsContact C-N 3.27Å; S448-E450 WeakPolarHBondContact CB-OE2 3.31Å; S448-E450 PolarHBondContact O-N 2.86Å; S448-E451 WeakPolarHBondContact CB-OE1 3.47Å; S448-E451 PolarHBondContact N-OE1 2.78Å; S448-E451 PolarHBondContact O-N 2.77Å; S448-E451 WeakPolarHBondContact OG-CB 3.07Å; S448-E451 WeakPolarHBondContact OG-CG 3.3Å; S448-E451 PolarHBondContact OG-N 3.14Å; S448-E451 PolarHBondContact OG-OE1 2.94Å
449	G	80	Confident	83.4	Confident	53 Å²	53	50.7 Å²	50.7	55%	0.546	28%	0.28	S	S	.	.	H	α-helix	trans	-63.9	-36.2	174.4	0	0	0	0	0	111.9	S452	G449-S452 WeakPolarHBondContact O-CB 3.11Å; G449-S452 PolarHBondContact O-N 3.21Å
450	E	82.2	Confident	82.9	Confident	75 Å²	75	52.9 Å²	52.9	35%	0.35	29%	0.29	S	S	.	.	H	α-helix	trans	-68.4	-34.2	178.7	-60.4	80.7	179.9	0	0	112.3	S448 S452 L453 V1041 L1044 L1079	S448-E450 VanDerWaalsContact C-N 3.27Å; S448-E450 WeakPolarHBondContact CB-OE2 3.31Å; S448-E450 PolarHBondContact O-N 2.86Å; E450-S452 PolarHBondContact O-N 2.89Å; E450-L453 WeakPolarHBondContact O-CB 3.3Å; E450-L453 PolarHBondContact O-N 2.77Å; E450-V1041 HydrophobicContact CB-CG1 4.11Å; E450-V1041 HydrophobicContact CB-CG2 3.66Å; E450-L1044 HydrophobicContact CG-CD2 4.48Å; E450-L1079 HydrophobicContact CB-CD2 4.41Å
451	E	83.5	Confident	81.9	Confident	19 Å²	19	55.3 Å²	55.3	9%	0.089	31%	0.308	C	S	.	.	H	α-helix	trans	-59.7	-34.3	172.8	-84	167.5	-108.7	0	0	112.1	P422 I447 S448 L453 I454 A455 P1037 V1041	P422-E451 WeakPolarHBondContact CB-OE1 3.44Å; I447-E451 HydrophobicContact CG2-CB 3.97Å; S448-E451 WeakPolarHBondContact CB-OE1 3.47Å; S448-E451 PolarHBondContact N-OE1 2.78Å; S448-E451 PolarHBondContact O-N 2.77Å; S448-E451 WeakPolarHBondContact OG-CB 3.07Å; S448-E451 WeakPolarHBondContact OG-CG 3.3Å; S448-E451 PolarHBondContact OG-N 3.14Å; S448-E451 PolarHBondContact OG-OE1 2.94Å; E451-L453 PolarHBondContact O-N 3.35Å; E451-I454 CarbonylContact O-C 3.38Å; E451-I454 PolarHBondContact O-N 2.76Å; E451-A455 PolarHBondContact O-N 3.26Å; E451-P1037 HydrophobicContact CB-CB 4.18Å; E451-P1037 HydrophobicContact CG-CB 3.73Å; E451-V1041 HydrophobicContact CB-CG2 4.5Å; E451-V1041 HydrophobicContact CG-CB 4.47Å; E451-V1041 HydrophobicContact CG-CG2 3.8Å
452	S	81	Confident	80.3	Confident	79 Å²	79	61.5 Å²	61.5	55%	0.552	33%	0.331	S	S	*	.	H	α-helix	trans	-66.4	-27.7	177.3	-56.4	0	0	0	0	112.2	G449 E450 I454	G449-S452 WeakPolarHBondContact O-CB 3.11Å; G449-S452 PolarHBondContact O-N 3.21Å; E450-S452 PolarHBondContact O-N 2.89Å; S452-I454 VanDerWaalsContact C-N 3.29Å; S452-I454 PolarHBondContact O-N 2.99Å
453	L	82	Confident	78.4	Confident	116 Å²	116	69.6 Å²	69.6	61%	0.607	37%	0.366	S	S	*	.	H	α-helix	trans	-70.1	-27.2	176.6	-60.1	173.9	0	0	0	112.6	E450 E451	E450-L453 WeakPolarHBondContact O-CB 3.3Å; E450-L453 PolarHBondContact O-N 2.77Å; E451-L453 PolarHBondContact O-N 3.35Å
454	I	84.3	Confident	76.4	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.01	40%	0.401	C	S	.	.	H	α-helix	trans	-113.9	8.7	-175.5	57	159.4	0	0	0	113.9	E451 S452 P1037 A1040 V1041 K1075 I1078 L1079	E451-I454 CarbonylContact O-C 3.38Å; E451-I454 PolarHBondContact O-N 2.76Å; S452-I454 VanDerWaalsContact C-N 3.29Å; S452-I454 PolarHBondContact O-N 2.99Å; I454-P1037 HydrophobicContact CD1-CB 3.95Å; I454-P1037 HydrophobicContact CG1-CB 4.24Å; I454-A1040 HydrophobicContact CD1-CB 3.71Å; I454-V1041 HydrophobicContact CD1-CG2 4.42Å; I454-K1075 HydrophobicContact CB-CB 4.37Å; I454-K1075 HydrophobicContact CB-CD 4.01Å; I454-K1075 HydrophobicContact CB-CG 4.5Å; I454-K1075 HydrophobicContact CD1-CB 4.34Å; I454-K1075 HydrophobicContact CG2-CB 4.39Å; I454-K1075 HydrophobicContact CG2-CD 4.34Å; I454-K1075 WeakPolarHBondContact O-CE 3.45Å; I454-K1075 PolarHBondContact O-NZ 3.5Å; I454-I1078 HydrophobicContact CG2-CG2 4.39Å; I454-L1079 HydrophobicContact CD1-CD1 3.83Å; I454-L1079 HydrophobicContact CD1-CG 4.34Å; I454-L1079 HydrophobicContact CG2-CD2 3.78Å; I454-L1079 HydrophobicContact CG2-CG 3.85Å
455	A	83.7	Confident	74.3	Confident	48 Å²	48	84 Å²	84	40%	0.397	43%	0.434	S	S	.	.	S	Bend	trans	-54.1	158.7	175.2	0	0	0	0	0	112.3	E451 R457 K1075	E451-A455 PolarHBondContact O-N 3.26Å; A455-R457 PolarHBondContact O-N 3.49Å; A455-K1075 PolarHBondContact O-NZ 3.37Å
456	A	80.9	Confident	72	Confident	51 Å²	51	92.1 Å²	92.1	42%	0.421	47%	0.468	S	S	.	.			trans	-60.1	120.9	177.4	0	0	0	0	0	110.2	E1028 F1035	A456-E1028 VanDerWaalsContact CA-OE2 3.32Å; A456-E1028 WeakPolarHBondContact CA-OE2 3.44Å; A456-E1028 HydrophobicContact CB-CB 4.07Å; A456-F1035 HydrophobicContact CB-CZ 3.97Å
457	R	80.2	Confident	69.9	Low	210 Å²	210	97.2 Å²	97.2	79%	0.792	50%	0.504	S	S	*	.	S	Bend	trans	-71	-35.6	178.6	-67.4	-178.1	179.4	174.9	1.2	112.6	A455 E1028	A455-R457 PolarHBondContact O-N 3.49Å; R457-E1028 PolarHBondContact N-OE2 3.22Å; R457-E1028 VanDerWaalsContact N-OE2 3.16Å
458	E	79.1	Confident	68	Low	109 Å²	109	100 Å²	100	51%	0.509	53%	0.527	S	S	.	.	S	Bend	trans	-144.8	144.5	-179	44.7	169.1	-168	0	0	110.2	E1028 G1029	E458-E1028 VanDerWaalsContact O-CA 3.3Å; E458-E1028 WeakPolarHBondContact O-CA 3.34Å; E458-E1028 WeakPolarHBondContact O-CB 3.25Å; E458-G1029 PolarHBondContact O-N 3.08Å; E458-G1029 VanDerWaalsContact O-N 3.11Å; E458-G1029 WeakPolarHBondContact OE1-CA 3.25Å
459	P	78.3	Confident	65.9	Low	114 Å²	114	108.9 Å²	108.9	74%	0.74	57%	0.569	S	S	*	*	B	Isolated β-bridge	trans	-64.6	145.5	177.5	27.6	-33.8	0	0	0	110.9	S461	P459-S461 PolarHBondContact O-N 2.66Å
460	F	76.6	Confident	64.4	Low	47 Å²	47	110.7 Å²	110.7	21%	0.206	58%	0.578	C	S	.	*			trans	-64.7	131.2	-179.5	172.4	-106.8	0	0	0	112.3	W462 R1027 G1029 S1031	F460-W462 AromaticContact CE1-CD1 3.3Å; F460-W462 HydrophobicContact CE1-CD2 4.44Å; F460-W462 AromaticContact CE1-CE2 3.94Å; F460-W462 HydrophobicContact CE1-CG 4.08Å; F460-W462 AromaticContact CE1-NE1 3.22Å; F460-W462 AromaticContact CZ-CD1 3.63Å; F460-W462 HydrophobicContact CZ-CD2 4.03Å; F460-W462 AromaticContact CZ-CE2 3.69Å; F460-W462 AromaticContact CZ-CG 3.99Å; F460-W462 HydrophobicContact CZ-CG 3.99Å; F460-W462 HydrophobicContact CZ-CZ2 4.3Å; F460-W462 AromaticContact CZ-NE1 3.47Å; F460-R1027 HydrophobicContact CB-CB 3.72Å; F460-R1027 HydrophobicContact CD2-CB 4.06Å; F460-R1027 HydrophobicContact CG-CB 3.87Å; F460-G1029 CarbonylContact C-O 3.56Å; F460-G1029 VanDerWaalsContact CA-O 3.26Å; F460-G1029 WeakPolarHBondContact CA-O 3.24Å; F460-G1029 VanDerWaalsContact CD2-O 3.31Å; F460-G1029 WeakPolarHBondContact CD2-O 3.25Å; F460-S1031 VanDerWaalsContact CD2-O 3.29Å; F460-S1031 WeakPolarHBondContact CD2-O 3.18Å; F460-S1031 WeakPolarHBondContact CE2-O 3.43Å
461	S	66.3	Low	62.4	Low	61 Å²	61	114.2 Å²	114.2	43%	0.427	60%	0.599	S	S	.	*			trans	-131.7	129.2	176.5	66.1	0	0	0	0	112.3	P459 K463 G1029	P459-S461 PolarHBondContact O-N 2.66Å; S461-K463 PolarHBondContact O-N 3.35Å; S461-G1029 PolarHBondContact N-O 2.74Å
462	W	52.1	Low	60.7	Low	201 Å²	201	120.2 Å²	120.2	76%	0.761	64%	0.637	S	S	*	*			trans	-81.4	111.5	170.8	-79.4	97.1	0	0	0	109.7	F460	F460-W462 AromaticContact CE1-CD1 3.3Å; F460-W462 HydrophobicContact CE1-CD2 4.44Å; F460-W462 AromaticContact CE1-CE2 3.94Å; F460-W462 HydrophobicContact CE1-CG 4.08Å; F460-W462 AromaticContact CE1-NE1 3.22Å; F460-W462 AromaticContact CZ-CD1 3.63Å; F460-W462 HydrophobicContact CZ-CD2 4.03Å; F460-W462 AromaticContact CZ-CE2 3.69Å; F460-W462 AromaticContact CZ-CG 3.99Å; F460-W462 HydrophobicContact CZ-CG 3.99Å; F460-W462 HydrophobicContact CZ-CZ2 4.3Å; F460-W462 AromaticContact CZ-NE1 3.47Å
463	K	48.4	Very low	59.3	Low	169 Å²	169	117.6 Å²	117.6	74%	0.735	62%	0.619	S	S	*	*			trans	-100.5	114.2	159.3	-88.9	-171.6	176.4	-179.4	0	109.3	S461 L465	S461-K463 PolarHBondContact O-N 3.35Å; K463-L465 PolarHBondContact O-N 2.92Å
464	K	42.2	Very low	58.5	Low	196 Å²	196	115.2 Å²	115.2	85%	0.852	62%	0.616	S	S	*	*			trans	-70.5	114.6	153.3	-74.9	-179.8	178.6	174.8	0	106	K466	K464-K466 PolarHBondContact O-N 3.23Å; K464-K466 VanDerWaalsContact O-N 3.14Å
465	L	44.9	Very low	57.6	Low	133 Å²	133	120.2 Å²	120.2	70%	0.696	64%	0.637	S	S	*	*			trans	-56.2	123	161	-110.3	85.4	0	0	0	106.1	K463 S467	K463-L465 PolarHBondContact O-N 2.92Å; L465-S467 PolarHBondContact O-N 3.35Å
466	K	36.1	Very low	57.4	Low	202 Å²	202	121.1 Å²	121.1	88%	0.878	64%	0.638	S	S	*	*			trans	-63.9	110.2	165.2	-74.3	-178.2	178.2	-179.8	0	104.9	K464 S468	K464-K466 PolarHBondContact O-N 3.23Å; K464-K466 VanDerWaalsContact O-N 3.14Å; K466-S468 PolarHBondContact O-N 2.97Å
467	S	40.7	Very low	57.1	Low	107 Å²	107	122.1 Å²	122.1	75%	0.748	64%	0.639	S	S	*	*			trans	-58.2	114.4	166.6	47.6	0	0	0	0	106.8	L465 Q469	L465-S467 PolarHBondContact O-N 3.35Å; S467-Q469 PolarHBondContact O-N 3.09Å; S467-Q469 VanDerWaalsContact O-N 3.15Å
468	S	42	Very low	56.9	Low	106 Å²	106	113.9 Å²	113.9	74%	0.741	61%	0.612	S	S	*	*			trans	-61.2	117.3	163.8	50.5	0	0	0	0	106.2	K466 A470	K466-S468 PolarHBondContact O-N 2.97Å; S468-A470 VanDerWaalsContact C-N 3.27Å; S468-A470 PolarHBondContact O-N 3.17Å
469	Q	40.2	Very low	56.4	Low	188 Å²	188	112.5 Å²	112.5	88%	0.879	61%	0.611	S	S	*	*			trans	-61.8	98.4	164.9	-73.7	-179.4	-17.3	0	0	106.2	S467 L471	S467-Q469 PolarHBondContact O-N 3.09Å; S467-Q469 VanDerWaalsContact O-N 3.15Å; Q469-L471 PolarHBondContact O-N 3.11Å; Q469-L471 VanDerWaalsContact O-N 3.16Å
470	A	47.2	Very low	55.6	Low	91 Å²	91	107.9 Å²	107.9	75%	0.752	58%	0.581	S	S	*	*			trans	-64.9	115.8	174.6	0	0	0	0	0	107.6	S468	S468-A470 VanDerWaalsContact C-N 3.27Å; S468-A470 PolarHBondContact O-N 3.17Å
471	L	41.9	Very low	54.2	Low	149 Å²	149	110 Å²	110	78%	0.78	60%	0.597	S	S	*	*			trans	-59.5	139.6	164.7	-119.3	83.1	0	0	0	107.8	Q469 S473	Q469-L471 PolarHBondContact O-N 3.11Å; Q469-L471 VanDerWaalsContact O-N 3.16Å; L471-S473 PolarHBondContact O-N 3.5Å
472	T	47.6	Very low	53.2	Low	145 Å²	145	111.6 Å²	111.6	89%	0.89	61%	0.614	S	S	*	*			trans	-70.1	91	172.8	32.9	0	0	0	0	110
473	S	50.6	Low	52.7	Low	25 Å²	25	107.3 Å²	107.3	18%	0.175	60%	0.603	C	S	.	*			trans	-77.2	157.8	164.2	40.2	0	0	0	0	111	L471 E592 G595	L471-S473 PolarHBondContact O-N 3.5Å; S473-E592 VanDerWaalsContact CB-OE1 3.24Å; S473-E592 WeakPolarHBondContact CB-OE1 3.25Å; S473-E592 PolarHBondContact OG-OE1 2.91Å; S473-G595 VanDerWaalsContact CB-O 3.26Å; S473-G595 WeakPolarHBondContact CB-O 3.32Å
474	A	64.7	Low	52.3	Low	66 Å²	66	108.4 Å²	108.4	55%	0.545	61%	0.608	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-69.3	134.2	173.2	0	0	0	0	0	109.3	G595 H596 A597	A474-G595 PolarHBondContact N-O 3.04Å; A474-H596 WeakPolarHBondContact O-CA 3.49Å; A474-H596 PolarHBondContact O-ND1 3.02Å; A474-A597 PolarHBondContact O-N 2.82Å
475	K	66.1	Low	52.3	Low	106 Å²	106	105.7 Å²	105.7	46%	0.461	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-121.8	135.1	-171.6	-65.7	168.3	172.4	-151.2	0	111.8	A597 E599	K475-A597 WeakPolarHBondContact CA-O 3.41Å; K475-E599 WeakPolarHBondContact CD-OE1 3.23Å; K475-E599 WeakPolarHBondContact CE-OE1 3.21Å; K475-E599 IonicContact NZ-OE1 3.36Å; K475-E599 PolarHBondContact NZ-OE1 3.07Å
476	T	79.1	Confident	52.3	Low	68 Å²	68	104.8 Å²	104.8	42%	0.417	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-109.3	120.8	166.6	-65	0	0	0	0	108.7	H596 A597 I598 E599	T476-H596 WeakPolarHBondContact CB-NE2 3.34Å; T476-H596 PolarHBondContact OG1-CE1 3.45Å; T476-H596 PolarHBondContact OG1-NE2 2.95Å; T476-A597 PolarHBondContact N-O 2.79Å; T476-I598 WeakPolarHBondContact O-CA 3.5Å; T476-E599 PolarHBondContact O-N 3.35Å
477	T	74.8	Confident	52.6	Low	72 Å²	72	100.2 Å²	100.2	44%	0.442	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.1	118	177.9	-51.7	0	0	0	0	110.7	V479 E599 I601	T477-V479 HydrophobicContact CG2-CG2 4.4Å; T477-E599 CarbonylContact C-O 3.6Å; T477-E599 VanDerWaalsContact CA-O 3.3Å; T477-E599 WeakPolarHBondContact CA-O 3.45Å; T477-E599 HydrophobicContact CG2-CB 4.48Å; T477-I601 HydrophobicContact CG2-CD1 3.88Å; T477-I601 HydrophobicContact CG2-CG1 3.94Å
478	V	75.4	Confident	53	Low	37 Å²	37	102.3 Å²	102.3	22%	0.224	57%	0.573	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.2	117.5	172.7	-179.3	0	0	0	0	108.7	I598 E599 Y600 I601 N617	V478-I598 HydrophobicContact CG2-CG2 3.74Å; V478-E599 PolarHBondContact N-O 3.18Å; V478-Y600 HydrophobicContact CB-CD1 3.59Å; V478-Y600 HydrophobicContact CB-CE1 3.75Å; V478-Y600 HydrophobicContact CB-CG 4.45Å; V478-Y600 HydrophobicContact CG1-CD1 3.81Å; V478-Y600 HydrophobicContact CG1-CE1 3.89Å; V478-Y600 HydrophobicContact CG2-CD1 4.19Å; V478-Y600 HydrophobicContact CG2-CE1 3.85Å; V478-Y600 WeakPolarHBondContact O-CA 3.44Å; V478-I601 PolarHBondContact O-N 2.83Å; V478-N617 HydrophobicContact CG1-CB 4.07Å
479	V	68.8	Low	53.8	Low	79 Å²	79	98.4 Å²	98.4	48%	0.479	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-95	148.5	178.5	-167	0	0	0	0	109.3	T477 T481 I601 N617	T477-V479 HydrophobicContact CG2-CG2 4.4Å; V479-T481 PolarHBondContact O-N 2.83Å; V479-I601 HydrophobicContact CG1-CD1 4.29Å; V479-I601 HydrophobicContact CG2-CD1 4Å; V479-N617 PolarHBondContact O-ND2 3.27Å
480	V	61.5	Low	54.4	Low	17 Å²	17	98.1 Å²	98.1	10%	0.103	54%	0.541	C	S	.	.	P	Polyproline II helix	trans	-53.5	124.3	165.6	-179.3	0	0	0	0	108.6	A482 I601 Y603	V480-A482 PolarHBondContact O-N 3.47Å; V480-I601 VanDerWaalsContact CG2-O 3.32Å; V480-I601 WeakPolarHBondContact CG2-O 3.32Å; V480-Y603 HydrophobicContact CG2-CD2 4.1Å; V480-Y603 HydrophobicContact CG2-CE2 4.17Å
481	T	48.7	Very low	55	Low	91 Å²	91	94.8 Å²	94.8	56%	0.558	51%	0.51	S	S	*	.	S	Bend	trans	-52.9	116.5	168.5	42.5	0	0	0	0	108.3	V479 Q483	V479-T481 PolarHBondContact O-N 2.83Å; T481-Q483 PolarHBondContact O-N 2.96Å
482	A	44.1	Very low	55.9	Low	95 Å²	95	90.4 Å²	90.4	79%	0.785	49%	0.491	S	S	*	.			trans	-8.7	104.7	-174.4	0	0	0	0	0	113.8	V480 K484	V480-A482 PolarHBondContact O-N 3.47Å; A482-K484 PolarHBondContact O-N 3.13Å; A482-K484 VanDerWaalsContact O-N 3.11Å
483	Q	41.8	Very low	56.4	Low	112 Å²	112	87.2 Å²	87.2	52%	0.523	48%	0.475	S	S	.	.			trans	-44.6	130.1	156.1	-93.3	-170.7	-38.8	0	0	106.3	T481 R485	T481-Q483 PolarHBondContact O-N 2.96Å; Q483-R485 PolarHBondContact O-N 3.25Å
484	K	41	Very low	57.3	Low	191 Å²	191	93.4 Å²	93.4	83%	0.83	50%	0.498	S	S	*	.			trans	-54.7	90.1	138.2	-78.3	179.2	179.5	174.1	0	103.2	A482 N486	A482-K484 PolarHBondContact O-N 3.13Å; A482-K484 VanDerWaalsContact O-N 3.11Å; K484-N486 PolarHBondContact O-N 3.14Å; K484-N486 VanDerWaalsContact O-N 3.1Å
485	R	42.2	Very low	58	Low	139 Å²	139	91 Å²	91	53%	0.525	48%	0.477	S	S	.	.			trans	-34	126.9	158.6	-79.7	-179.3	175.3	-179.1	-0.9	103.6	Q483 S487 L491	Q483-R485 PolarHBondContact O-N 3.25Å; R485-S487 VanDerWaalsContact O-CA 3.28Å; R485-S487 WeakPolarHBondContact O-CA 3.49Å; R485-S487 PolarHBondContact O-N 3.4Å; R485-L491 PolarHBondContact NH1-O 3.34Å
486	N	43.6	Very low	58.8	Low	114 Å²	114	88.4 Å²	88.4	61%	0.61	47%	0.47	S	S	*	.			trans	-23	107.6	179.1	-85.8	-19.7	0	0	0	108.1	K484 R488 R489	K484-N486 PolarHBondContact O-N 3.14Å; K484-N486 VanDerWaalsContact O-N 3.1Å; N486-R488 WeakPolarHBondContact O-CA 3.28Å; N486-R488 PolarHBondContact O-N 3.47Å; N486-R489 PolarHBondContact O-N 3.03Å
487	S	43.7	Very low	59	Low	107 Å²	107	90.8 Å²	90.8	75%	0.748	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	-13.4	-163.7	50.2	0	0	0	0	112.9	R485	R485-S487 VanDerWaalsContact O-CA 3.28Å; R485-S487 WeakPolarHBondContact O-CA 3.49Å; R485-S487 PolarHBondContact O-N 3.4Å
488	R	48.6	Very low	59.8	Low	151 Å²	151	88.4 Å²	88.4	57%	0.57	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-28	171.1	-56.9	-173.8	179.9	-174.5	-0.2	116.3	N486 E834	N486-R488 WeakPolarHBondContact O-CA 3.28Å; N486-R488 PolarHBondContact O-N 3.47Å; R488-E834 IonicContact NH1-OE2 3.97Å
489	R	58.2	Low	60.6	Low	23 Å²	23	90.1 Å²	90.1	9%	0.087	47%	0.472	C	S	.	.			trans	-139.7	92.7	-176.4	-51.4	-163.3	-167.4	-171.3	-1.4	115.2	N486 L491 N828 G848 E849	N486-R489 PolarHBondContact O-N 3.03Å; R489-L491 PolarHBondContact O-N 3.41Å; R489-N828 PolarHBondContact NH1-O 3.06Å; R489-N828 PolarHBondContact NH2-O 3.24Å; R489-N828 VanDerWaalsContact NH2-O 3.14Å; R489-G848 PolarHBondContact NH2-O 3.09Å; R489-E849 WeakPolarHBondContact CD-O 3.47Å; R489-E849 WeakPolarHBondContact CG-O 3.32Å; R489-E849 IonicContact CZ-OE1 3.67Å; R489-E849 IonicContact CZ-OE2 2.8Å; R489-E849 VanDerWaalsContact CZ-OE2 3.25Å; R489-E849 PolarHBondContact NE-O 3.43Å; R489-E849 IonicContact NE-OE2 2.78Å; R489-E849 PolarHBondContact NE-OE2 3.45Å; R489-E849 IonicContact NH2-OE1 2.77Å; R489-E849 PolarHBondContact NH2-OE1 3.12Å; R489-E849 IonicContact NH2-OE2 3.11Å; R489-E849 PolarHBondContact NH2-OE2 2.91Å
490	Q	53.9	Low	61.7	Low	183 Å²	183	87 Å²	87	86%	0.855	45%	0.452	S	S	*	.			trans	-84.1	85.4	164.3	-74.4	-173.6	-15.1	0	0	110.3
491	L	59.6	Low	63.1	Low	20 Å²	20	88.7 Å²	88.7	11%	0.105	46%	0.463	C	S	.	.			trans	-98.8	131.2	172	-66.9	170.7	0	0	0	110.7	R485 R489 S493 I851 L869 I873	R485-L491 PolarHBondContact NH1-O 3.34Å; R489-L491 PolarHBondContact O-N 3.41Å; L491-S493 PolarHBondContact O-N 3.23Å; L491-I851 HydrophobicContact CD1-CG1 3.88Å; L491-I851 HydrophobicContact CD2-CB 4.1Å; L491-I851 HydrophobicContact CD2-CG1 4.14Å; L491-L869 HydrophobicContact CD1-CD2 3.85Å; L491-I873 HydrophobicContact CD2-CG2 3.32Å
492	P	59.9	Low	65	Low	57 Å²	57	89.6 Å²	89.6	37%	0.37	47%	0.465	S	S	.	.			trans	-64.1	131.7	168.6	26.2	-30.1	0	0	0	109.5	F494	P492-F494 HydrophobicContact CB-CD2 3.78Å; P492-F494 HydrophobicContact CB-CE2 3.56Å; P492-F494 HydrophobicContact CG-CD2 3.96Å; P492-F494 HydrophobicContact CG-CE2 3.81Å; P492-F494 PolarHBondContact O-N 2.79Å; P492-F494 VanDerWaalsContact O-N 3.1Å
493	S	57.9	Low	67.1	Low	79 Å²	79	94.4 Å²	94.4	55%	0.552	46%	0.462	S	S	*	.			trans	-83.5	81.8	-178.3	168.5	0	0	0	0	110.3	L491	L491-S493 PolarHBondContact O-N 3.23Å
494	F	69.3	Low	69.4	Low	154 Å²	154	89.6 Å²	89.6	68%	0.675	44%	0.441	S	S	*	.			trans	-89.1	6.3	174.7	-77	-71.8	0	0	0	114.6	P492 P496	P492-F494 HydrophobicContact CB-CD2 3.78Å; P492-F494 HydrophobicContact CB-CE2 3.56Å; P492-F494 HydrophobicContact CG-CD2 3.96Å; P492-F494 HydrophobicContact CG-CE2 3.81Å; P492-F494 PolarHBondContact O-N 2.79Å; P492-F494 VanDerWaalsContact O-N 3.1Å; F494-P496 VanDerWaalsContact O-CD 3.29Å; F494-P496 WeakPolarHBondContact O-CD 3.35Å
495	L	79.3	Confident	71.8	Confident	17 Å²	17	83 Å²	83	9%	0.089	41%	0.41	C	S	.	.			trans	-73.7	122.5	-179.5	-167.8	66.1	0	0	0	110.2	R641 R642 F645	L495-R641 HydrophobicContact CD2-CB 3.54Å; L495-R641 HydrophobicContact CG-CB 4.06Å; L495-R641 PolarHBondContact O-NH2 3.18Å; L495-R642 HydrophobicContact CD1-CG 4.33Å; L495-R642 HydrophobicContact CD2-CG 4.05Å; L495-F645 HydrophobicContact CD1-CB 3.75Å; L495-F645 HydrophobicContact CD1-CD2 4.24Å; L495-F645 HydrophobicContact CD1-CG 3.94Å
496	P	84.4	Confident	74	Confident	50 Å²	50	82.3 Å²	82.3	33%	0.325	41%	0.411	S	S	.	.			trans	-61.7	163.3	175.9	-22.4	34.8	0	0	0	112.5	F494 Y498 R641 F645	F494-P496 VanDerWaalsContact O-CD 3.29Å; F494-P496 WeakPolarHBondContact O-CD 3.35Å; P496-Y498 HydrophobicContact CB-CD2 4.18Å; P496-Y498 HydrophobicContact CB-CE1 4.31Å; P496-Y498 HydrophobicContact CB-CE2 3.66Å; P496-Y498 HydrophobicContact CG-CE2 3.99Å; P496-R641 PolarHBondContact O-NE 3.13Å; P496-R641 PolarHBondContact O-NH2 2.82Å; P496-F645 HydrophobicContact CG-CD2 3.85Å; P496-F645 HydrophobicContact CG-CE2 4.06Å
497	Q	83.1	Confident	76.1	Confident	119 Å²	119	76.9 Å²	76.9	56%	0.556	38%	0.382	S	S	*	.			trans	-82.1	-25.3	-171.5	-68.7	-63.9	-12.1	0	0	114.6	R637	Q497-R637 PolarHBondContact O-NH1 2.77Å; Q497-R637 PolarHBondContact O-NH2 3.1Å
498	Y	91.4	Very high	78.3	Confident	22 Å²	22	73 Å²	73	9%	0.086	35%	0.354	C	S	.	.			trans	36.8	60.8	-174.9	-59.1	-68.7	0	0	0	112.6	P496 I500 W539 R637 R641 H644 F645 E648	P496-Y498 HydrophobicContact CB-CD2 4.18Å; P496-Y498 HydrophobicContact CB-CE1 4.31Å; P496-Y498 HydrophobicContact CB-CE2 3.66Å; P496-Y498 HydrophobicContact CG-CE2 3.99Å; Y498-I500 PolarHBondContact O-N 3.18Å; Y498-W539 PolarHBondContact O-NE1 3.37Å; Y498-R637 PolarHBondContact O-NH2 2.75Å; Y498-R641 HydrophobicContact CD2-CB 4.24Å; Y498-R641 HydrophobicContact CD2-CG 4.38Å; Y498-R641 WeakPolarHBondContact CE2-O 3.37Å; Y498-H644 HydrophobicContact CD1-CB 3.77Å; Y498-H644 HydrophobicContact CD2-CB 3.47Å; Y498-H644 VanDerWaalsContact CD2-CB 3.47Å; Y498-H644 HydrophobicContact CE1-CB 4.07Å; Y498-H644 HydrophobicContact CE2-CB 3.77Å; Y498-H644 HydrophobicContact CG-CB 3.46Å; Y498-H644 VanDerWaalsContact CG-CB 3.46Å; Y498-H644 AromaticContact CG-CG 3.93Å; Y498-F645 HydrophobicContact CE2-CB 3.9Å; Y498-F645 HydrophobicContact CE2-CD2 4.38Å; Y498-F645 VanDerWaalsContact OH-CA 3.3Å; Y498-F645 WeakPolarHBondContact OH-CA 3.42Å; Y498-F645 VanDerWaalsContact OH-CD2 3.28Å; Y498-F645 WeakPolarHBondContact OH-CD2 3.27Å; Y498-E648 HydrophobicContact CE1-CG 4.29Å; Y498-E648 WeakPolarHBondContact CE1-OE2 3.48Å; Y498-E648 VanDerWaalsContact OH-CD 3.3Å; Y498-E648 PolarHBondContact OH-OE2 2.81Å
499	P	91.7	Very high	80.2	Confident	73 Å²	73	70.3 Å²	70.3	47%	0.474	35%	0.348	S	S	.	.	P	Polyproline II helix	trans	-62.3	140	-176.9	28.3	-34.4	0	0	0	110.1	P501	P499-P501 WeakPolarHBondContact O-CD 3.31Å
500	I	90.9	Very high	81.5	Confident	14 Å²	14	75.5 Å²	75.5	7%	0.072	37%	0.373	C	S	.	.	P	Polyproline II helix	trans	-60.1	127	172.7	-66.9	163.8	0	0	0	108.4	Y498 D502 R505 W539 E542 I543	Y498-I500 PolarHBondContact O-N 3.18Å; I500-D502 PolarHBondContact O-N 3.3Å; I500-R505 HydrophobicContact CG2-CB 4.17Å; I500-W539 HydrophobicContact CG1-CB 4.37Å; I500-W539 HydrophobicContact CG1-CG 4.19Å; I500-E542 HydrophobicContact CD1-CB 4.22Å; I500-E542 HydrophobicContact CD1-CG 3.84Å; I500-E542 WeakPolarHBondContact CD1-OE1 3.2Å; I500-E542 WeakPolarHBondContact CG1-OE1 3.26Å; I500-I543 HydrophobicContact CD1-CG1 3.93Å; I500-I543 HydrophobicContact CG2-CD1 3.77Å; I500-I543 HydrophobicContact CG2-CG1 3.88Å
501	P	91.8	Very high	82.9	Confident	51 Å²	51	75.9 Å²	75.9	33%	0.331	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-59.2	129	175.5	-25	34	0	0	0	112	P499 R503 L504 R505 W539	P499-P501 WeakPolarHBondContact O-CD 3.31Å; P501-R503 PolarHBondContact O-N 3.11Å; P501-L504 HydrophobicContact CB-CB 4.07Å; P501-L504 WeakPolarHBondContact O-CB 3.19Å; P501-L504 PolarHBondContact O-N 3.05Å; P501-R505 PolarHBondContact O-N 2.97Å; P501-W539 VanDerWaalsContact CD-CD2 3.46Å; P501-W539 HydrophobicContact CG-CD2 4.19Å; P501-W539 HydrophobicContact CG-CE3 3.77Å; P501-W539 HydrophobicContact CG-CH2 3.88Å; P501-W539 HydrophobicContact CG-CZ2 4.25Å; P501-W539 HydrophobicContact CG-CZ3 3.63Å
502	D	89.1	Confident	84.1	Confident	110 Å²	110	77 Å²	77	59%	0.588	38%	0.378	S	S	*	.	H	α-helix	trans	-59	-34.6	-176.4	-68	-33.6	0	0	0	112.9	I500 R505 K506	I500-D502 PolarHBondContact O-N 3.3Å; D502-R505 PolarHBondContact O-N 3.36Å; D502-K506 WeakPolarHBondContact O-CB 3.26Å; D502-K506 WeakPolarHBondContact O-CG 3.21Å; D502-K506 PolarHBondContact O-N 3.39Å
503	R	86.8	Confident	85.2	Confident	196 Å²	196	75.2 Å²	75.2	74%	0.74	37%	0.365	S	S	*	.	H	α-helix	trans	-63.5	-42.2	175.5	-67.6	-176	179.5	178.5	-0.2	111.6	P501 K506 C507 F517	P501-R503 PolarHBondContact O-N 3.11Å; R503-K506 PolarHBondContact O-N 3.19Å; R503-C507 WeakPolarHBondContact O-CB 3.44Å; R503-C507 PolarHBondContact O-N 2.79Å; R503-F517 HydrophobicContact CB-CD1 4.2Å; R503-F517 HydrophobicContact CB-CE1 4.39Å
504	L	91.2	Very high	86.6	Confident	12 Å²	12	71.5 Å²	71.5	6%	0.063	34%	0.339	C	S	.	.	H	α-helix	trans	-65.7	-44.4	178.4	-178.5	63.1	0	0	0	111	P501 C507 V508 I514 T536 W539 L540 I543	P501-L504 HydrophobicContact CB-CB 4.07Å; P501-L504 WeakPolarHBondContact O-CB 3.19Å; P501-L504 PolarHBondContact O-N 3.05Å; L504-C507 WeakPolarHBondContact O-CB 3.19Å; L504-C507 PolarHBondContact O-N 2.8Å; L504-V508 WeakPolarHBondContact O-CG2 3.44Å; L504-V508 PolarHBondContact O-N 3.48Å; L504-V508 VanDerWaalsContact O-N 3.14Å; L504-I514 HydrophobicContact CD1-CD1 3.22Å; L504-T536 HydrophobicContact CD1-CG2 4.3Å; L504-T536 HydrophobicContact CD2-CG2 4.22Å; L504-W539 HydrophobicContact CD2-CB 3.53Å; L504-W539 HydrophobicContact CD2-CD2 4.31Å; L504-W539 HydrophobicContact CD2-CE3 3.87Å; L504-W539 HydrophobicContact CD2-CG 4.24Å; L504-L540 HydrophobicContact CD1-CD2 3.96Å; L504-I543 HydrophobicContact CD2-CD1 4.29Å; L504-I543 HydrophobicContact CG-CD1 3.96Å
505	R	90.3	Very high	87.5	Confident	51 Å²	51	64.2 Å²	64.2	19%	0.192	31%	0.307	C	S	.	.	H	α-helix	trans	-58.3	-51.9	175	179.3	177.4	-64.3	-80.3	5.4	111.7	I500 P501 D502 C507 V508 E509 E546	I500-R505 HydrophobicContact CG2-CB 4.17Å; P501-R505 PolarHBondContact O-N 2.97Å; D502-R505 PolarHBondContact O-N 3.36Å; R505-C507 VanDerWaalsContact C-N 3.31Å; R505-C507 PolarHBondContact O-N 3.28Å; R505-V508 PolarHBondContact O-N 3.45Å; R505-E509 HydrophobicContact CG-CG 4.31Å; R505-E509 VanDerWaalsContact CG-OE1 3.27Å; R505-E509 WeakPolarHBondContact CG-OE1 3.36Å; R505-E509 IonicContact NH1-OE1 2.99Å; R505-E509 WeakPolarHBondContact O-CB 3.49Å; R505-E509 WeakPolarHBondContact O-CG 3.41Å; R505-E509 PolarHBondContact O-N 3.43Å; R505-E546 IonicContact CZ-OE2 3.75Å; R505-E546 IonicContact NH1-OE2 3.78Å; R505-E546 PolarHBondContact NH1-OE2 3.04Å; R505-E546 IonicContact NH2-OE1 3.68Å; R505-E546 PolarHBondContact NH2-OE1 3.44Å; R505-E546 IonicContact NH2-OE2 2.8Å; R505-E546 PolarHBondContact NH2-OE2 2.85Å
506	K	89.4	Confident	87.6	Confident	125 Å²	125	65 Å²	65	54%	0.543	31%	0.313	S	S	.	.	H	α-helix	trans	-58.9	-42	178.4	-73.7	178	-178.1	-178	0	111.9	D502 R503 V508 E509 Q510	D502-K506 WeakPolarHBondContact O-CB 3.26Å; D502-K506 WeakPolarHBondContact O-CG 3.21Å; D502-K506 PolarHBondContact O-N 3.39Å; R503-K506 PolarHBondContact O-N 3.19Å; K506-V508 PolarHBondContact O-N 3.11Å; K506-E509 PolarHBondContact O-N 3.39Å; K506-Q510 WeakPolarHBondContact O-CB 3.5Å; K506-Q510 VanDerWaalsContact O-CG 3.27Å; K506-Q510 WeakPolarHBondContact O-CG 3.38Å; K506-Q510 PolarHBondContact O-N 3.43Å
507	C	88.3	Confident	87.5	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-54.3	-51.6	175.8	177.8	0	0	0	0	111.8	R503 L504 R505 K511 I512 F517	R503-C507 WeakPolarHBondContact O-CB 3.44Å; R503-C507 PolarHBondContact O-N 2.79Å; L504-C507 WeakPolarHBondContact O-CB 3.19Å; L504-C507 PolarHBondContact O-N 2.8Å; R505-C507 VanDerWaalsContact C-N 3.31Å; R505-C507 PolarHBondContact O-N 3.28Å; C507-K511 PolarHBondContact O-N 3.08Å; C507-K511 VanDerWaalsContact O-N 3.09Å; C507-I512 PolarHBondContact O-N 3.44Å; C507-I512 PolarHBondContact SG-O 3.26Å; C507-F517 HydrophobicContact CB-CD2 3.43Å; C507-F517 VanDerWaalsContact CB-CD2 3.43Å; C507-F517 HydrophobicContact CB-CE2 3.46Å; C507-F517 VanDerWaalsContact CB-CE2 3.46Å; C507-F517 HydrophobicContact CB-CG 4.09Å; C507-F517 HydrophobicContact CB-CZ 4.2Å; C507-F517 WeakPolarHBondContact SG-CD2 3.26Å; C507-F517 VanDerWaalsContact SG-CE2 3.53Å
508	V	88.5	Confident	87.7	Confident	27 Å²	27	62.9 Å²	62.9	16%	0.164	30%	0.297	C	S	.	.	H	α-helix	trans	-68.6	-45.2	-177.3	177	0	0	0	0	111.2	L504 R505 K506 Q510 K511 L540 I543 M547 L927	L504-V508 WeakPolarHBondContact O-CG2 3.44Å; L504-V508 PolarHBondContact O-N 3.48Å; L504-V508 VanDerWaalsContact O-N 3.14Å; R505-V508 PolarHBondContact O-N 3.45Å; K506-V508 PolarHBondContact O-N 3.11Å; V508-Q510 VanDerWaalsContact C-N 3.32Å; V508-Q510 PolarHBondContact O-N 3.07Å; V508-K511 PolarHBondContact O-N 3.08Å; V508-K511 VanDerWaalsContact O-N 3.1Å; V508-L540 HydrophobicContact CG2-CD2 3.65Å; V508-I543 HydrophobicContact CB-CG2 4.08Å; V508-I543 HydrophobicContact CG1-CG2 3.73Å; V508-I543 HydrophobicContact CG2-CD1 4.2Å; V508-M547 HydrophobicContact CG1-SD 4.16Å; V508-L927 HydrophobicContact CG2-CD1 4.32Å
509	E	88.2	Confident	87.5	Confident	93 Å²	93	63.3 Å²	63.3	44%	0.435	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-37.5	-180	-72.2	174	175.4	0	0	112.2	R505 K506 K511	R505-E509 HydrophobicContact CG-CG 4.31Å; R505-E509 VanDerWaalsContact CG-OE1 3.27Å; R505-E509 WeakPolarHBondContact CG-OE1 3.36Å; R505-E509 IonicContact NH1-OE1 2.99Å; R505-E509 WeakPolarHBondContact O-CB 3.49Å; R505-E509 WeakPolarHBondContact O-CG 3.41Å; R505-E509 PolarHBondContact O-N 3.43Å; K506-E509 PolarHBondContact O-N 3.39Å; E509-K511 VanDerWaalsContact C-N 3.3Å
510	Q	86.1	Confident	87.2	Confident	132 Å²	132	60.5 Å²	60.5	62%	0.617	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-0.6	176.9	-64.6	178.9	-15.5	0	0	113.4	K506 V508 I512	K506-Q510 WeakPolarHBondContact O-CB 3.5Å; K506-Q510 VanDerWaalsContact O-CG 3.27Å; K506-Q510 WeakPolarHBondContact O-CG 3.38Å; K506-Q510 PolarHBondContact O-N 3.43Å; V508-Q510 VanDerWaalsContact C-N 3.32Å; V508-Q510 PolarHBondContact O-N 3.07Å; Q510-I512 HydrophobicContact CB-CD1 4.01Å; Q510-I512 HydrophobicContact CB-CG1 3.96Å; Q510-I512 PolarHBondContact O-N 2.7Å
511	K	84.1	Confident	87.2	Confident	191 Å²	191	59.9 Å²	59.9	83%	0.83	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.1	35.1	-176.8	-55.2	-179	178.5	-178.8	0	113.5	C507 V508 E509	C507-K511 PolarHBondContact O-N 3.08Å; C507-K511 VanDerWaalsContact O-N 3.09Å; V508-K511 PolarHBondContact O-N 3.08Å; V508-K511 VanDerWaalsContact O-N 3.1Å; E509-K511 VanDerWaalsContact C-N 3.3Å
512	I	83.5	Confident	86.9	Confident	45 Å²	45	57.6 Å²	57.6	23%	0.231	27%	0.266	C	S	.	.			trans	-75.1	149.7	170.5	-56.8	168	0	0	0	108	W168 C507 Q510 I514 F517	W168-I512 HydrophobicContact CB-CG2 3.89Å; C507-I512 PolarHBondContact O-N 3.44Å; C507-I512 PolarHBondContact SG-O 3.26Å; Q510-I512 HydrophobicContact CB-CD1 4.01Å; Q510-I512 HydrophobicContact CB-CG1 3.96Å; Q510-I512 PolarHBondContact O-N 2.7Å; I512-I514 PolarHBondContact O-N 3.31Å; I512-F517 HydrophobicContact CB-CE2 4Å; I512-F517 HydrophobicContact CD1-CE2 4.01Å; I512-F517 HydrophobicContact CD1-CZ 4.15Å; I512-F517 HydrophobicContact CG2-CD2 4.35Å; I512-F517 HydrophobicContact CG2-CE2 3.65Å
513	D	84.3	Confident	86.8	Confident	18 Å²	18	56.7 Å²	56.7	10%	0.096	26%	0.258	C	S	.	.			trans	-60.2	127.8	174.3	-167.4	-32.6	0	0	0	111	W168 S170 L515 T516	W168-D513 VanDerWaalsContact O-CB 3.26Å; W168-D513 WeakPolarHBondContact O-CB 3.39Å; S170-D513 WeakPolarHBondContact CA-OD2 3.46Å; S170-D513 WeakPolarHBondContact CB-OD2 3.24Å; S170-D513 PolarHBondContact N-OD2 3.39Å; S170-D513 PolarHBondContact OG-OD2 2.86Å; D513-L515 PolarHBondContact O-N 3.12Å; D513-L515 PolarHBondContact OD1-N 3.11Å; D513-T516 WeakPolarHBondContact O-CB 3.34Å; D513-T516 PolarHBondContact O-N 3.37Å; D513-T516 VanDerWaalsContact O-N 3.17Å; D513-T516 PolarHBondContact O-OG1 3.17Å
514	I	87	Confident	86.7	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.01	25%	0.251	C	S	.	.	H	α-helix	trans	-64.1	-29.1	-177.6	-172.7	59.3	0	0	0	112.8	T137 L504 I512 T516 F517 Q518 L521 L540 L927 Y931	T137-I514 HydrophobicContact CG2-CG2 4.4Å; L504-I514 HydrophobicContact CD1-CD1 3.22Å; I512-I514 PolarHBondContact O-N 3.31Å; I514-T516 PolarHBondContact O-N 3.17Å; I514-F517 PolarHBondContact O-N 3.17Å; I514-F517 VanDerWaalsContact O-N 3.08Å; I514-Q518 PolarHBondContact O-N 3.08Å; I514-L521 HydrophobicContact CG1-CD1 3.61Å; I514-L521 HydrophobicContact CG2-CD1 4.28Å; I514-L540 HydrophobicContact CD1-CD2 4.06Å; I514-L540 HydrophobicContact CG1-CD1 4.36Å; I514-L540 HydrophobicContact CG1-CD2 4.45Å; I514-L927 HydrophobicContact CG2-CD2 4.23Å; I514-Y931 HydrophobicContact CG2-CE2 3.53Å
515	L	86.9	Confident	86.7	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-67.9	-21	178.8	-63.7	-176	0	0	0	112.9	Y161 I163 D513 F517 L521 A522 Y931	Y161-L515 HydrophobicContact CD2-CD1 4.49Å; Y161-L515 HydrophobicContact CE1-CD1 4.46Å; Y161-L515 HydrophobicContact CE2-CB 4.13Å; Y161-L515 HydrophobicContact CE2-CD1 4.05Å; I163-L515 HydrophobicContact CD1-CB 4.38Å; D513-L515 PolarHBondContact O-N 3.12Å; D513-L515 PolarHBondContact OD1-N 3.11Å; L515-F517 VanDerWaalsContact C-N 3.25Å; L515-F517 PolarHBondContact O-N 3.47Å; L515-L521 HydrophobicContact CD2-CB 4.09Å; L515-A522 HydrophobicContact CD1-CB 4.29Å; L515-A522 HydrophobicContact CD2-CB 3.84Å; L515-Y931 HydrophobicContact CD2-CE1 3.94Å; L515-Y931 WeakPolarHBondContact CD2-OH 3.09Å; L515-Y931 VanDerWaalsContact CG-OH 3.28Å; L515-Y931 WeakPolarHBondContact CG-OH 3.2Å
516	T	82.8	Confident	86.8	Confident	34 Å²	34	54 Å²	54	21%	0.209	26%	0.261	C	S	.	.	H	α-helix	trans	-61.4	-37.4	171.7	-60.7	0	0	0	0	111.4	I163 W168 D513 I514	I163-T516 HydrophobicContact CG2-CG2 4.44Å; W168-T516 HydrophobicContact CD2-CG2 4.3Å; W168-T516 HydrophobicContact CE3-CG2 3.34Å; W168-T516 HydrophobicContact CZ3-CG2 3.8Å; W168-T516 PolarHBondContact O-OG1 3.3Å; D513-T516 WeakPolarHBondContact O-CB 3.34Å; D513-T516 PolarHBondContact O-N 3.37Å; D513-T516 VanDerWaalsContact O-N 3.17Å; D513-T516 PolarHBondContact O-OG1 3.17Å; I514-T516 PolarHBondContact O-N 3.17Å
517	F	81	Confident	86.8	Confident	81 Å²	81	50.8 Å²	50.8	36%	0.355	25%	0.249	S	C	.	.	H	α-helix	trans	-100.4	-33	-176.8	-67.9	-85.9	0	0	0	113.1	R503 C507 I512 I514 L515	R503-F517 HydrophobicContact CB-CD1 4.2Å; R503-F517 HydrophobicContact CB-CE1 4.39Å; C507-F517 HydrophobicContact CB-CD2 3.43Å; C507-F517 VanDerWaalsContact CB-CD2 3.43Å; C507-F517 HydrophobicContact CB-CE2 3.46Å; C507-F517 VanDerWaalsContact CB-CE2 3.46Å; C507-F517 HydrophobicContact CB-CG 4.09Å; C507-F517 HydrophobicContact CB-CZ 4.2Å; C507-F517 WeakPolarHBondContact SG-CD2 3.26Å; C507-F517 VanDerWaalsContact SG-CE2 3.53Å; I512-F517 HydrophobicContact CB-CE2 4Å; I512-F517 HydrophobicContact CD1-CE2 4.01Å; I512-F517 HydrophobicContact CD1-CZ 4.15Å; I512-F517 HydrophobicContact CG2-CD2 4.35Å; I512-F517 HydrophobicContact CG2-CE2 3.65Å; I514-F517 PolarHBondContact O-N 3.17Å; I514-F517 VanDerWaalsContact O-N 3.08Å; L515-F517 VanDerWaalsContact C-N 3.25Å; L515-F517 PolarHBondContact O-N 3.47Å
518	Q	88.6	Confident	86.9	Confident	43 Å²	43	55.8 Å²	55.8	20%	0.201	28%	0.284	C	S	.	.			trans	-133.7	78.4	-177.9	-168.1	66.6	-61.4	0	0	112	I514 L520 L521 T536	I514-Q518 PolarHBondContact O-N 3.08Å; Q518-L520 VanDerWaalsContact C-N 3.26Å; Q518-L520 HydrophobicContact CG-CD1 4.01Å; Q518-L520 HydrophobicContact CG-CD2 4.2Å; Q518-L520 HydrophobicContact CG-CG 3.72Å; Q518-L520 PolarHBondContact O-N 3.48Å; Q518-L521 HydrophobicContact CB-CD1 4.35Å; Q518-L521 HydrophobicContact CB-CG 4.28Å; Q518-L521 HydrophobicContact CG-CD1 4.36Å; Q518-L521 HydrophobicContact CG-CD2 4.46Å; Q518-L521 HydrophobicContact CG-CG 3.84Å; Q518-L521 PolarHBondContact O-N 3.17Å; Q518-T536 HydrophobicContact CB-CG2 4.31Å; Q518-T536 HydrophobicContact CG-CG2 3.91Å; Q518-T536 PolarHBondContact NE2-OG1 3.23Å
519	P	86.2	Confident	87.1	Confident	31 Å²	31	54.8 Å²	54.8	20%	0.201	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-65.5	-26.9	-177.5	28.1	-37.4	0	0	0	113.4	L521 A522	P519-L521 PolarHBondContact O-N 2.78Å; P519-A522 WeakPolarHBondContact O-CB 3.31Å; P519-A522 PolarHBondContact O-N 3.25Å
520	L	87.1	Confident	87.4	Confident	13 Å²	13	50.5 Å²	50.5	7%	0.068	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-62	-16.6	179.6	67	85.6	0	0	0	114	Q518 A522 E523 E532 K533	Q518-L520 VanDerWaalsContact C-N 3.26Å; Q518-L520 HydrophobicContact CG-CD1 4.01Å; Q518-L520 HydrophobicContact CG-CD2 4.2Å; Q518-L520 HydrophobicContact CG-CG 3.72Å; Q518-L520 PolarHBondContact O-N 3.48Å; L520-A522 PolarHBondContact O-N 2.94Å; L520-E523 PolarHBondContact O-N 3.06Å; L520-E532 HydrophobicContact CD1-CB 4.33Å; L520-E532 HydrophobicContact CD2-CB 3.79Å; L520-E532 VanDerWaalsContact CD2-OE2 3.23Å; L520-E532 WeakPolarHBondContact CD2-OE2 3.46Å; L520-K533 VanDerWaalsContact CD1-CA 3.47Å; L520-K533 HydrophobicContact CD1-CB 3.75Å; L520-K533 HydrophobicContact CD1-CG 4.28Å
521	L	89.5	Confident	87.8	Confident	2 Å²	2	48 Å²	48	1%	0.01	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-62.7	-31.2	173.1	-68.6	-177	0	0	0	111.7	I514 L515 Q518 P519 K533 T536 L537 L540 Y931	I514-L521 HydrophobicContact CG1-CD1 3.61Å; I514-L521 HydrophobicContact CG2-CD1 4.28Å; L515-L521 HydrophobicContact CD2-CB 4.09Å; Q518-L521 HydrophobicContact CB-CD1 4.35Å; Q518-L521 HydrophobicContact CB-CG 4.28Å; Q518-L521 HydrophobicContact CG-CD1 4.36Å; Q518-L521 HydrophobicContact CG-CD2 4.46Å; Q518-L521 HydrophobicContact CG-CG 3.84Å; Q518-L521 PolarHBondContact O-N 3.17Å; P519-L521 PolarHBondContact O-N 2.78Å; L521-K533 HydrophobicContact CD2-CG 4.03Å; L521-K533 WeakPolarHBondContact O-CE 3.41Å; L521-K533 PolarHBondContact O-NZ 2.97Å; L521-T536 HydrophobicContact CD1-CG2 4.08Å; L521-T536 HydrophobicContact CD2-CG2 4.1Å; L521-T536 HydrophobicContact CG-CG2 4.36Å; L521-L537 HydrophobicContact CD2-CD2 3.96Å; L521-L537 HydrophobicContact CD2-CG 4.28Å; L521-L540 HydrophobicContact CD1-CD1 4.13Å; L521-Y931 HydrophobicContact CB-CD1 3.77Å; L521-Y931 HydrophobicContact CB-CD2 4.26Å; L521-Y931 HydrophobicContact CB-CE1 3.99Å; L521-Y931 HydrophobicContact CB-CE2 4.49Å; L521-Y931 HydrophobicContact CB-CG 3.91Å; L521-Y931 HydrophobicContact CD1-CD2 3.9Å; L521-Y931 HydrophobicContact CD1-CE2 4.13Å; L521-Y931 HydrophobicContact CD1-CG 4.3Å; L521-Y931 WeakPolarHBondContact O-CD1 3.2Å
522	A	86.2	Confident	88.2	Confident	2 Å²	2	44.3 Å²	44.3	2%	0.017	23%	0.23	C	C	.	.	S	Bend	trans	-77.4	-19.9	179.6	0	0	0	0	0	113.8	L120 I121 Y161 L515 P519 L520	L120-A522 HydrophobicContact CB-CB 4.08Å; L120-A522 HydrophobicContact CD1-CB 3.65Å; L120-A522 HydrophobicContact CG-CB 4.49Å; I121-A522 PolarHBondContact N-O 3.42Å; Y161-A522 HydrophobicContact CE1-CB 4.04Å; L515-A522 HydrophobicContact CD1-CB 4.29Å; L515-A522 HydrophobicContact CD2-CB 3.84Å; P519-A522 WeakPolarHBondContact O-CB 3.31Å; P519-A522 PolarHBondContact O-N 3.25Å; L520-A522 PolarHBondContact O-N 2.94Å
523	E	86.2	Confident	88.8	Confident	92 Å²	92	43.1 Å²	43.1	43%	0.43	22%	0.223	S	C	.	.	S	Bend	trans	-77.3	156.4	-178.4	-63.7	175.4	-167.2	0	0	112.5	L520 L525 N529 K533	L520-E523 PolarHBondContact O-N 3.06Å; E523-L525 PolarHBondContact O-N 3.47Å; E523-N529 PolarHBondContact OE2-ND2 3.48Å; E523-K533 PolarHBondContact O-NZ 3.12Å
524	L	85.4	Confident	89.4	Confident	113 Å²	113	42.6 Å²	42.6	59%	0.592	22%	0.22	S	C	*	.	P	Polyproline II helix	trans	-61.7	137.4	169.6	-72.1	172.9	0	0	0	110.8	I121 N526 N529	I121-L524 HydrophobicContact CB-CD2 4.5Å; I121-L524 HydrophobicContact CD1-CD1 3.79Å; I121-L524 HydrophobicContact CD1-CD2 3.64Å; I121-L524 HydrophobicContact CD1-CG 3.59Å; I121-L524 HydrophobicContact CG2-CD2 4.47Å; L524-N526 PolarHBondContact O-N 3.22Å; L524-N526 PolarHBondContact O-ND2 3.36Å; L524-N526 VanDerWaalsContact O-ND2 3.17Å; L524-N529 PolarHBondContact O-ND2 3.39Å
525	L	91.3	Very high	89.8	Confident	34 Å²	34	43.1 Å²	43.1	18%	0.178	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-65.8	122.9	176.7	-177.5	68.5	0	0	0	110.1	E523 Y530 K533 F534 F659	E523-L525 PolarHBondContact O-N 3.47Å; L525-Y530 HydrophobicContact CD1-CD2 3.77Å; L525-Y530 HydrophobicContact CD1-CE2 4.49Å; L525-Y530 HydrophobicContact CD2-CD2 4.25Å; L525-Y530 HydrophobicContact CD2-CE2 4.25Å; L525-Y530 HydrophobicContact CG-CD2 4.16Å; L525-K533 HydrophobicContact CD1-CB 4.44Å; L525-K533 HydrophobicContact CD1-CD 4.03Å; L525-F534 HydrophobicContact CD1-CD2 4.31Å; L525-F534 HydrophobicContact CD1-CE2 3.82Å; L525-F534 HydrophobicContact CD2-CE2 3.65Å; L525-F534 HydrophobicContact CD2-CZ 3.85Å; L525-F534 HydrophobicContact CG-CE2 4.4Å; L525-F659 HydrophobicContact CG-CE1 4.23Å; L525-F659 HydrophobicContact CG-CZ 4.05Å; L525-F659 WeakPolarHBondContact O-CE1 3.43Å
526	N	91.1	Very high	90.3	Very high	55 Å²	55	43.1 Å²	43.1	29%	0.294	22%	0.224	S	C	.	.			trans	-140.6	176.6	178.5	64.3	61	0	0	0	109.4	L524 S528 N529 Y530 F659	L524-N526 PolarHBondContact O-N 3.22Å; L524-N526 PolarHBondContact O-ND2 3.36Å; L524-N526 VanDerWaalsContact O-ND2 3.17Å; N526-S528 VanDerWaalsContact C-N 3.3Å; N526-S528 PolarHBondContact O-N 3.39Å; N526-S528 WeakPolarHBondContact OD1-CA 3.37Å; N526-S528 WeakPolarHBondContact OD1-CB 3.45Å; N526-S528 PolarHBondContact OD1-N 2.92Å; N526-S528 PolarHBondContact OD1-OG 3.26Å; N526-N529 PolarHBondContact N-OD1 3.24Å; N526-N529 PolarHBondContact ND2-ND2 3.18Å; N526-N529 VanDerWaalsContact ND2-ND2 3.17Å; N526-N529 PolarHBondContact O-OD1 3.23Å; N526-N529 PolarHBondContact OD1-N 2.58Å; N526-N529 VanDerWaalsContact OD1-N 3.08Å; N526-N529 PolarHBondContact OD1-OD1 2.87Å; N526-Y530 WeakPolarHBondContact O-CB 3.46Å; N526-Y530 PolarHBondContact O-N 3.17Å; N526-Y530 VanDerWaalsContact O-N 3.1Å; N526-F659 WeakPolarHBondContact O-CZ 3.29Å
527	M	91.3	Very high	90.9	Very high	58 Å²	58	41.6 Å²	41.6	29%	0.286	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-35	-176	-165.7	69.4	-177.2	0	0	113	I651 V655 L658 F659	M527-I651 HydrophobicContact CE-CG2 4.2Å; M527-V655 HydrophobicContact CB-CG2 4.44Å; M527-V655 HydrophobicContact CG-CG2 4.26Å; M527-V655 HydrophobicContact SD-CG2 4.42Å; M527-L658 HydrophobicContact CE-CD1 4.11Å; M527-L658 HydrophobicContact SD-CD1 4.07Å; M527-F659 HydrophobicContact CB-CD2 4.39Å; M527-F659 HydrophobicContact CB-CE2 4.25Å; M527-F659 HydrophobicContact SD-CD2 3.91Å; M527-F659 HydrophobicContact SD-CE2 3.92Å
528	S	90.3	Very high	91.7	Very high	104 Å²	104	38.4 Å²	38.4	73%	0.727	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-74.2	-36.7	-175.6	68.4	0	0	0	0	113.4	N526	N526-S528 VanDerWaalsContact C-N 3.3Å; N526-S528 PolarHBondContact O-N 3.39Å; N526-S528 WeakPolarHBondContact OD1-CA 3.37Å; N526-S528 WeakPolarHBondContact OD1-CB 3.45Å; N526-S528 PolarHBondContact OD1-N 2.92Å; N526-S528 PolarHBondContact OD1-OG 3.26Å
529	N	92.1	Very high	92.1	Very high	7 Å²	7	38.2 Å²	38.2	4%	0.037	20%	0.198	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-2.6	178.4	68.4	14	0	0	0	113.8	E523 L524 N526 K531 E532 K533	E523-N529 PolarHBondContact OE2-ND2 3.48Å; L524-N529 PolarHBondContact O-ND2 3.39Å; N526-N529 PolarHBondContact N-OD1 3.24Å; N526-N529 PolarHBondContact ND2-ND2 3.18Å; N526-N529 VanDerWaalsContact ND2-ND2 3.17Å; N526-N529 PolarHBondContact O-OD1 3.23Å; N526-N529 PolarHBondContact OD1-N 2.58Å; N526-N529 VanDerWaalsContact OD1-N 3.08Å; N526-N529 PolarHBondContact OD1-OD1 2.87Å; N529-K531 PolarHBondContact O-N 3.47Å; N529-E532 PolarHBondContact O-N 3.03Å; N529-K533 WeakPolarHBondContact O-CB 3.41Å; N529-K533 PolarHBondContact O-N 3.28Å
530	Y	94.5	Very high	92.6	Very high	3 Å²	3	36.9 Å²	36.9	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-52.9	-55.9	-173.3	-168.5	-98.8	0	0	0	113.5	L525 N526 F534 L647 V650 L658 F659 E893 L897	L525-Y530 HydrophobicContact CD1-CD2 3.77Å; L525-Y530 HydrophobicContact CD1-CE2 4.49Å; L525-Y530 HydrophobicContact CD2-CD2 4.25Å; L525-Y530 HydrophobicContact CD2-CE2 4.25Å; L525-Y530 HydrophobicContact CG-CD2 4.16Å; N526-Y530 WeakPolarHBondContact O-CB 3.46Å; N526-Y530 PolarHBondContact O-N 3.17Å; N526-Y530 VanDerWaalsContact O-N 3.1Å; Y530-F534 HydrophobicContact CD1-CD2 4.37Å; Y530-F534 HydrophobicContact CD2-CD2 4.06Å; Y530-F534 AromaticContact CD2-CE2 3.83Å; Y530-F534 HydrophobicContact CD2-CE2 3.83Å; Y530-F534 HydrophobicContact CE1-CD2 4.21Å; Y530-F534 HydrophobicContact CE1-CE2 4.49Å; Y530-F534 AromaticContact CE2-CD2 3.91Å; Y530-F534 HydrophobicContact CE2-CD2 3.91Å; Y530-F534 AromaticContact CE2-CE2 3.44Å; Y530-F534 HydrophobicContact CE2-CE2 3.44Å; Y530-F534 VanDerWaalsContact CE2-CE2 3.44Å; Y530-F534 HydrophobicContact CG-CD2 4.3Å; Y530-F534 AromaticContact CZ-CD2 3.98Å; Y530-F534 AromaticContact CZ-CE2 3.81Å; Y530-F534 WeakPolarHBondContact O-CD2 3.34Å; Y530-F534 PolarHBondContact O-N 3.08Å; Y530-F534 VanDerWaalsContact O-N 3.17Å; Y530-L647 HydrophobicContact CD1-CD2 4.28Å; Y530-L647 HydrophobicContact CE1-CD2 3.84Å; Y530-V650 HydrophobicContact CE1-CG1 4.11Å; Y530-L658 HydrophobicContact CD1-CD1 4.36Å; Y530-L658 HydrophobicContact CE1-CD1 4.08Å; Y530-F659 AromaticContact CD2-CE2 3.74Å; Y530-F659 HydrophobicContact CD2-CE2 3.74Å; Y530-F659 AromaticContact CD2-CZ 3.61Å; Y530-F659 HydrophobicContact CD2-CZ 3.61Å; Y530-F659 HydrophobicContact CE2-CE2 4.24Å; Y530-F659 HydrophobicContact CE2-CZ 4.17Å; Y530-F659 HydrophobicContact CG-CE2 4.38Å; Y530-E893 VanDerWaalsContact CE2-OE1 3.25Å; Y530-E893 WeakPolarHBondContact CE2-OE1 3.03Å; Y530-E893 PolarHBondContact OH-OE1 2.86Å; Y530-L897 HydrophobicContact CE1-CD1 3.75Å; Y530-L897 WeakPolarHBondContact OH-CD1 3.48Å
531	K	94.2	Very high	93	Very high	79 Å²	79	37.5 Å²	37.5	34%	0.343	19%	0.192	S	C	.	.	H	α-helix	trans	-61.8	-51	-178.4	174.9	-177.8	168.7	171.8	0	111.1	N529 S535 E648 I651	N529-K531 PolarHBondContact O-N 3.47Å; K531-S535 WeakPolarHBondContact O-CB 3.31Å; K531-S535 PolarHBondContact O-N 3.35Å; K531-E648 HydrophobicContact CD-CG 4.32Å; K531-E648 VanDerWaalsContact CE-OE1 3.32Å; K531-E648 WeakPolarHBondContact CE-OE1 3.32Å; K531-E648 IonicContact NZ-OE1 3.5Å; K531-E648 PolarHBondContact NZ-OE1 2.93Å; K531-I651 HydrophobicContact CD-CD1 4.38Å
532	E	93.2	Very high	93.2	Very high	113 Å²	113	37.5 Å²	37.5	53%	0.528	19%	0.192	S	C	.	.	H	α-helix	trans	-67.7	-39.8	-174.3	-62.6	-171.3	168.1	0	0	112.2	L520 N529 T536	L520-E532 HydrophobicContact CD1-CB 4.33Å; L520-E532 HydrophobicContact CD2-CB 3.79Å; L520-E532 VanDerWaalsContact CD2-OE2 3.23Å; L520-E532 WeakPolarHBondContact CD2-OE2 3.46Å; N529-E532 PolarHBondContact O-N 3.03Å; E532-T536 WeakPolarHBondContact O-CB 3.29Å; E532-T536 PolarHBondContact O-N 3.17Å; E532-T536 PolarHBondContact O-OG1 2.73Å
533	K	95	Very high	93.6	Very high	20 Å²	20	37.4 Å²	37.4	9%	0.087	19%	0.191	C	C	.	.	H	α-helix	trans	-61.1	-57.8	176.9	-171.5	163.2	-170.9	167	0	110.4	L520 L521 E523 L525 N529 S535 T536 L537	L520-K533 VanDerWaalsContact CD1-CA 3.47Å; L520-K533 HydrophobicContact CD1-CB 3.75Å; L520-K533 HydrophobicContact CD1-CG 4.28Å; L521-K533 HydrophobicContact CD2-CG 4.03Å; L521-K533 WeakPolarHBondContact O-CE 3.41Å; L521-K533 PolarHBondContact O-NZ 2.97Å; E523-K533 PolarHBondContact O-NZ 3.12Å; L525-K533 HydrophobicContact CD1-CB 4.44Å; L525-K533 HydrophobicContact CD1-CD 4.03Å; N529-K533 WeakPolarHBondContact O-CB 3.41Å; N529-K533 PolarHBondContact O-N 3.28Å; K533-S535 PolarHBondContact O-N 2.72Å; K533-T536 WeakPolarHBondContact O-CB 2.95Å; K533-T536 PolarHBondContact O-N 2.81Å; K533-L537 HydrophobicContact CG-CD1 4.4Å; K533-L537 WeakPolarHBondContact O-CG 3.42Å; K533-L537 PolarHBondContact O-N 2.77Å
534	F	97	Very high	93.8	Very high	8 Å²	8	37 Å²	37	4%	0.035	19%	0.187	C	C	.	.	H	α-helix	trans	-66.8	-34.6	-179	-77.5	-66.1	0	0	0	113.3	L525 Y530 T536 L537 L538 L647 E893 P894 L933	L525-F534 HydrophobicContact CD1-CD2 4.31Å; L525-F534 HydrophobicContact CD1-CE2 3.82Å; L525-F534 HydrophobicContact CD2-CE2 3.65Å; L525-F534 HydrophobicContact CD2-CZ 3.85Å; L525-F534 HydrophobicContact CG-CE2 4.4Å; Y530-F534 HydrophobicContact CD1-CD2 4.37Å; Y530-F534 HydrophobicContact CD2-CD2 4.06Å; Y530-F534 AromaticContact CD2-CE2 3.83Å; Y530-F534 HydrophobicContact CD2-CE2 3.83Å; Y530-F534 HydrophobicContact CE1-CD2 4.21Å; Y530-F534 HydrophobicContact CE1-CE2 4.49Å; Y530-F534 AromaticContact CE2-CD2 3.91Å; Y530-F534 HydrophobicContact CE2-CD2 3.91Å; Y530-F534 AromaticContact CE2-CE2 3.44Å; Y530-F534 HydrophobicContact CE2-CE2 3.44Å; Y530-F534 VanDerWaalsContact CE2-CE2 3.44Å; Y530-F534 HydrophobicContact CG-CD2 4.3Å; Y530-F534 AromaticContact CZ-CD2 3.98Å; Y530-F534 AromaticContact CZ-CE2 3.81Å; Y530-F534 WeakPolarHBondContact O-CD2 3.34Å; Y530-F534 PolarHBondContact O-N 3.08Å; Y530-F534 VanDerWaalsContact O-N 3.17Å; F534-T536 VanDerWaalsContact C-N 3.31Å; F534-T536 PolarHBondContact O-N 3.03Å; F534-L537 HydrophobicContact CD1-CD1 3.97Å; F534-L537 HydrophobicContact CE1-CD1 4.28Å; F534-L537 PolarHBondContact O-N 2.93Å; F534-L538 VanDerWaalsContact O-CG 3.3Å; F534-L538 WeakPolarHBondContact O-CG 3.45Å; F534-L538 PolarHBondContact O-N 2.87Å; F534-L647 HydrophobicContact CB-CD1 3.52Å; F534-L647 HydrophobicContact CB-CD2 3.64Å; F534-L647 HydrophobicContact CB-CG 4.25Å; F534-L647 HydrophobicContact CD2-CD2 4.22Å; F534-L647 HydrophobicContact CG-CD2 4.18Å; F534-E893 HydrophobicContact CE1-CB 4.08Å; F534-E893 HydrophobicContact CE1-CG 4.27Å; F534-E893 HydrophobicContact CE2-CG 4.23Å; F534-E893 HydrophobicContact CZ-CB 4.09Å; F534-E893 HydrophobicContact CZ-CG 3.85Å; F534-E893 WeakPolarHBondContact CZ-OE2 3.26Å; F534-P894 HydrophobicContact CB-CG 4.05Å; F534-P894 HydrophobicContact CD1-CG 3.69Å; F534-P894 HydrophobicContact CE1-CG 4.42Å; F534-P894 HydrophobicContact CG-CG 4.04Å; F534-L933 HydrophobicContact CD1-CD1 4.2Å
535	S	96.3	Very high	94	Very high	12 Å²	12	32 Å²	32	8%	0.084	16%	0.161	C	C	.	.	H	α-helix	trans	-61.2	-42	173.1	-168.5	0	0	0	0	111.2	K531 K533 L538 W539 H644	K531-S535 WeakPolarHBondContact O-CB 3.31Å; K531-S535 PolarHBondContact O-N 3.35Å; K533-S535 PolarHBondContact O-N 2.72Å; S535-L538 PolarHBondContact O-N 2.94Å; S535-W539 PolarHBondContact O-N 3.5Å; S535-W539 VanDerWaalsContact O-N 3.07Å; S535-W539 WeakPolarHBondContact OG-CH2 3.46Å; S535-W539 VanDerWaalsContact OG-CZ2 3.3Å; S535-W539 WeakPolarHBondContact OG-CZ2 3.36Å; S535-H644 PolarHBondContact O-CE1 2.74Å; S535-H644 VanDerWaalsContact O-CE1 3.24Å; S535-H644 PolarHBondContact OG-CE1 2.72Å; S535-H644 PolarHBondContact OG-ND1 2.89Å
536	T	96.4	Very high	93.9	Very high	2 Å²	2	32 Å²	32	1%	0.012	16%	0.16	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174.7	-52.9	0	0	0	0	111.4	L504 Q518 L521 E532 K533 F534 L538 W539 L540	L504-T536 HydrophobicContact CD1-CG2 4.3Å; L504-T536 HydrophobicContact CD2-CG2 4.22Å; Q518-T536 HydrophobicContact CB-CG2 4.31Å; Q518-T536 HydrophobicContact CG-CG2 3.91Å; Q518-T536 PolarHBondContact NE2-OG1 3.23Å; L521-T536 HydrophobicContact CD1-CG2 4.08Å; L521-T536 HydrophobicContact CD2-CG2 4.1Å; L521-T536 HydrophobicContact CG-CG2 4.36Å; E532-T536 WeakPolarHBondContact O-CB 3.29Å; E532-T536 PolarHBondContact O-N 3.17Å; E532-T536 PolarHBondContact O-OG1 2.73Å; K533-T536 WeakPolarHBondContact O-CB 2.95Å; K533-T536 PolarHBondContact O-N 2.81Å; F534-T536 VanDerWaalsContact C-N 3.31Å; F534-T536 PolarHBondContact O-N 3.03Å; T536-L538 VanDerWaalsContact C-N 3.32Å; T536-L538 PolarHBondContact O-N 3.42Å; T536-W539 PolarHBondContact O-N 3.19Å; T536-L540 HydrophobicContact CG2-CD1 4.21Å; T536-L540 HydrophobicContact CG2-CG 4.39Å; T536-L540 WeakPolarHBondContact O-CG 3.33Å; T536-L540 PolarHBondContact O-N 3.08Å
537	L	97	Very high	93.7	Very high	1 Å²	1	33 Å²	33	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-39.9	179	-62.9	175	0	0	0	112.4	L521 K533 F534 L540 E541 L933	L521-L537 HydrophobicContact CD2-CD2 3.96Å; L521-L537 HydrophobicContact CD2-CG 4.28Å; K533-L537 HydrophobicContact CG-CD1 4.4Å; K533-L537 WeakPolarHBondContact O-CG 3.42Å; K533-L537 PolarHBondContact O-N 2.77Å; F534-L537 HydrophobicContact CD1-CD1 3.97Å; F534-L537 HydrophobicContact CE1-CD1 4.28Å; F534-L537 PolarHBondContact O-N 2.93Å; L537-L540 HydrophobicContact CD2-CD1 4.41Å; L537-L540 PolarHBondContact O-N 3.21Å; L537-E541 PolarHBondContact O-N 3.21Å; L537-L933 HydrophobicContact CB-CB 4.17Å; L537-L933 HydrophobicContact CB-CD1 4.02Å; L537-L933 HydrophobicContact CB-CD2 4.14Å; L537-L933 HydrophobicContact CB-CG 4.33Å; L537-L933 HydrophobicContact CD1-CB 4.19Å; L537-L933 HydrophobicContact CD1-CD1 4.44Å
538	L	97.4	Very high	93.4	Very high	14 Å²	14	32.2 Å²	32.2	7%	0.073	16%	0.16	C	C	.	.	H	α-helix	trans	-63.2	-44.4	174.9	-71.1	171.2	0	0	0	111.7	F534 S535 T536 L540 E541 E542 C643 H644 L647 P894	F534-L538 VanDerWaalsContact O-CG 3.3Å; F534-L538 WeakPolarHBondContact O-CG 3.45Å; F534-L538 PolarHBondContact O-N 2.87Å; S535-L538 PolarHBondContact O-N 2.94Å; T536-L538 VanDerWaalsContact C-N 3.32Å; T536-L538 PolarHBondContact O-N 3.42Å; L538-L540 VanDerWaalsContact C-N 3.32Å; L538-L540 PolarHBondContact O-N 3.24Å; L538-E541 PolarHBondContact O-N 2.73Å; L538-E542 WeakPolarHBondContact O-CB 3.42Å; L538-E542 PolarHBondContact O-N 3.19Å; L538-C643 HydrophobicContact CD1-CB 3.56Å; L538-C643 HydrophobicContact CD2-CB 3.87Å; L538-C643 HydrophobicContact CG-CB 4.39Å; L538-H644 WeakPolarHBondContact CB-NE2 3.42Å; L538-L647 HydrophobicContact CD1-CD1 3.65Å; L538-P894 HydrophobicContact CD1-CB 4.11Å; L538-P894 HydrophobicContact CD1-CG 4.37Å; L538-P894 HydrophobicContact CD2-CB 4.24Å; L538-P894 HydrophobicContact CD2-CG 4.28Å; L538-P894 HydrophobicContact CG-CB 4.49Å; L538-P894 HydrophobicContact CG-CG 4.37Å
539	W	97.1	Very high	93.1	Very high	39 Å²	39	28.1 Å²	28.1	15%	0.148	13%	0.13	C	C	.	.	H	α-helix	trans	-64.1	-36.3	174.5	-68.5	-39.7	0	0	0	112.6	Y498 I500 P501 L504 S535 T536 E541 E542 I543 H644	Y498-W539 PolarHBondContact O-NE1 3.37Å; I500-W539 HydrophobicContact CG1-CB 4.37Å; I500-W539 HydrophobicContact CG1-CG 4.19Å; P501-W539 VanDerWaalsContact CD-CD2 3.46Å; P501-W539 HydrophobicContact CG-CD2 4.19Å; P501-W539 HydrophobicContact CG-CE3 3.77Å; P501-W539 HydrophobicContact CG-CH2 3.88Å; P501-W539 HydrophobicContact CG-CZ2 4.25Å; P501-W539 HydrophobicContact CG-CZ3 3.63Å; L504-W539 HydrophobicContact CD2-CB 3.53Å; L504-W539 HydrophobicContact CD2-CD2 4.31Å; L504-W539 HydrophobicContact CD2-CE3 3.87Å; L504-W539 HydrophobicContact CD2-CG 4.24Å; S535-W539 PolarHBondContact O-N 3.5Å; S535-W539 VanDerWaalsContact O-N 3.07Å; S535-W539 WeakPolarHBondContact OG-CH2 3.46Å; S535-W539 VanDerWaalsContact OG-CZ2 3.3Å; S535-W539 WeakPolarHBondContact OG-CZ2 3.36Å; T536-W539 PolarHBondContact O-N 3.19Å; W539-E541 VanDerWaalsContact C-N 3.34Å; W539-E542 PolarHBondContact O-N 3.48Å; W539-I543 WeakPolarHBondContact O-CB 3.49Å; W539-I543 WeakPolarHBondContact O-CD1 3.47Å; W539-I543 WeakPolarHBondContact O-CG1 3.3Å; W539-I543 PolarHBondContact O-N 3.18Å; W539-H644 AromaticContact CD1-CE1 3.62Å; W539-H644 AromaticContact CD1-NE2 3.46Å; W539-H644 AromaticContact CD2-CE1 3.94Å; W539-H644 AromaticContact CE2-CE1 3.51Å; W539-H644 AromaticContact NE1-CE1 3.32Å; W539-H644 PolarHBondContact NE1-CE1 2.95Å; W539-H644 VanDerWaalsContact NE1-CE1 3.32Å; W539-H644 AromaticContact NE1-NE2 3.38Å; W539-H644 PolarHBondContact NE1-NE2 2.95Å
540	L	95.9	Very high	92.7	Very high	3 Å²	3	31.9 Å²	31.9	2%	0.016	15%	0.146	C	C	.	.	H	α-helix	trans	-65.3	-36.6	175.7	-72.1	173.1	0	0	0	112.4	L504 V508 I514 L521 T536 L537 L538 Y544 S925 L927 A928	L504-L540 HydrophobicContact CD1-CD2 3.96Å; V508-L540 HydrophobicContact CG2-CD2 3.65Å; I514-L540 HydrophobicContact CD1-CD2 4.06Å; I514-L540 HydrophobicContact CG1-CD1 4.36Å; I514-L540 HydrophobicContact CG1-CD2 4.45Å; L521-L540 HydrophobicContact CD1-CD1 4.13Å; T536-L540 HydrophobicContact CG2-CD1 4.21Å; T536-L540 HydrophobicContact CG2-CG 4.39Å; T536-L540 WeakPolarHBondContact O-CG 3.33Å; T536-L540 PolarHBondContact O-N 3.08Å; L537-L540 HydrophobicContact CD2-CD1 4.41Å; L537-L540 PolarHBondContact O-N 3.21Å; L538-L540 VanDerWaalsContact C-N 3.32Å; L538-L540 PolarHBondContact O-N 3.24Å; L540-Y544 WeakPolarHBondContact O-CB 3.43Å; L540-Y544 PolarHBondContact O-N 3.22Å; L540-S925 WeakPolarHBondContact O-CB 3.48Å; L540-S925 PolarHBondContact O-OG 3.41Å; L540-L927 HydrophobicContact CD1-CB 4.08Å; L540-L927 HydrophobicContact CD2-CB 4.48Å; L540-L927 HydrophobicContact CD2-CD1 4.1Å; L540-A928 HydrophobicContact CB-CB 4.26Å
541	E	95.3	Very high	92.1	Very high	27 Å²	27	38.2 Å²	38.2	13%	0.126	18%	0.175	C	C	.	.	H	α-helix	trans	-68.5	-41.9	171.7	-175.9	62.7	-166.9	0	0	111.2	L537 L538 W539 Y544 A545 I923 K924 S925 L933	L537-E541 PolarHBondContact O-N 3.21Å; L538-E541 PolarHBondContact O-N 2.73Å; W539-E541 VanDerWaalsContact C-N 3.34Å; E541-Y544 PolarHBondContact O-N 2.91Å; E541-A545 WeakPolarHBondContact O-CB 3.5Å; E541-A545 PolarHBondContact O-N 3.18Å; E541-I923 VanDerWaalsContact OE2-CG2 3.31Å; E541-I923 WeakPolarHBondContact OE2-CG2 3.45Å; E541-K924 WeakPolarHBondContact OE1-CB 3.45Å; E541-K924 PolarHBondContact OE1-N 3.23Å; E541-K924 PolarHBondContact OE2-N 3.47Å; E541-K924 VanDerWaalsContact OE2-N 3.17Å; E541-S925 WeakPolarHBondContact OE2-CB 3.1Å; E541-S925 PolarHBondContact OE2-N 2.98Å; E541-L933 HydrophobicContact CB-CD2 4.14Å
542	E	94.1	Very high	91.5	Very high	1 Å²	1	37 Å²	37	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-64.2	-46.2	178.9	-168.5	175	126.6	0	0	112.5	I500 L538 W539 Y544 A545 E546 Y635 R637 S640	I500-E542 HydrophobicContact CD1-CB 4.22Å; I500-E542 HydrophobicContact CD1-CG 3.84Å; I500-E542 WeakPolarHBondContact CD1-OE1 3.2Å; I500-E542 WeakPolarHBondContact CG1-OE1 3.26Å; L538-E542 WeakPolarHBondContact O-CB 3.42Å; L538-E542 PolarHBondContact O-N 3.19Å; W539-E542 PolarHBondContact O-N 3.48Å; E542-Y544 VanDerWaalsContact C-N 3.29Å; E542-Y544 PolarHBondContact O-N 2.61Å; E542-A545 PolarHBondContact O-N 2.93Å; E542-E546 WeakPolarHBondContact O-CG 3.47Å; E542-E546 PolarHBondContact O-N 3.16Å; E542-Y635 HydrophobicContact CG-CD1 3.96Å; E542-Y635 HydrophobicContact CG-CE1 3.94Å; E542-R637 IonicContact OE1-CZ 2.64Å; E542-R637 IonicContact OE1-NE 2.63Å; E542-R637 PolarHBondContact OE1-NE 3.16Å; E542-R637 IonicContact OE1-NH2 3.43Å; E542-R637 PolarHBondContact OE1-NH2 3.26Å; E542-R637 IonicContact OE2-NE 2.66Å; E542-R637 IonicContact OE2-NH2 2.87Å; E542-S640 WeakPolarHBondContact OE2-CB 3.35Å; E542-S640 PolarHBondContact OE2-OG 2.78Å
543	I	93.8	Very high	91.2	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-58.9	-44.4	175.3	-67.9	161.2	0	0	0	110	I500 L504 V508 W539 E546 M547	I500-I543 HydrophobicContact CD1-CG1 3.93Å; I500-I543 HydrophobicContact CG2-CD1 3.77Å; I500-I543 HydrophobicContact CG2-CG1 3.88Å; L504-I543 HydrophobicContact CD2-CD1 4.29Å; L504-I543 HydrophobicContact CG-CD1 3.96Å; V508-I543 HydrophobicContact CB-CG2 4.08Å; V508-I543 HydrophobicContact CG1-CG2 3.73Å; V508-I543 HydrophobicContact CG2-CD1 4.2Å; W539-I543 WeakPolarHBondContact O-CB 3.49Å; W539-I543 WeakPolarHBondContact O-CD1 3.47Å; W539-I543 WeakPolarHBondContact O-CG1 3.3Å; W539-I543 PolarHBondContact O-N 3.18Å; I543-E546 PolarHBondContact O-N 3.37Å; I543-M547 HydrophobicContact CG2-CG 4.39Å; I543-M547 HydrophobicContact CG2-SD 3.92Å; I543-M547 WeakPolarHBondContact O-CB 3.44Å; I543-M547 VanDerWaalsContact O-CG 3.28Å; I543-M547 WeakPolarHBondContact O-CG 3.4Å; I543-M547 PolarHBondContact O-N 2.83Å
544	Y	92	Very high	90.7	Very high	85 Å²	85	34.5 Å²	34.5	33%	0.333	16%	0.16	S	C	.	.	H	α-helix	trans	-62.7	-45.9	177.9	-177	-84.1	0	0	0	111.5	L540 E541 E542 E546 M547 E548 K924	L540-Y544 WeakPolarHBondContact O-CB 3.43Å; L540-Y544 PolarHBondContact O-N 3.22Å; E541-Y544 PolarHBondContact O-N 2.91Å; E542-Y544 VanDerWaalsContact C-N 3.29Å; E542-Y544 PolarHBondContact O-N 2.61Å; Y544-E546 VanDerWaalsContact C-N 3.33Å; Y544-E546 PolarHBondContact O-N 3.31Å; Y544-M547 PolarHBondContact O-N 2.82Å; Y544-E548 HydrophobicContact CE1-CB 4.22Å; Y544-E548 WeakPolarHBondContact O-CB 3.34Å; Y544-E548 PolarHBondContact O-N 2.87Å; Y544-K924 HydrophobicContact CD1-CB 3.61Å; Y544-K924 HydrophobicContact CE1-CB 3.48Å; Y544-K924 VanDerWaalsContact CE1-CB 3.48Å; Y544-K924 HydrophobicContact CE1-CD 4.24Å; Y544-K924 HydrophobicContact CE1-CG 4.5Å
545	A	89.6	Confident	90.2	Very high	7 Å²	7	38.7 Å²	38.7	6%	0.058	19%	0.19	C	C	.	.	H	α-helix	trans	-62.1	-39.8	178.1	0	0	0	0	0	112.1	E541 E542 L549 Y635	E541-A545 WeakPolarHBondContact O-CB 3.5Å; E541-A545 PolarHBondContact O-N 3.18Å; E542-A545 PolarHBondContact O-N 2.93Å; A545-L549 VanDerWaalsContact O-CB 3.22Å; A545-L549 WeakPolarHBondContact O-CB 3.31Å; A545-L549 PolarHBondContact O-N 2.91Å; A545-Y635 HydrophobicContact CB-CD1 4.45Å; A545-Y635 HydrophobicContact CB-CD2 3.63Å; A545-Y635 HydrophobicContact CB-CE1 4.41Å; A545-Y635 HydrophobicContact CB-CE2 3.58Å; A545-Y635 HydrophobicContact CB-CG 4.08Å
546	E	89.4	Confident	89.7	Confident	33 Å²	33	40 Å²	40	15%	0.154	21%	0.205	C	C	.	.	H	α-helix	trans	-63.1	-43.5	172.5	-74.8	-177.9	178.3	0	0	112.1	R505 E542 I543 Y544 K550	R505-E546 IonicContact CZ-OE2 3.75Å; R505-E546 IonicContact NH1-OE2 3.78Å; R505-E546 PolarHBondContact NH1-OE2 3.04Å; R505-E546 IonicContact NH2-OE1 3.68Å; R505-E546 PolarHBondContact NH2-OE1 3.44Å; R505-E546 IonicContact NH2-OE2 2.8Å; R505-E546 PolarHBondContact NH2-OE2 2.85Å; E542-E546 WeakPolarHBondContact O-CG 3.47Å; E542-E546 PolarHBondContact O-N 3.16Å; I543-E546 PolarHBondContact O-N 3.37Å; Y544-E546 VanDerWaalsContact C-N 3.33Å; Y544-E546 PolarHBondContact O-N 3.31Å; E546-K550 WeakPolarHBondContact O-CB 3.43Å; E546-K550 WeakPolarHBondContact O-CG 3.08Å; E546-K550 PolarHBondContact O-N 3.37Å
547	M	86.6	Confident	89.2	Confident	78 Å²	78	41.6 Å²	41.6	38%	0.384	21%	0.213	S	C	.	.	H	α-helix	trans	-65.1	-47	178.2	-72.5	176	68.8	0	0	111.7	V508 I543 Y544 L549 K550 E551	V508-M547 HydrophobicContact CG1-SD 4.16Å; I543-M547 HydrophobicContact CG2-CG 4.39Å; I543-M547 HydrophobicContact CG2-SD 3.92Å; I543-M547 WeakPolarHBondContact O-CB 3.44Å; I543-M547 VanDerWaalsContact O-CG 3.28Å; I543-M547 WeakPolarHBondContact O-CG 3.4Å; I543-M547 PolarHBondContact O-N 2.83Å; Y544-M547 PolarHBondContact O-N 2.82Å; M547-L549 VanDerWaalsContact C-N 3.33Å; M547-L549 PolarHBondContact O-N 2.78Å; M547-K550 WeakPolarHBondContact O-CB 3.4Å; M547-K550 PolarHBondContact O-N 3.08Å; M547-E551 PolarHBondContact O-N 3.09Å
548	E	83.6	Confident	88.9	Confident	40 Å²	40	46.3 Å²	46.3	19%	0.187	24%	0.237	C	C	.	.	H	α-helix	trans	-59	-45	176.7	-179.3	-179.3	-129.6	0	0	110.8	Y544 K550 E551 Y552 K924	Y544-E548 HydrophobicContact CE1-CB 4.22Å; Y544-E548 WeakPolarHBondContact O-CB 3.34Å; Y544-E548 PolarHBondContact O-N 2.87Å; E548-K550 VanDerWaalsContact C-N 3.35Å; E548-K550 PolarHBondContact O-N 3.03Å; E548-E551 WeakPolarHBondContact O-CB 3.45Å; E548-E551 PolarHBondContact O-N 3.16Å; E548-Y552 HydrophobicContact CG-CE2 4.36Å; E548-Y552 WeakPolarHBondContact O-CD2 2.94Å; E548-Y552 WeakPolarHBondContact O-CE2 3.48Å; E548-K924 IonicContact OE1-NZ 3.86Å; E548-K924 WeakPolarHBondContact OE2-CD 3.28Å; E548-K924 IonicContact OE2-NZ 2.88Å; E548-K924 PolarHBondContact OE2-NZ 3.22Å
549	L	84	Confident	88.6	Confident	19 Å²	19	45.6 Å²	45.6	10%	0.099	23%	0.234	C	C	.	.	H	α-helix	trans	-67.8	-35.8	-179.7	-167	66.2	0	0	0	112	A545 M547 E551 Y552 P578 F633 T634	A545-L549 VanDerWaalsContact O-CB 3.22Å; A545-L549 WeakPolarHBondContact O-CB 3.31Å; A545-L549 PolarHBondContact O-N 2.91Å; M547-L549 VanDerWaalsContact C-N 3.33Å; M547-L549 PolarHBondContact O-N 2.78Å; L549-E551 PolarHBondContact O-N 2.9Å; L549-Y552 PolarHBondContact O-N 3.45Å; L549-Y552 VanDerWaalsContact O-N 3.12Å; L549-P578 HydrophobicContact CD1-CB 3.69Å; L549-F633 HydrophobicContact CD1-CB 3.8Å; L549-F633 HydrophobicContact CD1-CG 4.42Å; L549-F633 HydrophobicContact CD2-CB 3.77Å; L549-F633 HydrophobicContact CG-CB 3.46Å; L549-F633 VanDerWaalsContact CG-CB 3.46Å; L549-T634 WeakPolarHBondContact CD2-O 3.12Å
550	K	84.7	Confident	88.2	Confident	85 Å²	85	49.4 Å²	49.4	37%	0.37	25%	0.248	S	C	.	.	H	α-helix	trans	-63	-25.4	173.9	-78.3	170.9	-178	177.6	0	113.4	E546 M547 E548 Y552 N553	E546-K550 WeakPolarHBondContact O-CB 3.43Å; E546-K550 WeakPolarHBondContact O-CG 3.08Å; E546-K550 PolarHBondContact O-N 3.37Å; M547-K550 WeakPolarHBondContact O-CB 3.4Å; M547-K550 PolarHBondContact O-N 3.08Å; E548-K550 VanDerWaalsContact C-N 3.35Å; E548-K550 PolarHBondContact O-N 3.03Å; K550-Y552 PolarHBondContact O-N 3.22Å; K550-N553 VanDerWaalsContact O-CB 3.31Å; K550-N553 WeakPolarHBondContact O-CB 3.28Å; K550-N553 PolarHBondContact O-N 3.41Å; K550-N553 VanDerWaalsContact O-N 3.12Å
551	E	80.8	Confident	87.8	Confident	136 Å²	136	55.5 Å²	55.5	64%	0.636	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-23.4	174.9	-65.7	-178.7	169.9	0	0	112.5	M547 E548 L549	M547-E551 PolarHBondContact O-N 3.09Å; E548-E551 WeakPolarHBondContact O-CB 3.45Å; E548-E551 PolarHBondContact O-N 3.16Å; L549-E551 PolarHBondContact O-N 2.9Å
552	Y	82.9	Confident	87.2	Confident	55 Å²	55	59.7 Å²	59.7	22%	0.216	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.3	-2.5	176.8	-59	-84.4	0	0	0	112.9	E548 L549 K550 M554 R577 P578 F633	E548-Y552 HydrophobicContact CG-CE2 4.36Å; E548-Y552 WeakPolarHBondContact O-CD2 2.94Å; E548-Y552 WeakPolarHBondContact O-CE2 3.48Å; L549-Y552 PolarHBondContact O-N 3.45Å; L549-Y552 VanDerWaalsContact O-N 3.12Å; K550-Y552 PolarHBondContact O-N 3.22Å; Y552-M554 WeakPolarHBondContact O-CG 3.15Å; Y552-M554 PolarHBondContact O-N 3.25Å; Y552-R577 HydrophobicContact CE1-CB 3.75Å; Y552-R577 WeakPolarHBondContact OH-CD 3.45Å; Y552-P578 HydrophobicContact CD1-CB 4.4Å; Y552-P578 HydrophobicContact CD1-CG 4.49Å; Y552-P578 HydrophobicContact CD2-CB 3.94Å; Y552-P578 HydrophobicContact CG-CB 3.84Å; Y552-P578 HydrophobicContact CG-CG 4.17Å; Y552-F633 WeakPolarHBondContact O-CE2 3.23Å
553	N	85.6	Confident	86.6	Confident	48 Å²	48	62.4 Å²	62.4	26%	0.257	32%	0.322	S	S	.	.			trans	-55.3	138.6	176.2	-73.5	-8.3	0	0	0	110.3	K550 V631 E632 F633	K550-N553 VanDerWaalsContact O-CB 3.31Å; K550-N553 WeakPolarHBondContact O-CB 3.28Å; K550-N553 PolarHBondContact O-N 3.41Å; K550-N553 VanDerWaalsContact O-N 3.12Å; N553-V631 WeakPolarHBondContact CA-O 3.27Å; N553-E632 WeakPolarHBondContact OD1-CA 3.33Å; N553-F633 PolarHBondContact OD1-N 2.86Å
554	M	85.4	Confident	85.9	Confident	31 Å²	31	69.3 Å²	69.3	15%	0.153	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	150.4	-173.5	-52.4	-173.9	-72.4	0	0	110.1	Y552 I557 L568 V570 D630 V631 F633	Y552-M554 WeakPolarHBondContact O-CG 3.15Å; Y552-M554 PolarHBondContact O-N 3.25Å; M554-I557 HydrophobicContact CB-CD1 3.24Å; M554-I557 HydrophobicContact CB-CG1 3.98Å; M554-I557 HydrophobicContact CE-CD1 3.48Å; M554-I557 VanDerWaalsContact CE-CD1 3.48Å; M554-I557 HydrophobicContact CG-CD1 3.77Å; M554-I557 HydrophobicContact SD-CD1 3.25Å; M554-I557 WeakPolarHBondContact SD-CD1 3.25Å; M554-L568 HydrophobicContact CE-CD1 3.79Å; M554-L568 HydrophobicContact CE-CD2 3.84Å; M554-L568 HydrophobicContact CE-CG 4.02Å; M554-V570 HydrophobicContact CE-CB 4.47Å; M554-V570 HydrophobicContact CE-CG1 4.41Å; M554-V570 HydrophobicContact CE-CG2 3.91Å; M554-D630 CarbonylContact O-C 3.58Å; M554-D630 WeakPolarHBondContact O-CA 3.29Å; M554-V631 HydrophobicContact CB-CB 4.31Å; M554-V631 HydrophobicContact CE-CB 4.22Å; M554-V631 HydrophobicContact CE-CG1 4.36Å; M554-V631 HydrophobicContact CE-CG2 4.23Å; M554-V631 PolarHBondContact N-O 2.86Å; M554-V631 PolarHBondContact O-N 2.95Å; M554-F633 HydrophobicContact CE-CE2 4.03Å; M554-F633 HydrophobicContact CE-CZ 3.83Å; M554-F633 HydrophobicContact CG-CE2 4.37Å
555	S	86.5	Confident	85.5	Confident	97 Å²	97	67.7 Å²	67.7	68%	0.678	36%	0.356	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128.6	144.2	179.7	49.8	0	0	0	0	110.9	I557 D630	S555-I557 PolarHBondContact O-N 2.8Å; S555-D630 WeakPolarHBondContact CA-OD1 3.46Å; S555-D630 VanDerWaalsContact CB-OD1 3.28Å; S555-D630 WeakPolarHBondContact CB-OD1 3.35Å
556	G	85.8	Confident	85.5	Confident	38 Å²	38	67.4 Å²	67.4	39%	0.392	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	63.3	33.4	177.3	0	0	0	0	0	115.6	M629 D630	G556-M629 PolarHBondContact N-O 3.42Å; G556-D630 PolarHBondContact N-OD1 2.73Å
557	I	86.2	Confident	85.6	Confident	37 Å²	37	66.2 Å²	66.2	19%	0.19	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	141	179	-64.8	-169.5	0	0	0	111.3	M554 S555 L568 M629	M554-I557 HydrophobicContact CB-CD1 3.24Å; M554-I557 HydrophobicContact CB-CG1 3.98Å; M554-I557 HydrophobicContact CE-CD1 3.48Å; M554-I557 VanDerWaalsContact CE-CD1 3.48Å; M554-I557 HydrophobicContact CG-CD1 3.77Å; M554-I557 HydrophobicContact SD-CD1 3.25Å; M554-I557 WeakPolarHBondContact SD-CD1 3.25Å; S555-I557 PolarHBondContact O-N 2.8Å; I557-L568 HydrophobicContact CD1-CD1 4.39Å; I557-L568 HydrophobicContact CG2-CD1 3.68Å; I557-M629 PolarHBondContact N-O 3.19Å; I557-M629 PolarHBondContact O-N 3.47Å
558	I	89.8	Confident	85.9	Confident	99 Å²	99	62.5 Å²	62.5	51%	0.508	33%	0.33	S	S	.	.	P	Polyproline II helix	trans	-96.2	126.7	172.5	-59.2	170.3	0	0	0	108.5	F626	I558-F626 HydrophobicContact CG2-CB 3.82Å; I558-F626 HydrophobicContact CG2-CD1 3.85Å; I558-F626 HydrophobicContact CG2-CG 4.34Å
559	L	91.3	Very high	86.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-78.5	135.4	175.3	-54	171.2	0	0	0	109.5	L566 L568 L588 L614 Y624	L559-L566 HydrophobicContact CB-CB 4.39Å; L559-L566 HydrophobicContact CB-CD2 4.39Å; L559-L566 HydrophobicContact CD1-CB 4.32Å; L559-L566 HydrophobicContact CD1-CD1 4Å; L559-L568 HydrophobicContact CD2-CB 3.92Å; L559-L568 HydrophobicContact CD2-CD1 3.74Å; L559-L568 HydrophobicContact CD2-CG 4.41Å; L559-L588 HydrophobicContact CD1-CD1 3.82Å; L559-L588 HydrophobicContact CD2-CD2 4.47Å; L559-L614 HydrophobicContact CD2-CD1 4.2Å; L559-Y624 HydrophobicContact CB-CD1 4.48Å; L559-Y624 HydrophobicContact CB-CE1 3.63Å; L559-Y624 HydrophobicContact CD1-CE1 4.32Å; L559-Y624 HydrophobicContact CD1-CE2 4.39Å; L559-Y624 HydrophobicContact CG-CE1 4.28Å; L559-Y624 PolarHBondContact N-OH 2.83Å
560	R	89.9	Confident	86.2	Confident	119 Å²	119	63.5 Å²	63.5	45%	0.449	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	153.1	173.1	-61.6	177.1	-177.6	177.5	0.2	109.2	L566 V567 E569 D611	R560-L566 CarbonylContact O-C 3.48Å; R560-L566 WeakPolarHBondContact O-CA 3.36Å; R560-V567 HydrophobicContact CB-CB 4.26Å; R560-V567 PolarHBondContact N-O 3.13Å; R560-V567 PolarHBondContact O-N 2.76Å; R560-E569 IonicContact CZ-OE2 2.79Å; R560-E569 IonicContact NE-OE2 3.47Å; R560-E569 IonicContact NH2-OE1 2.73Å; R560-E569 PolarHBondContact NH2-OE1 2.89Å; R560-E569 IonicContact NH2-OE2 3.2Å; R560-E569 PolarHBondContact NH2-OE2 2.9Å; R560-D611 IonicContact NH1-OD1 3.81Å
561	R	87.2	Confident	85.8	Confident	130 Å²	130	63.6 Å²	63.6	49%	0.491	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	127	175.7	-154.6	177.9	-150.2	179	12.8	110	L566 E621 Q622	R561-L566 HydrophobicContact CG-CD2 4.35Å; R561-E621 PolarHBondContact NH2-O 2.94Å; R561-Q622 PolarHBondContact NH2-O 3.44Å
562	N	82.7	Confident	85.2	Confident	116 Å²	116	57.9 Å²	57.9	62%	0.62	32%	0.322	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	97.3	173	-173.9	15.7	0	0	0	109	D564 L565 V567	N562-D564 PolarHBondContact O-N 3.39Å; N562-L565 PolarHBondContact N-O 3.22Å; N562-L565 PolarHBondContact O-N 2.97Å; N562-V567 HydrophobicContact CB-CG2 3.65Å
563	G	80.6	Confident	84.8	Confident	58 Å²	58	55.9 Å²	55.9	60%	0.598	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.8	-128.8	-169.2	0	0	0	0	0	111.8	L565	G563-L565 VanDerWaalsContact C-N 3.33Å
564	D	79	Confident	83.5	Confident	144 Å²	144	56.5 Å²	56.5	77%	0.77	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	1.2	179	-62.8	-28.5	0	0	0	113.5	N562	N562-D564 PolarHBondContact O-N 3.39Å
565	L	84	Confident	82.2	Confident	51 Å²	51	58.6 Å²	58.6	27%	0.267	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	151.7	-176.5	-62.5	172.3	0	0	0	111.5	N562 G563 T613 K615	N562-L565 PolarHBondContact N-O 3.22Å; N562-L565 PolarHBondContact O-N 2.97Å; G563-L565 VanDerWaalsContact C-N 3.33Å; L565-T613 HydrophobicContact CB-CG2 3.69Å; L565-T613 HydrophobicContact CD1-CG2 3.65Å; L565-T613 HydrophobicContact CG-CG2 4.23Å; L565-K615 HydrophobicContact CD2-CD 3.87Å
566	L	90.3	Very high	81.2	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.005	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	136.8	175.6	-67.4	174.7	0	0	0	109.7	L559 R560 R561 L614 I616 F620 Y624	L559-L566 HydrophobicContact CB-CB 4.39Å; L559-L566 HydrophobicContact CB-CD2 4.39Å; L559-L566 HydrophobicContact CD1-CB 4.32Å; L559-L566 HydrophobicContact CD1-CD1 4Å; R560-L566 CarbonylContact O-C 3.48Å; R560-L566 WeakPolarHBondContact O-CA 3.36Å; R561-L566 HydrophobicContact CG-CD2 4.35Å; L566-L614 PolarHBondContact O-N 3.48Å; L566-I616 HydrophobicContact CB-CD1 4.27Å; L566-I616 HydrophobicContact CD1-CD1 3.69Å; L566-F620 HydrophobicContact CD1-CD1 4.18Å; L566-F620 HydrophobicContact CD1-CE1 3.89Å; L566-Y624 HydrophobicContact CD1-CD1 4.07Å; L566-Y624 HydrophobicContact CD1-CG 4.14Å; L566-Y624 HydrophobicContact CD2-CD1 3.65Å; L566-Y624 HydrophobicContact CD2-CE1 4.23Å; L566-Y624 HydrophobicContact CD2-CG 4.46Å
567	V	91.8	Very high	80.4	Confident	8 Å²	8	59.1 Å²	59.1	5%	0.048	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.4	-176.5	-178.4	0	0	0	0	109.2	R560 N562 D611 V612 T613	R560-V567 HydrophobicContact CB-CB 4.26Å; R560-V567 PolarHBondContact N-O 3.13Å; R560-V567 PolarHBondContact O-N 2.76Å; N562-V567 HydrophobicContact CB-CG2 3.65Å; V567-D611 HydrophobicContact CG1-CB 3.69Å; V567-V612 CarbonylContact C-O 3.54Å; V567-V612 WeakPolarHBondContact CA-O 3.41Å; V567-T613 HydrophobicContact CG2-CG2 4.48Å
568	L	92.4	Very high	79.9	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	120.3	177.7	173.2	68.8	0	0	0	109.5	M554 I557 L559 V570 L586 V612 L614 V631	M554-L568 HydrophobicContact CE-CD1 3.79Å; M554-L568 HydrophobicContact CE-CD2 3.84Å; M554-L568 HydrophobicContact CE-CG 4.02Å; I557-L568 HydrophobicContact CD1-CD1 4.39Å; I557-L568 HydrophobicContact CG2-CD1 3.68Å; L559-L568 HydrophobicContact CD2-CB 3.92Å; L559-L568 HydrophobicContact CD2-CD1 3.74Å; L559-L568 HydrophobicContact CD2-CG 4.41Å; L568-V570 HydrophobicContact CD2-CG2 3.74Å; L568-V570 HydrophobicContact CG-CG2 3.77Å; L568-L586 HydrophobicContact CD2-CD2 4.08Å; L568-V612 HydrophobicContact CB-CB 4.34Å; L568-V612 PolarHBondContact N-O 3.11Å; L568-V612 PolarHBondContact O-N 3.4Å; L568-L614 HydrophobicContact CB-CD1 3.84Å; L568-L614 HydrophobicContact CB-CG 4.26Å; L568-L614 HydrophobicContact CD2-CD1 4.35Å; L568-V631 HydrophobicContact CD1-CG2 3.84Å; L568-V631 HydrophobicContact CD2-CB 4.5Å; L568-V631 HydrophobicContact CD2-CG1 3.79Å; L568-V631 HydrophobicContact CD2-CG2 4.05Å
569	E	87.8	Confident	79.1	Confident	79 Å²	79	55.6 Å²	55.6	37%	0.369	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	121.5	170.6	-175.9	176.6	-155.1	0	0	109.3	R560	R560-E569 IonicContact CZ-OE2 2.79Å; R560-E569 IonicContact NE-OE2 3.47Å; R560-E569 IonicContact NH2-OE1 2.73Å; R560-E569 PolarHBondContact NH2-OE1 2.89Å; R560-E569 IonicContact NH2-OE2 3.2Å; R560-E569 PolarHBondContact NH2-OE2 2.9Å
570	V	85.8	Confident	78.5	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.012	31%	0.313	C	S	.	.			trans	-118.3	101.1	-178.9	-175.1	0	0	0	0	108.9	M554 L568 G572 L573 P578 E610 V612 F633	M554-V570 HydrophobicContact CE-CB 4.47Å; M554-V570 HydrophobicContact CE-CG1 4.41Å; M554-V570 HydrophobicContact CE-CG2 3.91Å; L568-V570 HydrophobicContact CD2-CG2 3.74Å; L568-V570 HydrophobicContact CG-CG2 3.77Å; V570-G572 PolarHBondContact O-N 2.86Å; V570-L573 HydrophobicContact CB-CB 4.02Å; V570-L573 HydrophobicContact CB-CD2 4.17Å; V570-L573 HydrophobicContact CG1-CB 4.17Å; V570-L573 WeakPolarHBondContact O-CB 3.46Å; V570-L573 PolarHBondContact O-N 3.44Å; V570-L573 VanDerWaalsContact O-N 3.13Å; V570-P578 VanDerWaalsContact CG1-CD 3.49Å; V570-P578 HydrophobicContact CG1-CG 3.81Å; V570-E610 PolarHBondContact N-O 2.99Å; V570-V612 HydrophobicContact CB-CG2 4.31Å; V570-V612 HydrophobicContact CG2-CB 4.36Å; V570-V612 HydrophobicContact CG2-CG2 3.59Å; V570-F633 HydrophobicContact CG1-CZ 3.89Å; V570-F633 HydrophobicContact CG2-CE1 4.43Å; V570-F633 HydrophobicContact CG2-CZ 3.99Å
571	P	75.8	Confident	77.9	Confident	87 Å²	87	57.8 Å²	57.8	57%	0.565	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	131.8	-178.6	-25.1	34.1	0	0	0	112.3	L573	P571-L573 VanDerWaalsContact C-N 3.3Å
572	G	68.5	Low	77.2	Confident	16 Å²	16	52.3 Å²	52.3	17%	0.165	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	81.3	3.2	-179.6	0	0	0	0	0	114.8	V570 A574 E575 G576 R577 E610	V570-G572 PolarHBondContact O-N 2.86Å; G572-A574 VanDerWaalsContact C-N 3.29Å; G572-A574 PolarHBondContact O-N 3.05Å; G572-E575 CarbonylContact O-C 3.52Å; G572-E575 WeakPolarHBondContact O-CA 3.48Å; G572-E575 WeakPolarHBondContact O-CB 3.47Å; G572-E575 PolarHBondContact O-N 2.97Å; G572-G576 PolarHBondContact O-N 2.88Å; G572-R577 CarbonylContact C-O 3.48Å; G572-R577 PolarHBondContact O-N 3.47Å; G572-E610 PolarHBondContact N-OE1 3.38Å
573	L	74.2	Confident	76.7	Confident	13 Å²	13	48.9 Å²	48.9	7%	0.068	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-64	-34.4	175.2	-179.5	63.2	0	0	0	112.5	V570 P571 E575 G576 R577 P578 L580 I607 V612	V570-L573 HydrophobicContact CB-CB 4.02Å; V570-L573 HydrophobicContact CB-CD2 4.17Å; V570-L573 HydrophobicContact CG1-CB 4.17Å; V570-L573 WeakPolarHBondContact O-CB 3.46Å; V570-L573 PolarHBondContact O-N 3.44Å; V570-L573 VanDerWaalsContact O-N 3.13Å; P571-L573 VanDerWaalsContact C-N 3.3Å; L573-E575 PolarHBondContact O-N 3.44Å; L573-G576 WeakPolarHBondContact O-CA 3.46Å; L573-G576 PolarHBondContact O-N 2.89Å; L573-R577 PolarHBondContact N-O 3.28Å; L573-P578 VanDerWaalsContact CD1-O 3.23Å; L573-P578 WeakPolarHBondContact CD1-O 3.3Å; L573-L580 HydrophobicContact CD1-CB 4.09Å; L573-L580 HydrophobicContact CD1-CD1 3.9Å; L573-L580 HydrophobicContact CD1-CG 4.11Å; L573-L580 HydrophobicContact CD2-CD1 4.41Å; L573-I607 HydrophobicContact CD2-CG2 3.56Å; L573-I607 HydrophobicContact CG-CG2 4.1Å; L573-V612 HydrophobicContact CD2-CG2 3.19Å
574	A	58.3	Low	76.7	Confident	60 Å²	60	46.9 Å²	46.9	50%	0.496	27%	0.269	S	S	.	.	G	3₁₀ helix	trans	-61.3	-25.1	168.8	0	0	0	0	0	112.1	G572 G576 E609 E610 R1070	G572-A574 VanDerWaalsContact C-N 3.29Å; G572-A574 PolarHBondContact O-N 3.05Å; A574-G576 PolarHBondContact O-N 3.43Å; A574-E609 PolarHBondContact N-O 3.17Å; A574-E610 HydrophobicContact CB-CG 4.14Å; A574-R1070 PolarHBondContact O-NH2 3.43Å; A574-R1070 VanDerWaalsContact O-NH2 3.16Å
575	E	58.6	Low	77	Confident	75 Å²	75	43.5 Å²	43.5	35%	0.35	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-82.2	6.4	169.8	-53.3	-173.2	-173.3	0	0	113.5	G572 L573 R577 R1070	G572-E575 CarbonylContact O-C 3.52Å; G572-E575 WeakPolarHBondContact O-CA 3.48Å; G572-E575 WeakPolarHBondContact O-CB 3.47Å; G572-E575 PolarHBondContact O-N 2.97Å; L573-E575 PolarHBondContact O-N 3.44Å; E575-R577 VanDerWaalsContact C-N 3.25Å; E575-R577 PolarHBondContact O-N 3.2Å; E575-R1070 PolarHBondContact O-NE 2.89Å; E575-R1070 VanDerWaalsContact O-NE 3.11Å; E575-R1070 PolarHBondContact O-NH1 3.11Å; E575-R1070 PolarHBondContact O-NH2 3.41Å; E575-R1070 VanDerWaalsContact O-NH2 3.13Å
576	G	65.9	Low	77.2	Confident	35 Å²	35	41.1 Å²	41.1	36%	0.361	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	68.3	21.6	-177.4	0	0	0	0	0	113.9	G572 L573 A574 P578 S579	G572-G576 PolarHBondContact O-N 2.88Å; L573-G576 WeakPolarHBondContact O-CA 3.46Å; L573-G576 PolarHBondContact O-N 2.89Å; A574-G576 PolarHBondContact O-N 3.43Å; G576-P578 CarbonylContact C-O 3.53Å; G576-P578 CarbonylContact O-C 3.53Å; G576-S579 PolarHBondContact O-N 3.23Å
577	R	68.4	Low	77.2	Confident	112 Å²	112	42 Å²	42	42%	0.423	24%	0.24	S	C	.	.			trans	-134	109.8	-177.1	-75.8	-176.6	175.6	-144.1	0.5	110.3	Y552 G572 L573 E575	Y552-R577 HydrophobicContact CE1-CB 3.75Å; Y552-R577 WeakPolarHBondContact OH-CD 3.45Å; G572-R577 CarbonylContact C-O 3.48Å; G572-R577 PolarHBondContact O-N 3.47Å; L573-R577 PolarHBondContact N-O 3.28Å; E575-R577 VanDerWaalsContact C-N 3.25Å; E575-R577 PolarHBondContact O-N 3.2Å
578	P	75.1	Confident	77.1	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.013	24%	0.237	C	C	.	.	S	Bend	cis	-67.6	156	0.4	27.6	-33.2	0	0	0	112.9	L549 Y552 V570 L573 G576 L580 F633	L549-P578 HydrophobicContact CD1-CB 3.69Å; Y552-P578 HydrophobicContact CD1-CB 4.4Å; Y552-P578 HydrophobicContact CD1-CG 4.49Å; Y552-P578 HydrophobicContact CD2-CB 3.94Å; Y552-P578 HydrophobicContact CG-CB 3.84Å; Y552-P578 HydrophobicContact CG-CG 4.17Å; V570-P578 VanDerWaalsContact CG1-CD 3.49Å; V570-P578 HydrophobicContact CG1-CG 3.81Å; L573-P578 VanDerWaalsContact CD1-O 3.23Å; L573-P578 WeakPolarHBondContact CD1-O 3.3Å; G576-P578 CarbonylContact C-O 3.53Å; G576-P578 CarbonylContact O-C 3.53Å; P578-L580 HydrophobicContact CB-CD2 4.37Å; P578-L580 HydrophobicContact CB-CG 4.23Å; P578-L580 HydrophobicContact CG-CD1 3.91Å; P578-L580 HydrophobicContact CG-CD2 4.32Å; P578-L580 HydrophobicContact CG-CG 3.92Å; P578-L580 PolarHBondContact O-N 3.5Å; P578-L580 VanDerWaalsContact O-N 3.11Å; P578-F633 HydrophobicContact CG-CD1 4.43Å; P578-F633 HydrophobicContact CG-CE1 4.07Å; P578-F633 HydrophobicContact CG-CE2 4.18Å; P578-F633 HydrophobicContact CG-CZ 3.92Å
579	S	73.2	Confident	76.9	Confident	59 Å²	59	43.5 Å²	43.5	41%	0.413	25%	0.246	S	C	.	.			trans	-79	93.5	173.9	178.1	0	0	0	0	109.2	G576	G576-S579 PolarHBondContact O-N 3.23Å
580	L	79	Confident	76.8	Confident	18 Å²	18	41.2 Å²	41.2	9%	0.094	24%	0.237	C	C	.	.			trans	-106.8	144.2	178.2	-57.8	172.4	0	0	0	111.1	L573 P578 I607 V612 F633	L573-L580 HydrophobicContact CD1-CB 4.09Å; L573-L580 HydrophobicContact CD1-CD1 3.9Å; L573-L580 HydrophobicContact CD1-CG 4.11Å; L573-L580 HydrophobicContact CD2-CD1 4.41Å; P578-L580 HydrophobicContact CB-CD2 4.37Å; P578-L580 HydrophobicContact CB-CG 4.23Å; P578-L580 HydrophobicContact CG-CD1 3.91Å; P578-L580 HydrophobicContact CG-CD2 4.32Å; P578-L580 HydrophobicContact CG-CG 3.92Å; P578-L580 PolarHBondContact O-N 3.5Å; P578-L580 VanDerWaalsContact O-N 3.11Å; L580-I607 HydrophobicContact CB-CD1 3.83Å; L580-I607 WeakPolarHBondContact O-CD1 2.71Å; L580-V612 HydrophobicContact CD1-CG2 4.04Å; L580-F633 HydrophobicContact CD1-CD1 4.06Å; L580-F633 HydrophobicContact CD1-CE1 3.45Å; L580-F633 VanDerWaalsContact CD1-CE1 3.45Å; L580-F633 HydrophobicContact CD1-CZ 4.29Å; L580-F633 HydrophobicContact CD2-CD1 3.51Å; L580-F633 HydrophobicContact CD2-CE1 3.83Å; L580-F633 HydrophobicContact CD2-CG 4.49Å; L580-F633 HydrophobicContact CG-CD1 4.37Å; L580-F633 HydrophobicContact CG-CE1 4.21Å
581	Y	77.7	Confident	76.4	Confident	148 Å²	148	46.2 Å²	46.2	58%	0.58	26%	0.26	S	S	*	.			trans	-123.9	154.3	171.4	-60.5	-80.1	0	0	0	110.4	G583 D584 V604	Y581-G583 PolarHBondContact O-N 3.11Å; Y581-D584 PolarHBondContact N-OD2 3.21Å; Y581-D584 WeakPolarHBondContact O-CB 3.5Å; Y581-D584 VanDerWaalsContact O-CG 3.29Å; Y581-D584 PolarHBondContact O-N 2.98Å; Y581-V604 WeakPolarHBondContact O-CB 3.33Å
582	A	71.5	Confident	76.2	Confident	14 Å²	14	47.7 Å²	47.7	12%	0.116	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	137	167.6	0	0	0	0	0	111.2	D584 T605 F833	A582-D584 VanDerWaalsContact C-N 3.34Å; A582-T605 WeakPolarHBondContact CB-O 3.32Å; A582-F833 HydrophobicContact CB-CE1 4.45Å; A582-F833 HydrophobicContact CB-CE2 3.47Å; A582-F833 VanDerWaalsContact CB-CE2 3.47Å; A582-F833 HydrophobicContact CB-CZ 3.25Å
583	G	72.9	Confident	76	Confident	44 Å²	44	55.5 Å²	55.5	45%	0.454	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-8.2	-170.7	0	0	0	0	0	114.3	Y581 V604	Y581-G583 PolarHBondContact O-N 3.11Å; G583-V604 PolarHBondContact N-O 3.22Å
584	D	81.4	Confident	75.8	Confident	16 Å²	16	62.1 Å²	62.1	9%	0.086	32%	0.321	C	S	.	.			trans	-66.3	146.7	174.2	-75.2	-16.5	0	0	0	111.1	Y581 A582 Y603 V604	Y581-D584 PolarHBondContact N-OD2 3.21Å; Y581-D584 WeakPolarHBondContact O-CB 3.5Å; Y581-D584 VanDerWaalsContact O-CG 3.29Å; Y581-D584 PolarHBondContact O-N 2.98Å; A582-D584 VanDerWaalsContact C-N 3.34Å; D584-Y603 CarbonylContact O-C 3.54Å; D584-Y603 VanDerWaalsContact O-CA 3.3Å; D584-Y603 WeakPolarHBondContact O-CA 3.36Å; D584-V604 HydrophobicContact CB-CG2 4.18Å; D584-V604 PolarHBondContact O-N 3.29Å
585	K	84.2	Confident	76.5	Confident	74 Å²	74	61.3 Å²	61.3	32%	0.322	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	132.8	-179.9	175.4	-175.7	170.1	-173.6	0	109.6	I601 S602 Y603 T634	K585-I601 HydrophobicContact CD-CG2 4.03Å; K585-I601 HydrophobicContact CG-CG2 3.91Å; K585-S602 WeakPolarHBondContact CA-O 3.32Å; K585-Y603 HydrophobicContact CB-CD1 4.32Å; K585-Y603 HydrophobicContact CB-CE1 4.09Å; K585-T634 WeakPolarHBondContact CB-OG1 3.34Å; K585-T634 PolarHBondContact O-N 2.83Å; K585-T634 PolarHBondContact O-OG1 3.12Å
586	L	88.6	Confident	77.4	Confident	0 Å²	0	61 Å²	61	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	160.4	164.8	-51.9	83.1	0	0	0	109.4	L568 S602 V604 L614 V631 F633	L568-L586 HydrophobicContact CD2-CD2 4.08Å; L586-S602 WeakPolarHBondContact CB-OG 3.2Å; L586-S602 PolarHBondContact N-O 2.86Å; L586-S602 PolarHBondContact O-N 2.91Å; L586-S602 PolarHBondContact O-OG 2.7Å; L586-V604 HydrophobicContact CD1-CG2 3.26Å; L586-L614 HydrophobicContact CD1-CD2 3.86Å; L586-L614 HydrophobicContact CD2-CD2 4.34Å; L586-V631 HydrophobicContact CD2-CG1 3.89Å; L586-F633 HydrophobicContact CD2-CD1 3.41Å; L586-F633 VanDerWaalsContact CD2-CD1 3.41Å; L586-F633 HydrophobicContact CD2-CE1 3.28Å; L586-F633 HydrophobicContact CD2-CG 4.48Å; L586-F633 HydrophobicContact CD2-CZ 4.26Å; L586-F633 HydrophobicContact CG-CD1 3.95Å; L586-F633 HydrophobicContact CG-CE1 4.28Å
587	I	89.1	Confident	78.1	Confident	19 Å²	19	59.6 Å²	59.6	10%	0.097	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	117.4	175.9	-58.8	172	0	0	0	107	K589 E599 Y600 E632 T634	I587-K589 HydrophobicContact CG2-CG 4.06Å; I587-E599 HydrophobicContact CG2-CB 3.89Å; I587-E599 HydrophobicContact CG2-CG 4.25Å; I587-Y600 WeakPolarHBondContact CA-O 3.38Å; I587-E632 HydrophobicContact CB-CB 4.23Å; I587-E632 PolarHBondContact N-O 2.82Å; I587-E632 PolarHBondContact O-N 3.2Å; I587-T634 HydrophobicContact CD1-CG2 3.67Å; I587-T634 HydrophobicContact CG1-CG2 3.89Å
588	L	89.9	Confident	78.8	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	125	171.7	-59.8	173.2	0	0	0	108.3	L559 E599 Y600 L614 I616 F620 M629 D630 V631	L559-L588 HydrophobicContact CD1-CD1 3.82Å; L559-L588 HydrophobicContact CD2-CD2 4.47Å; L588-E599 CarbonylContact O-C 2.97Å; L588-E599 WeakPolarHBondContact O-CA 3.46Å; L588-Y600 PolarHBondContact N-O 2.79Å; L588-Y600 PolarHBondContact O-N 2.89Å; L588-L614 HydrophobicContact CD1-CD1 4.2Å; L588-L614 HydrophobicContact CD2-CD1 4.23Å; L588-I616 HydrophobicContact CD1-CD1 3.36Å; L588-I616 HydrophobicContact CD1-CG1 4.02Å; L588-F620 HydrophobicContact CD1-CE1 4.29Å; L588-M629 HydrophobicContact CB-CE 3.78Å; L588-D630 CarbonylContact C-O 3.56Å; L588-D630 WeakPolarHBondContact CA-O 3.38Å; L588-V631 HydrophobicContact CD2-CG1 4.43Å; L588-V631 HydrophobicContact CD2-CG2 3.84Å
589	K	88.7	Confident	79.4	Confident	40 Å²	40	57.6 Å²	57.6	17%	0.174	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.7	133.4	177.9	-47.4	-172.4	-179.5	163.3	0	109.9	I587 I598 E599 M629 D630 E632	I587-K589 HydrophobicContact CG2-CG 4.06Å; K589-I598 WeakPolarHBondContact CA-O 3.47Å; K589-E599 HydrophobicContact CD-CG 4.24Å; K589-E599 WeakPolarHBondContact CE-OE1 3.24Å; K589-E599 HydrophobicContact CG-CG 4.06Å; K589-E599 IonicContact NZ-OE1 3.42Å; K589-M629 VanDerWaalsContact C-CE 3.45Å; K589-M629 WeakPolarHBondContact O-CA 3.34Å; K589-M629 WeakPolarHBondContact O-CE 3.31Å; K589-D630 HydrophobicContact CB-CB 4.24Å; K589-D630 PolarHBondContact N-O 2.74Å; K589-D630 PolarHBondContact O-N 2.8Å; K589-E632 WeakPolarHBondContact CE-OE2 3.27Å; K589-E632 IonicContact NZ-OE2 3.15Å; K589-E632 PolarHBondContact NZ-OE2 2.85Å
590	T	85.4	Confident	80.1	Confident	32 Å²	32	56.6 Å²	56.6	20%	0.196	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	151.3	168.4	62	0	0	0	0	109.6	I598 Y600 M629	T590-I598 HydrophobicContact CG2-CB 4Å; T590-I598 PolarHBondContact N-O 3.26Å; T590-I598 PolarHBondContact OG1-N 2.79Å; T590-Y600 HydrophobicContact CG2-CD2 4.42Å; T590-Y600 HydrophobicContact CG2-CE2 3.71Å; T590-M629 HydrophobicContact CG2-CE 3.96Å; T590-M629 HydrophobicContact CG2-SD 4.04Å
591	Q	78.9	Confident	80.5	Confident	106 Å²	106	56.5 Å²	56.5	50%	0.495	29%	0.285	S	S	.	.	P	Polyproline II helix	trans	-56.9	142.4	165	-69.2	-173.9	-14.6	0	0	110	Y593 P628	Q591-Y593 PolarHBondContact O-N 2.81Å; Q591-P628 VanDerWaalsContact CD-CG 3.44Å; Q591-P628 HydrophobicContact CG-CG 4.33Å; Q591-P628 VanDerWaalsContact NE2-CG 3.26Å
592	E	70.7	Confident	81	Confident	118 Å²	118	49.4 Å²	49.4	55%	0.551	26%	0.258	S	S	*	.	P	Polyproline II helix	trans	-60.6	122.5	-176.5	-71.4	-172.5	158.5	0	0	111.1	S473 A597	S473-E592 VanDerWaalsContact CB-OE1 3.24Å; S473-E592 WeakPolarHBondContact CB-OE1 3.25Å; S473-E592 PolarHBondContact OG-OE1 2.91Å; E592-A597 HydrophobicContact CG-CB 4.3Å
593	Y	64.5	Low	81.6	Confident	181 Å²	181	51.9 Å²	51.9	71%	0.71	26%	0.264	S	S	*	.	B	Isolated β-bridge	trans	-115.1	120.1	171.5	-165.9	-94.5	0	0	0	108.7	Q591 G595 H596	Q591-Y593 PolarHBondContact O-N 2.81Å; Y593-G595 PolarHBondContact O-N 3.04Å; Y593-H596 PolarHBondContact N-O 3.18Å; Y593-H596 PolarHBondContact O-N 3.29Å
594	N	70	Confident	82.3	Confident	151 Å²	151	50 Å²	50	81%	0.807	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	51	36.6	-176.5	-66.7	-18.9	0	0	0	114.6	H596	N594-H596 VanDerWaalsContact C-N 3.27Å; N594-H596 PolarHBondContact O-N 2.82Å
595	G	72.8	Confident	82.3	Confident	43 Å²	43	51.4 Å²	51.4	44%	0.443	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	73.8	14.5	-179.3	0	0	0	0	0	114.7	S473 A474 Y593	S473-G595 VanDerWaalsContact CB-O 3.26Å; S473-G595 WeakPolarHBondContact CB-O 3.32Å; A474-G595 PolarHBondContact N-O 3.04Å; Y593-G595 PolarHBondContact O-N 3.04Å
596	H	77	Confident	82.3	Confident	69 Å²	69	52.4 Å²	52.4	32%	0.319	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	133.8	174.5	-164.7	61.8	0	0	0	110.2	A474 T476 Y593 N594	A474-H596 WeakPolarHBondContact O-CA 3.49Å; A474-H596 PolarHBondContact O-ND1 3.02Å; T476-H596 WeakPolarHBondContact CB-NE2 3.34Å; T476-H596 PolarHBondContact OG1-CE1 3.45Å; T476-H596 PolarHBondContact OG1-NE2 2.95Å; Y593-H596 PolarHBondContact N-O 3.18Å; Y593-H596 PolarHBondContact O-N 3.29Å; N594-H596 VanDerWaalsContact C-N 3.27Å; N594-H596 PolarHBondContact O-N 2.82Å
597	A	80	Confident	82	Confident	6 Å²	6	55.1 Å²	55.1	5%	0.05	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	136.5	173.6	0	0	0	0	0	109.7	A474 K475 T476 E592	A474-A597 PolarHBondContact O-N 2.82Å; K475-A597 WeakPolarHBondContact CA-O 3.41Å; T476-A597 PolarHBondContact N-O 2.79Å; E592-A597 HydrophobicContact CG-CB 4.3Å
598	I	83.8	Confident	81.6	Confident	52 Å²	52	59.4 Å²	59.4	27%	0.267	29%	0.292	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	126.6	174.7	-54.6	176	0	0	0	108	T476 V478 K589 T590 Y600	T476-I598 WeakPolarHBondContact O-CA 3.5Å; V478-I598 HydrophobicContact CG2-CG2 3.74Å; K589-I598 WeakPolarHBondContact CA-O 3.47Å; T590-I598 HydrophobicContact CG2-CB 4Å; T590-I598 PolarHBondContact N-O 3.26Å; T590-I598 PolarHBondContact OG1-N 2.79Å; I598-Y600 HydrophobicContact CB-CE2 3.99Å; I598-Y600 HydrophobicContact CG2-CD2 4.14Å; I598-Y600 HydrophobicContact CG2-CE1 4.12Å; I598-Y600 HydrophobicContact CG2-CE2 3.52Å
599	E	87.8	Confident	81.1	Confident	20 Å²	20	67.6 Å²	67.6	9%	0.093	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	113.6	177.8	-61.1	-169.8	158.2	0	0	109.6	K475 T476 T477 V478 I587 L588 K589	K475-E599 WeakPolarHBondContact CD-OE1 3.23Å; K475-E599 WeakPolarHBondContact CE-OE1 3.21Å; K475-E599 IonicContact NZ-OE1 3.36Å; K475-E599 PolarHBondContact NZ-OE1 3.07Å; T476-E599 PolarHBondContact O-N 3.35Å; T477-E599 CarbonylContact C-O 3.6Å; T477-E599 VanDerWaalsContact CA-O 3.3Å; T477-E599 WeakPolarHBondContact CA-O 3.45Å; T477-E599 HydrophobicContact CG2-CB 4.48Å; V478-E599 PolarHBondContact N-O 3.18Å; I587-E599 HydrophobicContact CG2-CB 3.89Å; I587-E599 HydrophobicContact CG2-CG 4.25Å; L588-E599 CarbonylContact O-C 2.97Å; L588-E599 WeakPolarHBondContact O-CA 3.46Å; K589-E599 HydrophobicContact CD-CG 4.24Å; K589-E599 WeakPolarHBondContact CE-OE1 3.24Å; K589-E599 HydrophobicContact CG-CG 4.06Å; K589-E599 IonicContact NZ-OE1 3.42Å
600	Y	87.8	Confident	80.8	Confident	37 Å²	37	69.1 Å²	69.1	15%	0.145	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	122.2	173.3	-60.9	-88.3	0	0	0	109.8	V478 I587 L588 T590 I598 S602 F620 M629	V478-Y600 HydrophobicContact CB-CD1 3.59Å; V478-Y600 HydrophobicContact CB-CE1 3.75Å; V478-Y600 HydrophobicContact CB-CG 4.45Å; V478-Y600 HydrophobicContact CG1-CD1 3.81Å; V478-Y600 HydrophobicContact CG1-CE1 3.89Å; V478-Y600 HydrophobicContact CG2-CD1 4.19Å; V478-Y600 HydrophobicContact CG2-CE1 3.85Å; V478-Y600 WeakPolarHBondContact O-CA 3.44Å; I587-Y600 WeakPolarHBondContact CA-O 3.38Å; L588-Y600 PolarHBondContact N-O 2.79Å; L588-Y600 PolarHBondContact O-N 2.89Å; T590-Y600 HydrophobicContact CG2-CD2 4.42Å; T590-Y600 HydrophobicContact CG2-CE2 3.71Å; I598-Y600 HydrophobicContact CB-CE2 3.99Å; I598-Y600 HydrophobicContact CG2-CD2 4.14Å; I598-Y600 HydrophobicContact CG2-CE1 4.12Å; I598-Y600 HydrophobicContact CG2-CE2 3.52Å; Y600-S602 PolarHBondContact O-N 2.88Å; Y600-F620 HydrophobicContact CD1-CB 3.86Å; Y600-F620 AromaticContact CD1-CD2 3.75Å; Y600-F620 HydrophobicContact CD1-CD2 3.75Å; Y600-F620 HydrophobicContact CD1-CE2 4.43Å; Y600-F620 AromaticContact CD1-CG 3.77Å; Y600-F620 HydrophobicContact CD1-CG 3.77Å; Y600-F620 AromaticContact CD2-CD2 3.86Å; Y600-F620 HydrophobicContact CD2-CD2 3.86Å; Y600-F620 AromaticContact CD2-CE2 3.72Å; Y600-F620 HydrophobicContact CD2-CE2 3.72Å; Y600-F620 HydrophobicContact CD2-CG 4.45Å; Y600-F620 HydrophobicContact CD2-CZ 4.22Å; Y600-F620 HydrophobicContact CE1-CB 3.77Å; Y600-F620 AromaticContact CE1-CD2 3.41Å; Y600-F620 HydrophobicContact CE1-CD2 3.41Å; Y600-F620 VanDerWaalsContact CE1-CD2 3.41Å; Y600-F620 HydrophobicContact CE1-CE2 4.23Å; Y600-F620 AromaticContact CE1-CG 3.79Å; Y600-F620 HydrophobicContact CE1-CG 3.79Å; Y600-F620 AromaticContact CE2-CD2 3.51Å; Y600-F620 HydrophobicContact CE2-CD2 3.51Å; Y600-F620 AromaticContact CE2-CE2 3.45Å; Y600-F620 HydrophobicContact CE2-CE2 3.45Å; Y600-F620 VanDerWaalsContact CE2-CE2 3.45Å; Y600-F620 HydrophobicContact CE2-CG 4.44Å; Y600-F620 HydrophobicContact CE2-CZ 4.37Å; Y600-F620 AromaticContact CG-CD2 3.97Å; Y600-F620 HydrophobicContact CG-CD2 3.97Å; Y600-F620 HydrophobicContact CG-CE2 4.2Å; Y600-F620 HydrophobicContact CG-CG 4.12Å; Y600-F620 AromaticContact CZ-CD2 3.28Å; Y600-F620 AromaticContact CZ-CE2 3.74Å; Y600-M629 HydrophobicContact CD2-CE 4.02Å; Y600-M629 HydrophobicContact CE2-CE 4.42Å
601	I	87.4	Confident	81	Confident	16 Å²	16	70.1 Å²	70.1	8%	0.082	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	124.6	171.3	-63.4	-179.5	0	0	0	108.5	T477 V478 V479 V480 K585 Y603	T477-I601 HydrophobicContact CG2-CD1 3.88Å; T477-I601 HydrophobicContact CG2-CG1 3.94Å; V478-I601 PolarHBondContact O-N 2.83Å; V479-I601 HydrophobicContact CG1-CD1 4.29Å; V479-I601 HydrophobicContact CG2-CD1 4Å; V480-I601 VanDerWaalsContact CG2-O 3.32Å; V480-I601 WeakPolarHBondContact CG2-O 3.32Å; K585-I601 HydrophobicContact CD-CG2 4.03Å; K585-I601 HydrophobicContact CG-CG2 3.91Å; I601-Y603 HydrophobicContact CG2-CE2 3.94Å
602	S	87.9	Confident	81.6	Confident	0 Å²	0	65 Å²	65	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	154.4	175.4	72.8	0	0	0	0	111	K585 L586 Y600 K615 I616	K585-S602 WeakPolarHBondContact CA-O 3.32Å; L586-S602 WeakPolarHBondContact CB-OG 3.2Å; L586-S602 PolarHBondContact N-O 2.86Å; L586-S602 PolarHBondContact O-N 2.91Å; L586-S602 PolarHBondContact O-OG 2.7Å; Y600-S602 PolarHBondContact O-N 2.88Å; S602-K615 CarbonylContact C-O 3.39Å; S602-K615 VanDerWaalsContact CA-O 3.31Å; S602-K615 WeakPolarHBondContact CA-O 3.49Å; S602-I616 VanDerWaalsContact CB-CG1 3.41Å
603	Y	85.5	Confident	82.5	Confident	66 Å²	66	59.9 Å²	59.9	26%	0.259	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	139.2	173.1	-66.2	-85.1	0	0	0	110.5	V480 D584 K585 I601 T605 L614 K615	V480-Y603 HydrophobicContact CG2-CD2 4.1Å; V480-Y603 HydrophobicContact CG2-CE2 4.17Å; D584-Y603 CarbonylContact O-C 3.54Å; D584-Y603 VanDerWaalsContact O-CA 3.3Å; D584-Y603 WeakPolarHBondContact O-CA 3.36Å; K585-Y603 HydrophobicContact CB-CD1 4.32Å; K585-Y603 HydrophobicContact CB-CE1 4.09Å; I601-Y603 HydrophobicContact CG2-CE2 3.94Å; Y603-T605 PolarHBondContact O-N 2.99Å; Y603-L614 WeakPolarHBondContact O-CA 3.44Å; Y603-K615 PolarHBondContact N-O 3.31Å; Y603-K615 PolarHBondContact O-N 2.81Å
604	V	86	Confident	83.7	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.018	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	127.5	170.6	-176.3	0	0	0	0	109.1	Y581 G583 D584 L586 I607 V612	Y581-V604 WeakPolarHBondContact O-CB 3.33Å; G583-V604 PolarHBondContact N-O 3.22Å; D584-V604 HydrophobicContact CB-CG2 4.18Å; D584-V604 PolarHBondContact O-N 3.29Å; L586-V604 HydrophobicContact CD1-CG2 3.26Å; V604-I607 HydrophobicContact CG1-CD1 4Å; V604-I607 HydrophobicContact CG1-CG1 3.6Å; V604-V612 HydrophobicContact CB-CG1 4.27Å; V604-V612 HydrophobicContact CG1-CG1 3.73Å; V604-V612 HydrophobicContact CG2-CG1 3.79Å
605	T	82.6	Confident	84.4	Confident	46 Å²	46	47.1 Å²	47.1	28%	0.282	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	-48	170.9	49.8	0	0	0	0	111.4	A582 Y603 T613 K615	A582-T605 WeakPolarHBondContact CB-O 3.32Å; Y603-T605 PolarHBondContact O-N 2.99Å; T605-T613 PolarHBondContact N-O 3.22Å; T605-T613 WeakPolarHBondContact OG1-CB 3.49Å; T605-T613 WeakPolarHBondContact OG1-CG2 3.26Å; T605-T613 PolarHBondContact OG1-O 2.61Å; T605-T613 VanDerWaalsContact OG1-O 3.09Å; T605-K615 HydrophobicContact CG2-CB 3.62Å
606	E	82.9	Confident	85	Confident	96 Å²	96	45 Å²	45	45%	0.449	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	149.8	-175.4	-63.3	-177.3	-166.9	0	0	110	H608 T613	E606-H608 IonicContact OE2-CD2 3.75Å; E606-H608 IonicContact OE2-CE1 2.77Å; E606-H608 IonicContact OE2-NE2 3.58Å; E606-H608 PolarHBondContact OE2-NE2 2.98Å; E606-T613 PolarHBondContact O-N 3.45Å
607	I	83.2	Confident	85.4	Confident	56 Å²	56	42.3 Å²	42.3	29%	0.287	20%	0.203	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	121.4	175.7	-61.2	171.9	0	0	0	107.2	L573 L580 V604 D611	L573-I607 HydrophobicContact CD2-CG2 3.56Å; L573-I607 HydrophobicContact CG-CG2 4.1Å; L580-I607 HydrophobicContact CB-CD1 3.83Å; L580-I607 WeakPolarHBondContact O-CD1 2.71Å; V604-I607 HydrophobicContact CG1-CD1 4Å; V604-I607 HydrophobicContact CG1-CG1 3.6Å; I607-D611 WeakPolarHBondContact CA-O 3.37Å
608	H	81.5	Confident	85.5	Confident	109 Å²	109	44.2 Å²	44.2	51%	0.505	21%	0.214	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	109.3	177.3	-65.7	-68.4	0	0	0	109	E606 E610 D611	E606-H608 IonicContact OE2-CD2 3.75Å; E606-H608 IonicContact OE2-CE1 2.77Å; E606-H608 IonicContact OE2-NE2 3.58Å; E606-H608 PolarHBondContact OE2-NE2 2.98Å; H608-E610 PolarHBondContact O-N 2.86Å; H608-D611 PolarHBondContact N-O 3.28Å; H608-D611 PolarHBondContact O-N 2.69Å
609	E	79.7	Confident	85.4	Confident	172 Å²	172	48.6 Å²	48.6	80%	0.804	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	52.7	-102.3	-175.4	-58.4	-170.1	159.1	0	0	113.4	A574	A574-E609 PolarHBondContact N-O 3.17Å
610	E	82.2	Confident	85.3	Confident	72 Å²	72	48.4 Å²	48.4	34%	0.336	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.5	-6.6	176.6	-60	-162.8	141.2	0	0	113.4	V570 G572 A574 H608	V570-E610 PolarHBondContact N-O 2.99Å; G572-E610 PolarHBondContact N-OE1 3.38Å; A574-E610 HydrophobicContact CB-CG 4.14Å; H608-E610 PolarHBondContact O-N 2.86Å
611	D	89.4	Confident	85.1	Confident	53 Å²	53	47.2 Å²	47.2	28%	0.283	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	125	-177.7	-76	-24.7	0	0	0	111.6	R560 V567 I607 H608	R560-D611 IonicContact NH1-OD1 3.81Å; V567-D611 HydrophobicContact CG1-CB 3.69Å; I607-D611 WeakPolarHBondContact CA-O 3.37Å; H608-D611 PolarHBondContact N-O 3.28Å; H608-D611 PolarHBondContact O-N 2.69Å
612	V	90.3	Very high	84.9	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	114.2	176.3	-176.5	0	0	0	0	109	V567 L568 V570 L573 L580 V604 L614	V567-V612 CarbonylContact C-O 3.54Å; V567-V612 WeakPolarHBondContact CA-O 3.41Å; L568-V612 HydrophobicContact CB-CB 4.34Å; L568-V612 PolarHBondContact N-O 3.11Å; L568-V612 PolarHBondContact O-N 3.4Å; V570-V612 HydrophobicContact CB-CG2 4.31Å; V570-V612 HydrophobicContact CG2-CB 4.36Å; V570-V612 HydrophobicContact CG2-CG2 3.59Å; L573-V612 HydrophobicContact CD2-CG2 3.19Å; L580-V612 HydrophobicContact CD1-CG2 4.04Å; V604-V612 HydrophobicContact CB-CG1 4.27Å; V604-V612 HydrophobicContact CG1-CG1 3.73Å; V604-V612 HydrophobicContact CG2-CG1 3.79Å; V612-L614 HydrophobicContact CG1-CD2 3.75Å
613	T	90.4	Very high	84.7	Confident	10 Å²	10	57.2 Å²	57.2	6%	0.061	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	128.1	173.4	-53.6	0	0	0	0	109.5	L565 V567 T605 E606	L565-T613 HydrophobicContact CB-CG2 3.69Å; L565-T613 HydrophobicContact CD1-CG2 3.65Å; L565-T613 HydrophobicContact CG-CG2 4.23Å; V567-T613 HydrophobicContact CG2-CG2 4.48Å; T605-T613 PolarHBondContact N-O 3.22Å; T605-T613 WeakPolarHBondContact OG1-CB 3.49Å; T605-T613 WeakPolarHBondContact OG1-CG2 3.26Å; T605-T613 PolarHBondContact OG1-O 2.61Å; T605-T613 VanDerWaalsContact OG1-O 3.09Å; E606-T613 PolarHBondContact O-N 3.45Å
614	L	89.7	Confident	84.8	Confident	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	137.5	-174.6	-59.2	179.7	0	0	0	110.8	L559 L566 L568 L586 L588 Y603 V612 I616	L559-L614 HydrophobicContact CD2-CD1 4.2Å; L566-L614 PolarHBondContact O-N 3.48Å; L568-L614 HydrophobicContact CB-CD1 3.84Å; L568-L614 HydrophobicContact CB-CG 4.26Å; L568-L614 HydrophobicContact CD2-CD1 4.35Å; L586-L614 HydrophobicContact CD1-CD2 3.86Å; L586-L614 HydrophobicContact CD2-CD2 4.34Å; L588-L614 HydrophobicContact CD1-CD1 4.2Å; L588-L614 HydrophobicContact CD2-CD1 4.23Å; Y603-L614 WeakPolarHBondContact O-CA 3.44Å; V612-L614 HydrophobicContact CG1-CD2 3.75Å; L614-I616 HydrophobicContact CB-CD1 4.16Å; L614-I616 HydrophobicContact CB-CG1 4.37Å
615	K	84.1	Confident	84.8	Confident	63 Å²	63	60 Å²	60	27%	0.274	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	125.1	165.4	-171.7	73.5	-162.5	150.9	0	110.3	L565 S602 Y603 T605 E621	L565-K615 HydrophobicContact CD2-CD 3.87Å; S602-K615 CarbonylContact C-O 3.39Å; S602-K615 VanDerWaalsContact CA-O 3.31Å; S602-K615 WeakPolarHBondContact CA-O 3.49Å; Y603-K615 PolarHBondContact N-O 3.31Å; Y603-K615 PolarHBondContact O-N 2.81Å; T605-K615 HydrophobicContact CG2-CB 3.62Å; K615-E621 WeakPolarHBondContact CD-OE1 3.23Å; K615-E621 WeakPolarHBondContact CE-OE1 3.44Å; K615-E621 IonicContact NZ-OE1 3.87Å; K615-E621 PolarHBondContact NZ-OE1 3.47Å; K615-E621 IonicContact NZ-OE2 2.77Å; K615-E621 PolarHBondContact NZ-OE2 3.41Å
616	I	85.5	Confident	85	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	32%	0.316	C	S	.	.			trans	-128.6	179.3	-175.6	-54.8	151.1	0	0	0	108.8	L566 L588 S602 L614 F620 E621	L566-I616 HydrophobicContact CB-CD1 4.27Å; L566-I616 HydrophobicContact CD1-CD1 3.69Å; L588-I616 HydrophobicContact CD1-CD1 3.36Å; L588-I616 HydrophobicContact CD1-CG1 4.02Å; S602-I616 VanDerWaalsContact CB-CG1 3.41Å; L614-I616 HydrophobicContact CB-CD1 4.16Å; L614-I616 HydrophobicContact CB-CG1 4.37Å; I616-F620 HydrophobicContact CB-CD1 4.19Å; I616-F620 HydrophobicContact CD1-CD1 4.04Å; I616-F620 HydrophobicContact CD1-CE1 3.99Å; I616-F620 HydrophobicContact CG2-CB 4.11Å; I616-F620 HydrophobicContact CG2-CD1 3.5Å; I616-F620 HydrophobicContact CG2-CE1 4.29Å; I616-F620 HydrophobicContact CG2-CG 4.09Å; I616-E621 HydrophobicContact CB-CG 3.98Å; I616-E621 PolarHBondContact N-OE1 3.2Å
617	N	84.8	Confident	85.3	Confident	11 Å²	11	62.8 Å²	62.8	6%	0.059	32%	0.315	C	S	.	.			trans	-53.6	127	168.4	-177	-43.4	0	0	0	109.4	V478 V479 E619 F620 E621	V478-N617 HydrophobicContact CG1-CB 4.07Å; V479-N617 PolarHBondContact O-ND2 3.27Å; N617-E619 PolarHBondContact O-N 3.47Å; N617-E619 WeakPolarHBondContact OD1-CB 3.46Å; N617-E619 PolarHBondContact OD1-N 3.11Å; N617-F620 HydrophobicContact CB-CB 4.46Å; N617-F620 WeakPolarHBondContact O-CB 3.35Å; N617-F620 PolarHBondContact O-N 3.36Å; N617-E621 PolarHBondContact O-N 3.19Å
618	P	82.6	Confident	85.6	Confident	46 Å²	46	62.3 Å²	62.3	30%	0.299	32%	0.315	S	S	.	.	H	α-helix	trans	-55.3	-33	-178.7	-26.4	34.1	0	0	0	114.6	F620 E621 Q622	P618-F620 VanDerWaalsContact C-N 3.32Å; P618-E621 PolarHBondContact O-N 3.1Å; P618-Q622 WeakPolarHBondContact O-CB 3.3Å; P618-Q622 VanDerWaalsContact O-CG 3.29Å; P618-Q622 WeakPolarHBondContact O-CG 3.38Å; P618-Q622 PolarHBondContact O-N 3.46Å
619	E	82.8	Confident	86	Confident	144 Å²	144	57.3 Å²	57.3	67%	0.673	29%	0.292	S	S	*	.	H	α-helix	trans	-63.9	-40.7	176.7	-63.3	174.5	178.8	0	0	110.8	N617 A623	N617-E619 PolarHBondContact O-N 3.47Å; N617-E619 WeakPolarHBondContact OD1-CB 3.46Å; N617-E619 PolarHBondContact OD1-N 3.11Å; E619-A623 WeakPolarHBondContact O-CB 3.39Å; E619-A623 PolarHBondContact O-N 2.83Å
620	F	84.5	Confident	86.5	Confident	16 Å²	16	51.6 Å²	51.6	7%	0.07	27%	0.267	C	S	.	.	H	α-helix	trans	-70.9	-43.4	174.5	179.8	-95.6	0	0	0	111.8	L566 L588 Y600 I616 N617 P618 Q622 A623 Y624 M629	L566-F620 HydrophobicContact CD1-CD1 4.18Å; L566-F620 HydrophobicContact CD1-CE1 3.89Å; L588-F620 HydrophobicContact CD1-CE1 4.29Å; Y600-F620 HydrophobicContact CD1-CB 3.86Å; Y600-F620 AromaticContact CD1-CD2 3.75Å; Y600-F620 HydrophobicContact CD1-CD2 3.75Å; Y600-F620 HydrophobicContact CD1-CE2 4.43Å; Y600-F620 AromaticContact CD1-CG 3.77Å; Y600-F620 HydrophobicContact CD1-CG 3.77Å; Y600-F620 AromaticContact CD2-CD2 3.86Å; Y600-F620 HydrophobicContact CD2-CD2 3.86Å; Y600-F620 AromaticContact CD2-CE2 3.72Å; Y600-F620 HydrophobicContact CD2-CE2 3.72Å; Y600-F620 HydrophobicContact CD2-CG 4.45Å; Y600-F620 HydrophobicContact CD2-CZ 4.22Å; Y600-F620 HydrophobicContact CE1-CB 3.77Å; Y600-F620 AromaticContact CE1-CD2 3.41Å; Y600-F620 HydrophobicContact CE1-CD2 3.41Å; Y600-F620 VanDerWaalsContact CE1-CD2 3.41Å; Y600-F620 HydrophobicContact CE1-CE2 4.23Å; Y600-F620 AromaticContact CE1-CG 3.79Å; Y600-F620 HydrophobicContact CE1-CG 3.79Å; Y600-F620 AromaticContact CE2-CD2 3.51Å; Y600-F620 HydrophobicContact CE2-CD2 3.51Å; Y600-F620 AromaticContact CE2-CE2 3.45Å; Y600-F620 HydrophobicContact CE2-CE2 3.45Å; Y600-F620 VanDerWaalsContact CE2-CE2 3.45Å; Y600-F620 HydrophobicContact CE2-CG 4.44Å; Y600-F620 HydrophobicContact CE2-CZ 4.37Å; Y600-F620 AromaticContact CG-CD2 3.97Å; Y600-F620 HydrophobicContact CG-CD2 3.97Å; Y600-F620 HydrophobicContact CG-CE2 4.2Å; Y600-F620 HydrophobicContact CG-CG 4.12Å; Y600-F620 AromaticContact CZ-CD2 3.28Å; Y600-F620 AromaticContact CZ-CE2 3.74Å; I616-F620 HydrophobicContact CB-CD1 4.19Å; I616-F620 HydrophobicContact CD1-CD1 4.04Å; I616-F620 HydrophobicContact CD1-CE1 3.99Å; I616-F620 HydrophobicContact CG2-CB 4.11Å; I616-F620 HydrophobicContact CG2-CD1 3.5Å; I616-F620 HydrophobicContact CG2-CE1 4.29Å; I616-F620 HydrophobicContact CG2-CG 4.09Å; N617-F620 HydrophobicContact CB-CB 4.46Å; N617-F620 WeakPolarHBondContact O-CB 3.35Å; N617-F620 PolarHBondContact O-N 3.36Å; P618-F620 VanDerWaalsContact C-N 3.32Å; F620-Q622 PolarHBondContact O-N 2.91Å; F620-A623 PolarHBondContact O-N 2.84Å; F620-Y624 HydrophobicContact CE1-CD2 4.06Å; F620-Y624 HydrophobicContact CE1-CG 4.3Å; F620-Y624 HydrophobicContact CE2-CD2 4.08Å; F620-Y624 AromaticContact CZ-CD2 3.49Å; F620-Y624 HydrophobicContact CZ-CD2 3.49Å; F620-Y624 VanDerWaalsContact CZ-CD2 3.49Å; F620-Y624 HydrophobicContact CZ-CE2 4.19Å; F620-Y624 HydrophobicContact CZ-CG 4.16Å; F620-Y624 VanDerWaalsContact O-CB 3.22Å; F620-Y624 WeakPolarHBondContact O-CB 3.29Å; F620-Y624 PolarHBondContact O-N 3.12Å; F620-M629 HydrophobicContact CE2-CE 4.17Å; F620-M629 HydrophobicContact CZ-CE 3.81Å; F620-M629 HydrophobicContact CZ-SD 4.3Å
621	E	83.4	Confident	86.8	Confident	12 Å²	12	48.3 Å²	48.3	6%	0.056	25%	0.252	C	S	.	.	H	α-helix	trans	-57.7	-35.7	177.3	-68.2	176.1	165.2	0	0	112.3	R561 K615 I616 N617 P618	R561-E621 PolarHBondContact NH2-O 2.94Å; K615-E621 WeakPolarHBondContact CD-OE1 3.23Å; K615-E621 WeakPolarHBondContact CE-OE1 3.44Å; K615-E621 IonicContact NZ-OE1 3.87Å; K615-E621 PolarHBondContact NZ-OE1 3.47Å; K615-E621 IonicContact NZ-OE2 2.77Å; K615-E621 PolarHBondContact NZ-OE2 3.41Å; I616-E621 HydrophobicContact CB-CG 3.98Å; I616-E621 PolarHBondContact N-OE1 3.2Å; N617-E621 PolarHBondContact O-N 3.19Å; P618-E621 PolarHBondContact O-N 3.1Å
622	Q	83.3	Confident	86.9	Confident	150 Å²	150	47.9 Å²	47.9	70%	0.701	25%	0.248	S	C	*	.	H	α-helix	trans	-77.2	-43.3	176.7	-71.7	175.5	18.7	0	0	112.6	R561 P618 F620	R561-Q622 PolarHBondContact NH2-O 3.44Å; P618-Q622 WeakPolarHBondContact O-CB 3.3Å; P618-Q622 VanDerWaalsContact O-CG 3.29Å; P618-Q622 WeakPolarHBondContact O-CG 3.38Å; P618-Q622 PolarHBondContact O-N 3.46Å; F620-Q622 PolarHBondContact O-N 2.91Å
623	A	84.9	Confident	86.8	Confident	76 Å²	76	48.1 Å²	48.1	63%	0.628	25%	0.249	S	C	*	.	H	α-helix	trans	-81.6	-22.1	-174.2	0	0	0	0	0	114.5	E619 F620 N625	E619-A623 WeakPolarHBondContact O-CB 3.39Å; E619-A623 PolarHBondContact O-N 2.83Å; F620-A623 PolarHBondContact O-N 2.84Å; A623-N625 PolarHBondContact O-N 2.82Å
624	Y	87.2	Confident	86.5	Confident	13 Å²	13	49.3 Å²	49.3	5%	0.051	26%	0.256	C	S	.	.			trans	-59	124.6	-178.2	-178.4	-103.6	0	0	0	111.3	L559 L566 F620 E627 M629	L559-Y624 HydrophobicContact CB-CD1 4.48Å; L559-Y624 HydrophobicContact CB-CE1 3.63Å; L559-Y624 HydrophobicContact CD1-CE1 4.32Å; L559-Y624 HydrophobicContact CD1-CE2 4.39Å; L559-Y624 HydrophobicContact CG-CE1 4.28Å; L559-Y624 PolarHBondContact N-OH 2.83Å; L566-Y624 HydrophobicContact CD1-CD1 4.07Å; L566-Y624 HydrophobicContact CD1-CG 4.14Å; L566-Y624 HydrophobicContact CD2-CD1 3.65Å; L566-Y624 HydrophobicContact CD2-CE1 4.23Å; L566-Y624 HydrophobicContact CD2-CG 4.46Å; F620-Y624 HydrophobicContact CE1-CD2 4.06Å; F620-Y624 HydrophobicContact CE1-CG 4.3Å; F620-Y624 HydrophobicContact CE2-CD2 4.08Å; F620-Y624 AromaticContact CZ-CD2 3.49Å; F620-Y624 HydrophobicContact CZ-CD2 3.49Å; F620-Y624 VanDerWaalsContact CZ-CD2 3.49Å; F620-Y624 HydrophobicContact CZ-CE2 4.19Å; F620-Y624 HydrophobicContact CZ-CG 4.16Å; F620-Y624 VanDerWaalsContact O-CB 3.22Å; F620-Y624 WeakPolarHBondContact O-CB 3.29Å; F620-Y624 PolarHBondContact O-N 3.12Å; Y624-E627 WeakPolarHBondContact CD2-OE2 3.38Å; Y624-E627 HydrophobicContact CE2-CB 4.39Å; Y624-E627 VanDerWaalsContact CE2-O 3.25Å; Y624-E627 WeakPolarHBondContact CE2-O 3.25Å; Y624-E627 PolarHBondContact OH-O 3.14Å; Y624-M629 HydrophobicContact CE2-CG 3.79Å; Y624-M629 HydrophobicContact CE2-SD 4.4Å
625	N	85.9	Confident	86.3	Confident	115 Å²	115	53.1 Å²	53.1	62%	0.615	27%	0.271	S	S	*	.			trans	-127.6	52	-174.3	-173.2	39.1	0	0	0	110.9	A623 E627	A623-N625 PolarHBondContact O-N 2.82Å; N625-E627 WeakPolarHBondContact CA-OE2 3.34Å; N625-E627 WeakPolarHBondContact CB-OE1 3.21Å; N625-E627 PolarHBondContact N-OE2 3.46Å; N625-E627 PolarHBondContact O-N 3.26Å
626	F	87.3	Confident	86.2	Confident	112 Å²	112	53.7 Å²	53.7	49%	0.491	28%	0.277	S	S	.	.	S	Bend	trans	60.8	24	175.3	-55.3	-79.9	0	0	0	114.7	I558	I558-F626 HydrophobicContact CG2-CB 3.82Å; I558-F626 HydrophobicContact CG2-CD1 3.85Å; I558-F626 HydrophobicContact CG2-CG 4.34Å
627	E	88.5	Confident	86.3	Confident	88 Å²	88	56.2 Å²	56.2	41%	0.411	29%	0.287	S	S	.	.			trans	-65.4	142.1	173	-59.8	86.9	171.4	0	0	110.6	Y624 N625 M629	Y624-E627 WeakPolarHBondContact CD2-OE2 3.38Å; Y624-E627 HydrophobicContact CE2-CB 4.39Å; Y624-E627 VanDerWaalsContact CE2-O 3.25Å; Y624-E627 WeakPolarHBondContact CE2-O 3.25Å; Y624-E627 PolarHBondContact OH-O 3.14Å; N625-E627 WeakPolarHBondContact CA-OE2 3.34Å; N625-E627 WeakPolarHBondContact CB-OE1 3.21Å; N625-E627 PolarHBondContact N-OE2 3.46Å; N625-E627 PolarHBondContact O-N 3.26Å; E627-M629 PolarHBondContact O-N 3.28Å
628	P	89.2	Confident	86.4	Confident	46 Å²	46	58 Å²	58	30%	0.299	30%	0.299	S	S	.	.			trans	-65.2	133.5	175.4	27.6	-35.4	0	0	0	111	Q591	Q591-P628 VanDerWaalsContact CD-CG 3.44Å; Q591-P628 HydrophobicContact CG-CG 4.33Å; Q591-P628 VanDerWaalsContact NE2-CG 3.26Å
629	M	89.6	Confident	86.7	Confident	4 Å²	4	58.7 Å²	58.7	2%	0.02	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	148.2	-177.4	-62.4	-67.2	-70	0	0	110.6	G556 I557 L588 K589 T590 Y600 F620 Y624 E627	G556-M629 PolarHBondContact N-O 3.42Å; I557-M629 PolarHBondContact N-O 3.19Å; I557-M629 PolarHBondContact O-N 3.47Å; L588-M629 HydrophobicContact CB-CE 3.78Å; K589-M629 VanDerWaalsContact C-CE 3.45Å; K589-M629 WeakPolarHBondContact O-CA 3.34Å; K589-M629 WeakPolarHBondContact O-CE 3.31Å; T590-M629 HydrophobicContact CG2-CE 3.96Å; T590-M629 HydrophobicContact CG2-SD 4.04Å; Y600-M629 HydrophobicContact CD2-CE 4.02Å; Y600-M629 HydrophobicContact CE2-CE 4.42Å; F620-M629 HydrophobicContact CE2-CE 4.17Å; F620-M629 HydrophobicContact CZ-CE 3.81Å; F620-M629 HydrophobicContact CZ-SD 4.3Å; Y624-M629 HydrophobicContact CE2-CG 3.79Å; Y624-M629 HydrophobicContact CE2-SD 4.4Å; E627-M629 PolarHBondContact O-N 3.28Å
630	D	90.3	Very high	87.2	Confident	53 Å²	53	52.2 Å²	52.2	28%	0.283	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	136.7	169.1	-60.2	-22.4	0	0	0	109.6	M554 S555 G556 L588 K589	M554-D630 CarbonylContact O-C 3.58Å; M554-D630 WeakPolarHBondContact O-CA 3.29Å; S555-D630 WeakPolarHBondContact CA-OD1 3.46Å; S555-D630 VanDerWaalsContact CB-OD1 3.28Å; S555-D630 WeakPolarHBondContact CB-OD1 3.35Å; G556-D630 PolarHBondContact N-OD1 2.73Å; L588-D630 CarbonylContact C-O 3.56Å; L588-D630 WeakPolarHBondContact CA-O 3.38Å; K589-D630 HydrophobicContact CB-CB 4.24Å; K589-D630 PolarHBondContact N-O 2.74Å; K589-D630 PolarHBondContact O-N 2.8Å
631	V	90.1	Very high	87.6	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.018	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	119.7	-179.2	-174.2	0	0	0	0	109.3	N553 M554 L568 L586 L588 F633	N553-V631 WeakPolarHBondContact CA-O 3.27Å; M554-V631 HydrophobicContact CB-CB 4.31Å; M554-V631 HydrophobicContact CE-CB 4.22Å; M554-V631 HydrophobicContact CE-CG1 4.36Å; M554-V631 HydrophobicContact CE-CG2 4.23Å; M554-V631 PolarHBondContact N-O 2.86Å; M554-V631 PolarHBondContact O-N 2.95Å; L568-V631 HydrophobicContact CD1-CG2 3.84Å; L568-V631 HydrophobicContact CD2-CB 4.5Å; L568-V631 HydrophobicContact CD2-CG1 3.79Å; L568-V631 HydrophobicContact CD2-CG2 4.05Å; L586-V631 HydrophobicContact CD2-CG1 3.89Å; L588-V631 HydrophobicContact CD2-CG1 4.43Å; L588-V631 HydrophobicContact CD2-CG2 3.84Å; V631-F633 HydrophobicContact CG1-CE1 4.39Å; V631-F633 HydrophobicContact CG1-CE2 4.23Å; V631-F633 HydrophobicContact CG1-CZ 4.16Å
632	E	89.6	Confident	88.1	Confident	44 Å²	44	53.5 Å²	53.5	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	120.6	169.2	175.8	172.4	-166.9	0	0	110.5	N553 I587 K589	N553-E632 WeakPolarHBondContact OD1-CA 3.33Å; I587-E632 HydrophobicContact CB-CB 4.23Å; I587-E632 PolarHBondContact N-O 2.82Å; I587-E632 PolarHBondContact O-N 3.2Å; K589-E632 WeakPolarHBondContact CE-OE2 3.27Å; K589-E632 IonicContact NZ-OE2 3.15Å; K589-E632 PolarHBondContact NZ-OE2 2.85Å
633	F	88.4	Confident	88.7	Confident	5 Å²	5	46.5 Å²	46.5	2%	0.022	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	136	175.9	-67	-76.7	0	0	0	110.2	L549 Y552 N553 M554 V570 P578 L580 L586 V631	L549-F633 HydrophobicContact CD1-CB 3.8Å; L549-F633 HydrophobicContact CD1-CG 4.42Å; L549-F633 HydrophobicContact CD2-CB 3.77Å; L549-F633 HydrophobicContact CG-CB 3.46Å; L549-F633 VanDerWaalsContact CG-CB 3.46Å; Y552-F633 WeakPolarHBondContact O-CE2 3.23Å; N553-F633 PolarHBondContact OD1-N 2.86Å; M554-F633 HydrophobicContact CE-CE2 4.03Å; M554-F633 HydrophobicContact CE-CZ 3.83Å; M554-F633 HydrophobicContact CG-CE2 4.37Å; V570-F633 HydrophobicContact CG1-CZ 3.89Å; V570-F633 HydrophobicContact CG2-CE1 4.43Å; V570-F633 HydrophobicContact CG2-CZ 3.99Å; P578-F633 HydrophobicContact CG-CD1 4.43Å; P578-F633 HydrophobicContact CG-CE1 4.07Å; P578-F633 HydrophobicContact CG-CE2 4.18Å; P578-F633 HydrophobicContact CG-CZ 3.92Å; L580-F633 HydrophobicContact CD1-CD1 4.06Å; L580-F633 HydrophobicContact CD1-CE1 3.45Å; L580-F633 VanDerWaalsContact CD1-CE1 3.45Å; L580-F633 HydrophobicContact CD1-CZ 4.29Å; L580-F633 HydrophobicContact CD2-CD1 3.51Å; L580-F633 HydrophobicContact CD2-CE1 3.83Å; L580-F633 HydrophobicContact CD2-CG 4.49Å; L580-F633 HydrophobicContact CG-CD1 4.37Å; L580-F633 HydrophobicContact CG-CE1 4.21Å; L586-F633 HydrophobicContact CD2-CD1 3.41Å; L586-F633 VanDerWaalsContact CD2-CD1 3.41Å; L586-F633 HydrophobicContact CD2-CE1 3.28Å; L586-F633 HydrophobicContact CD2-CG 4.48Å; L586-F633 HydrophobicContact CD2-CZ 4.26Å; L586-F633 HydrophobicContact CG-CD1 3.95Å; L586-F633 HydrophobicContact CG-CE1 4.28Å; V631-F633 HydrophobicContact CG1-CE1 4.39Å; V631-F633 HydrophobicContact CG1-CE2 4.23Å; V631-F633 HydrophobicContact CG1-CZ 4.16Å
634	T	84.3	Confident	89.3	Confident	34 Å²	34	43 Å²	43	21%	0.209	21%	0.214	C	C	.	.			trans	-116.6	138.5	-179.1	71.9	0	0	0	0	112.5	L549 K585 I587	L549-T634 WeakPolarHBondContact CD2-O 3.12Å; K585-T634 WeakPolarHBondContact CB-OG1 3.34Å; K585-T634 PolarHBondContact O-N 2.83Å; K585-T634 PolarHBondContact O-OG1 3.12Å; I587-T634 HydrophobicContact CD1-CG2 3.67Å; I587-T634 HydrophobicContact CG1-CG2 3.89Å
635	Y	85.3	Confident	89.6	Confident	80 Å²	80	43.6 Å²	43.6	31%	0.314	22%	0.217	S	C	.	.			trans	-78.4	132.8	-179.4	177	-106.5	0	0	0	111.6	E542 A545 R637	E542-Y635 HydrophobicContact CG-CD1 3.96Å; E542-Y635 HydrophobicContact CG-CE1 3.94Å; A545-Y635 HydrophobicContact CB-CD1 4.45Å; A545-Y635 HydrophobicContact CB-CD2 3.63Å; A545-Y635 HydrophobicContact CB-CE1 4.41Å; A545-Y635 HydrophobicContact CB-CE2 3.58Å; A545-Y635 HydrophobicContact CB-CG 4.08Å; Y635-R637 HydrophobicContact CD1-CG 4.15Å; Y635-R637 PolarHBondContact O-N 3.31Å
636	N	82.7	Confident	90	Very high	75 Å²	75	38.1 Å²	38.1	40%	0.401	19%	0.188	S	C	.	.			trans	-77	103.2	177	-172.4	-18.5	0	0	0	111.5	T638	N636-T638 PolarHBondContact O-N 2.99Å; N636-T638 VanDerWaalsContact OD1-CB 3.23Å; N636-T638 WeakPolarHBondContact OD1-CB 3.36Å; N636-T638 PolarHBondContact OD1-N 3.41Å; N636-T638 PolarHBondContact OD1-OG1 3.14Å
637	R	88.1	Confident	90.4	Very high	54 Å²	54	32.9 Å²	32.9	20%	0.204	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.5	1.2	-176.6	-52	173	72.9	-125.2	-11	114.4	Q497 Y498 E542 Y635 T639 S640 R641	Q497-R637 PolarHBondContact O-NH1 2.77Å; Q497-R637 PolarHBondContact O-NH2 3.1Å; Y498-R637 PolarHBondContact O-NH2 2.75Å; E542-R637 IonicContact OE1-CZ 2.64Å; E542-R637 IonicContact OE1-NE 2.63Å; E542-R637 PolarHBondContact OE1-NE 3.16Å; E542-R637 IonicContact OE1-NH2 3.43Å; E542-R637 PolarHBondContact OE1-NH2 3.26Å; E542-R637 IonicContact OE2-NE 2.66Å; E542-R637 IonicContact OE2-NH2 2.87Å; Y635-R637 HydrophobicContact CD1-CG 4.15Å; Y635-R637 PolarHBondContact O-N 3.31Å; R637-T639 PolarHBondContact O-N 3.45Å; R637-S640 PolarHBondContact O-N 3.21Å; R637-R641 HydrophobicContact CB-CG 4.29Å; R637-R641 WeakPolarHBondContact O-CB 3.42Å; R637-R641 VanDerWaalsContact O-CG 3.24Å; R637-R641 WeakPolarHBondContact O-CG 3.32Å; R637-R641 PolarHBondContact O-N 2.88Å
638	T	86.5	Confident	90.5	Very high	49 Å²	49	32 Å²	32	30%	0.301	16%	0.161	S	C	.	.	H	α-helix	trans	-61.6	-47	-170.8	-58	0	0	0	0	112.4	N636 R642	N636-T638 PolarHBondContact O-N 2.99Å; N636-T638 VanDerWaalsContact OD1-CB 3.23Å; N636-T638 WeakPolarHBondContact OD1-CB 3.36Å; N636-T638 PolarHBondContact OD1-N 3.41Å; N636-T638 PolarHBondContact OD1-OG1 3.14Å; T638-R642 WeakPolarHBondContact O-CG 3.4Å; T638-R642 PolarHBondContact O-N 3.12Å
639	T	89.6	Confident	90.5	Very high	59 Å²	59	33.3 Å²	33.3	36%	0.362	16%	0.163	S	C	.	.	H	α-helix	trans	-65.4	-47.4	178.4	-60.9	0	0	0	0	110.9	R637 R641 R642 C643 S865	R637-T639 PolarHBondContact O-N 3.45Å; T639-R641 PolarHBondContact O-N 2.81Å; T639-R642 PolarHBondContact O-N 3.23Å; T639-R642 VanDerWaalsContact O-N 3.14Å; T639-C643 PolarHBondContact O-N 3.28Å; T639-C643 PolarHBondContact O-SG 3.34Å; T639-C643 VanDerWaalsContact O-SG 3.35Å; T639-S865 PolarHBondContact OG1-OG 3.44Å; T639-S865 VanDerWaalsContact OG1-OG 3.1Å
640	S	93.2	Very high	90.6	Very high	8 Å²	8	33.1 Å²	33.1	6%	0.056	16%	0.162	C	C	.	.	H	α-helix	trans	-53.2	-50.7	175.4	174.9	0	0	0	0	111.6	E542 R637 R642 C643 H644	E542-S640 WeakPolarHBondContact OE2-CB 3.35Å; E542-S640 PolarHBondContact OE2-OG 2.78Å; R637-S640 PolarHBondContact O-N 3.21Å; S640-R642 VanDerWaalsContact C-N 3.32Å; S640-R642 PolarHBondContact O-N 3.36Å; S640-C643 WeakPolarHBondContact O-CA 3.43Å; S640-C643 WeakPolarHBondContact O-CB 3.45Å; S640-C643 PolarHBondContact O-N 3.42Å; S640-C643 VanDerWaalsContact O-N 3.08Å; S640-H644 PolarHBondContact O-CD2 3.08Å; S640-H644 PolarHBondContact O-N 2.92Å
641	R	93	Very high	90.6	Very high	36 Å²	36	34.7 Å²	34.7	14%	0.136	17%	0.169	C	C	.	.	H	α-helix	trans	-63	-35	179.3	-71.5	168.5	62.7	-166.1	3.5	113.2	L495 P496 Y498 R637 T639 H644 F645	L495-R641 HydrophobicContact CD2-CB 3.54Å; L495-R641 HydrophobicContact CG-CB 4.06Å; L495-R641 PolarHBondContact O-NH2 3.18Å; P496-R641 PolarHBondContact O-NE 3.13Å; P496-R641 PolarHBondContact O-NH2 2.82Å; Y498-R641 HydrophobicContact CD2-CB 4.24Å; Y498-R641 HydrophobicContact CD2-CG 4.38Å; Y498-R641 WeakPolarHBondContact CE2-O 3.37Å; R637-R641 HydrophobicContact CB-CG 4.29Å; R637-R641 WeakPolarHBondContact O-CB 3.42Å; R637-R641 VanDerWaalsContact O-CG 3.24Å; R637-R641 WeakPolarHBondContact O-CG 3.32Å; R637-R641 PolarHBondContact O-N 2.88Å; T639-R641 PolarHBondContact O-N 2.81Å; R641-H644 PolarHBondContact O-N 2.84Å; R641-F645 WeakPolarHBondContact O-CB 3.39Å; R641-F645 PolarHBondContact O-N 2.87Å
642	R	93.5	Very high	90.6	Very high	19 Å²	19	37.5 Å²	37.5	7%	0.072	18%	0.182	C	C	.	.	H	α-helix	trans	-68.2	-38.6	173.3	-74.1	179.4	178.1	157.1	2.2	111.9	L495 T638 T639 S640 F645 A646 S865 I898	L495-R642 HydrophobicContact CD1-CG 4.33Å; L495-R642 HydrophobicContact CD2-CG 4.05Å; T638-R642 WeakPolarHBondContact O-CG 3.4Å; T638-R642 PolarHBondContact O-N 3.12Å; T639-R642 PolarHBondContact O-N 3.23Å; T639-R642 VanDerWaalsContact O-N 3.14Å; S640-R642 VanDerWaalsContact C-N 3.32Å; S640-R642 PolarHBondContact O-N 3.36Å; R642-F645 PolarHBondContact O-N 3.22Å; R642-A646 WeakPolarHBondContact O-CB 3.23Å; R642-A646 PolarHBondContact O-N 3.3Å; R642-S865 WeakPolarHBondContact CD-O 3.3Å; R642-S865 PolarHBondContact NH1-O 2.68Å; R642-S865 PolarHBondContact NH1-OG 2.83Å; R642-I898 HydrophobicContact CB-CD1 3.99Å
643	C	96.5	Very high	90.7	Very high	3 Å²	3	35.6 Å²	35.6	2%	0.02	17%	0.173	C	C	.	.	H	α-helix	trans	-62.2	-46.7	172.4	-66.2	0	0	0	0	111.3	L538 T639 S640 F645 A646 L647 P894	L538-C643 HydrophobicContact CD1-CB 3.56Å; L538-C643 HydrophobicContact CD2-CB 3.87Å; L538-C643 HydrophobicContact CG-CB 4.39Å; T639-C643 PolarHBondContact O-N 3.28Å; T639-C643 PolarHBondContact O-SG 3.34Å; T639-C643 VanDerWaalsContact O-SG 3.35Å; S640-C643 WeakPolarHBondContact O-CA 3.43Å; S640-C643 WeakPolarHBondContact O-CB 3.45Å; S640-C643 PolarHBondContact O-N 3.42Å; S640-C643 VanDerWaalsContact O-N 3.08Å; C643-F645 PolarHBondContact O-N 3.46Å; C643-A646 PolarHBondContact O-N 3.42Å; C643-L647 WeakPolarHBondContact O-CG 3.34Å; C643-L647 PolarHBondContact O-N 3.12Å; C643-P894 HydrophobicContact CB-CB 3.76Å
644	H	96.3	Very high	90.8	Very high	3 Å²	3	36.3 Å²	36.3	1%	0.014	18%	0.182	C	C	.	.	H	α-helix	trans	-57.7	-47.7	174.3	-76.3	-76	0	0	0	112	Y498 S535 L538 W539 S640 R641 A646 L647 E648	Y498-H644 HydrophobicContact CD1-CB 3.77Å; Y498-H644 HydrophobicContact CD2-CB 3.47Å; Y498-H644 VanDerWaalsContact CD2-CB 3.47Å; Y498-H644 HydrophobicContact CE1-CB 4.07Å; Y498-H644 HydrophobicContact CE2-CB 3.77Å; Y498-H644 HydrophobicContact CG-CB 3.46Å; Y498-H644 VanDerWaalsContact CG-CB 3.46Å; Y498-H644 AromaticContact CG-CG 3.93Å; S535-H644 PolarHBondContact O-CE1 2.74Å; S535-H644 VanDerWaalsContact O-CE1 3.24Å; S535-H644 PolarHBondContact OG-CE1 2.72Å; S535-H644 PolarHBondContact OG-ND1 2.89Å; L538-H644 WeakPolarHBondContact CB-NE2 3.42Å; W539-H644 AromaticContact CD1-CE1 3.62Å; W539-H644 AromaticContact CD1-NE2 3.46Å; W539-H644 AromaticContact CD2-CE1 3.94Å; W539-H644 AromaticContact CE2-CE1 3.51Å; W539-H644 AromaticContact NE1-CE1 3.32Å; W539-H644 PolarHBondContact NE1-CE1 2.95Å; W539-H644 VanDerWaalsContact NE1-CE1 3.32Å; W539-H644 AromaticContact NE1-NE2 3.38Å; W539-H644 PolarHBondContact NE1-NE2 2.95Å; S640-H644 PolarHBondContact O-CD2 3.08Å; S640-H644 PolarHBondContact O-N 2.92Å; R641-H644 PolarHBondContact O-N 2.84Å; H644-A646 VanDerWaalsContact C-N 3.33Å; H644-A646 PolarHBondContact O-N 3.27Å; H644-L647 WeakPolarHBondContact O-CB 3.37Å; H644-L647 PolarHBondContact O-N 3.35Å; H644-L647 VanDerWaalsContact O-N 3.16Å; H644-E648 PolarHBondContact O-N 2.66Å
645	F	93.7	Very high	91.1	Very high	26 Å²	26	38.2 Å²	38.2	11%	0.114	19%	0.194	C	C	.	.	H	α-helix	trans	-59.2	-43.7	176.7	-169.6	-99.6	0	0	0	112.2	L495 P496 Y498 R641 R642 C643 L647 E648 H649 Y871	L495-F645 HydrophobicContact CD1-CB 3.75Å; L495-F645 HydrophobicContact CD1-CD2 4.24Å; L495-F645 HydrophobicContact CD1-CG 3.94Å; P496-F645 HydrophobicContact CG-CD2 3.85Å; P496-F645 HydrophobicContact CG-CE2 4.06Å; Y498-F645 HydrophobicContact CE2-CB 3.9Å; Y498-F645 HydrophobicContact CE2-CD2 4.38Å; Y498-F645 VanDerWaalsContact OH-CA 3.3Å; Y498-F645 WeakPolarHBondContact OH-CA 3.42Å; Y498-F645 VanDerWaalsContact OH-CD2 3.28Å; Y498-F645 WeakPolarHBondContact OH-CD2 3.27Å; R641-F645 WeakPolarHBondContact O-CB 3.39Å; R641-F645 PolarHBondContact O-N 2.87Å; R642-F645 PolarHBondContact O-N 3.22Å; C643-F645 PolarHBondContact O-N 3.46Å; F645-L647 VanDerWaalsContact C-N 3.32Å; F645-L647 PolarHBondContact O-N 3.33Å; F645-E648 PolarHBondContact O-N 2.92Å; F645-H649 AromaticContact CD1-CD2 3.64Å; F645-H649 AromaticContact CD2-CD2 3.98Å; F645-H649 AromaticContact CE1-CD2 3.25Å; F645-H649 WeakPolarHBondContact CE1-CD2 3.32Å; F645-H649 AromaticContact CE1-NE2 3.4Å; F645-H649 WeakPolarHBondContact CE1-NE2 3.29Å; F645-H649 AromaticContact CE2-CD2 3.67Å; F645-H649 AromaticContact CE2-NE2 3.35Å; F645-H649 VanDerWaalsContact CE2-NE2 3.35Å; F645-H649 WeakPolarHBondContact CE2-NE2 3.49Å; F645-H649 AromaticContact CG-CD2 3.99Å; F645-H649 AromaticContact CZ-CD2 3.31Å; F645-H649 WeakPolarHBondContact CZ-CD2 3.49Å; F645-H649 AromaticContact CZ-CE1 3.84Å; F645-H649 AromaticContact CZ-NE2 2.94Å; F645-H649 WeakPolarHBondContact CZ-NE2 3.19Å; F645-H649 PolarHBondContact O-CD2 2.89Å; F645-H649 PolarHBondContact O-N 3.48Å; F645-Y871 HydrophobicContact CD1-CD1 4.29Å; F645-Y871 AromaticContact CD1-CD2 3.81Å; F645-Y871 HydrophobicContact CD1-CD2 3.81Å; F645-Y871 HydrophobicContact CD1-CE2 4.27Å; F645-Y871 AromaticContact CD1-CG 3.86Å; F645-Y871 HydrophobicContact CD1-CG 3.86Å; F645-Y871 AromaticContact CE1-CD1 3.6Å; F645-Y871 HydrophobicContact CE1-CD1 3.6Å; F645-Y871 AromaticContact CE1-CD2 3.87Å; F645-Y871 HydrophobicContact CE1-CD2 3.87Å; F645-Y871 HydrophobicContact CE1-CE1 4.22Å; F645-Y871 AromaticContact CE1-CG 3.4Å; F645-Y871 HydrophobicContact CE1-CG 3.4Å; F645-Y871 VanDerWaalsContact CE1-CG 3.4Å
646	A	94.5	Very high	91.3	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-61	-39.5	176	0	0	0	0	0	112.2	R642 C643 H644 E648 H649 V650 L897 I898	R642-A646 WeakPolarHBondContact O-CB 3.23Å; R642-A646 PolarHBondContact O-N 3.3Å; C643-A646 PolarHBondContact O-N 3.42Å; H644-A646 VanDerWaalsContact C-N 3.33Å; H644-A646 PolarHBondContact O-N 3.27Å; A646-E648 VanDerWaalsContact C-N 3.27Å; A646-E648 PolarHBondContact O-N 2.97Å; A646-H649 PolarHBondContact O-N 3.12Å; A646-V650 WeakPolarHBondContact O-CB 3.33Å; A646-V650 WeakPolarHBondContact O-CG1 3.48Å; A646-V650 PolarHBondContact O-N 3.5Å; A646-L897 HydrophobicContact CB-CB 4.36Å; A646-I898 HydrophobicContact CB-CB 4.24Å; A646-I898 HydrophobicContact CB-CG1 3.77Å
647	L	94.7	Very high	91.7	Very high	1 Å²	1	37 Å²	37	1%	0.005	19%	0.186	C	C	.	.	H	α-helix	trans	-62.4	-32.2	176.2	-69.9	167.6	0	0	0	113.2	Y530 F534 L538 C643 H644 F645 P894 L897	Y530-L647 HydrophobicContact CD1-CD2 4.28Å; Y530-L647 HydrophobicContact CE1-CD2 3.84Å; F534-L647 HydrophobicContact CB-CD1 3.52Å; F534-L647 HydrophobicContact CB-CD2 3.64Å; F534-L647 HydrophobicContact CB-CG 4.25Å; F534-L647 HydrophobicContact CD2-CD2 4.22Å; F534-L647 HydrophobicContact CG-CD2 4.18Å; L538-L647 HydrophobicContact CD1-CD1 3.65Å; C643-L647 WeakPolarHBondContact O-CG 3.34Å; C643-L647 PolarHBondContact O-N 3.12Å; H644-L647 WeakPolarHBondContact O-CB 3.37Å; H644-L647 PolarHBondContact O-N 3.35Å; H644-L647 VanDerWaalsContact O-N 3.16Å; F645-L647 VanDerWaalsContact C-N 3.32Å; F645-L647 PolarHBondContact O-N 3.33Å; L647-P894 HydrophobicContact CD1-CB 4.37Å; L647-P894 HydrophobicContact CD1-CG 4.49Å; L647-P894 HydrophobicContact CD2-CB 4.43Å; L647-P894 HydrophobicContact CD2-CG 4.47Å; L647-P894 HydrophobicContact CG-CB 4.37Å; L647-L897 HydrophobicContact CD2-CD1 3.76Å
648	E	91.6	Very high	92	Very high	70 Å²	70	34.4 Å²	34.4	33%	0.327	18%	0.177	S	C	.	.	H	α-helix	trans	-73.8	-41.7	174.3	-56.7	-162.2	136.9	0	0	111.6	Y498 K531 H644 F645 A646	Y498-E648 HydrophobicContact CE1-CG 4.29Å; Y498-E648 WeakPolarHBondContact CE1-OE2 3.48Å; Y498-E648 VanDerWaalsContact OH-CD 3.3Å; Y498-E648 PolarHBondContact OH-OE2 2.81Å; K531-E648 HydrophobicContact CD-CG 4.32Å; K531-E648 VanDerWaalsContact CE-OE1 3.32Å; K531-E648 WeakPolarHBondContact CE-OE1 3.32Å; K531-E648 IonicContact NZ-OE1 3.5Å; K531-E648 PolarHBondContact NZ-OE1 2.93Å; H644-E648 PolarHBondContact O-N 2.66Å; F645-E648 PolarHBondContact O-N 2.92Å; A646-E648 VanDerWaalsContact C-N 3.27Å; A646-E648 PolarHBondContact O-N 2.97Å
649	H	89	Confident	92.4	Very high	74 Å²	74	32.4 Å²	32.4	34%	0.343	16%	0.164	S	C	.	.	H	α-helix	trans	-76.6	-33	-176	-84.6	-86.3	0	0	0	113.2	F645 A646 I651 H652 Y871	F645-H649 AromaticContact CD1-CD2 3.64Å; F645-H649 AromaticContact CD2-CD2 3.98Å; F645-H649 AromaticContact CE1-CD2 3.25Å; F645-H649 WeakPolarHBondContact CE1-CD2 3.32Å; F645-H649 AromaticContact CE1-NE2 3.4Å; F645-H649 WeakPolarHBondContact CE1-NE2 3.29Å; F645-H649 AromaticContact CE2-CD2 3.67Å; F645-H649 AromaticContact CE2-NE2 3.35Å; F645-H649 VanDerWaalsContact CE2-NE2 3.35Å; F645-H649 WeakPolarHBondContact CE2-NE2 3.49Å; F645-H649 AromaticContact CG-CD2 3.99Å; F645-H649 AromaticContact CZ-CD2 3.31Å; F645-H649 WeakPolarHBondContact CZ-CD2 3.49Å; F645-H649 AromaticContact CZ-CE1 3.84Å; F645-H649 AromaticContact CZ-NE2 2.94Å; F645-H649 WeakPolarHBondContact CZ-NE2 3.19Å; F645-H649 PolarHBondContact O-CD2 2.89Å; F645-H649 PolarHBondContact O-N 3.48Å; A646-H649 PolarHBondContact O-N 3.12Å; H649-I651 PolarHBondContact O-N 2.82Å; H649-I651 VanDerWaalsContact O-N 3.16Å; H649-H652 PolarHBondContact O-CE1 2.98Å; H649-H652 PolarHBondContact O-ND1 2.89Å; H649-Y871 HydrophobicContact CB-CE1 4.47Å
650	V	91.4	Very high	92.5	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-70.4	-12.6	-172.1	77.9	0	0	0	0	114.5	Y530 A646 H652 L653 L658 L897	Y530-V650 HydrophobicContact CE1-CG1 4.11Å; A646-V650 WeakPolarHBondContact O-CB 3.33Å; A646-V650 WeakPolarHBondContact O-CG1 3.48Å; A646-V650 PolarHBondContact O-N 3.5Å; V650-H652 PolarHBondContact O-N 3.17Å; V650-L653 HydrophobicContact CG2-CB 4.49Å; V650-L653 HydrophobicContact CG2-CD1 3.58Å; V650-L653 HydrophobicContact CG2-CG 4.18Å; V650-L653 WeakPolarHBondContact O-CB 3.49Å; V650-L653 PolarHBondContact O-N 2.78Å; V650-L658 HydrophobicContact CG1-CD1 4.28Å; V650-L658 HydrophobicContact CG2-CD2 4.08Å; V650-L897 HydrophobicContact CG1-CD1 4.04Å; V650-L897 HydrophobicContact CG2-CB 4.26Å; V650-L897 HydrophobicContact CG2-CD2 4.12Å; V650-L897 HydrophobicContact CG2-CG 4.48Å
651	I	90	Very high	92.4	Very high	85 Å²	85	35.7 Å²	35.7	44%	0.436	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-54.4	-31.9	-179.1	-61.9	174.6	0	0	0	111.5	M527 K531 H649 L653 G654	M527-I651 HydrophobicContact CE-CG2 4.2Å; K531-I651 HydrophobicContact CD-CD1 4.38Å; H649-I651 PolarHBondContact O-N 2.82Å; H649-I651 VanDerWaalsContact O-N 3.16Å; I651-L653 VanDerWaalsContact C-N 3.27Å; I651-L653 PolarHBondContact O-N 3.27Å; I651-G654 PolarHBondContact O-N 2.79Å; I651-G654 VanDerWaalsContact O-N 3.07Å
652	H	91.3	Very high	92.1	Very high	62 Å²	62	41.3 Å²	41.3	29%	0.287	20%	0.202	S	C	.	.	G	3₁₀ helix	trans	-64.5	-24.7	178	78	-86.3	0	0	0	114.3	H649 V650 G654 V877 G901 M903	H649-H652 PolarHBondContact O-CE1 2.98Å; H649-H652 PolarHBondContact O-ND1 2.89Å; V650-H652 PolarHBondContact O-N 3.17Å; H652-G654 PolarHBondContact O-N 2.83Å; H652-V877 WeakPolarHBondContact NE2-CG1 3.38Å; H652-G901 PolarHBondContact CE1-O 3.11Å; H652-M903 PolarHBondContact NE2-O 2.9Å
653	L	91.6	Very high	91.9	Very high	4 Å²	4	43 Å²	43	2%	0.021	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-68.8	-19.3	175	-63.8	-178.5	0	0	0	112.2	V650 I651 V657 L900 D905	V650-L653 HydrophobicContact CG2-CB 4.49Å; V650-L653 HydrophobicContact CG2-CD1 3.58Å; V650-L653 HydrophobicContact CG2-CG 4.18Å; V650-L653 WeakPolarHBondContact O-CB 3.49Å; V650-L653 PolarHBondContact O-N 2.78Å; I651-L653 VanDerWaalsContact C-N 3.27Å; I651-L653 PolarHBondContact O-N 3.27Å; L653-V657 HydrophobicContact CB-CB 3.92Å; L653-V657 HydrophobicContact CB-CG1 4.29Å; L653-V657 HydrophobicContact CB-CG2 4.06Å; L653-V657 HydrophobicContact CD1-CG1 4.09Å; L653-L900 HydrophobicContact CD1-CB 4.11Å; L653-D905 HydrophobicContact CD2-CB 4.18Å
654	G	89.8	Confident	91.5	Very high	20 Å²	20	47.2 Å²	47.2	21%	0.206	23%	0.233	C	C	.	.	H	α-helix	trans	65.4	-168.7	170.4	0	0	0	0	0	115.2	I651 H652 K656 V657 L658	I651-G654 PolarHBondContact O-N 2.79Å; I651-G654 VanDerWaalsContact O-N 3.07Å; H652-G654 PolarHBondContact O-N 2.83Å; G654-K656 VanDerWaalsContact C-N 3.29Å; G654-K656 PolarHBondContact O-N 2.96Å; G654-V657 PolarHBondContact O-N 2.85Å; G654-L658 PolarHBondContact O-N 3.47Å
655	V	90.8	Very high	91.3	Very high	75 Å²	75	52.2 Å²	52.2	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-62.7	-35.4	-178.9	-178.9	0	0	0	0	111.2	M527 V657 F659	M527-V655 HydrophobicContact CB-CG2 4.44Å; M527-V655 HydrophobicContact CG-CG2 4.26Å; M527-V655 HydrophobicContact SD-CG2 4.42Å; V655-V657 VanDerWaalsContact C-N 3.26Å; V655-V657 PolarHBondContact O-N 2.86Å; V655-F659 HydrophobicContact CG1-CB 3.83Å; V655-F659 CarbonylContact O-C 3.6Å; V655-F659 WeakPolarHBondContact O-CA 3.47Å; V655-F659 PolarHBondContact O-N 3.45Å
656	K	88.9	Confident	91.1	Very high	128 Å²	128	55.1 Å²	55.1	56%	0.557	27%	0.274	S	S	*	.	H	α-helix	trans	-57.5	-35.3	-177.2	-63.8	179.6	-177.5	175.4	0	113.6	G654 L764	G654-K656 VanDerWaalsContact C-N 3.29Å; G654-K656 PolarHBondContact O-N 2.96Å; K656-L764 HydrophobicContact CB-CD1 4.4Å
657	V	92.9	Very high	90.9	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-98.1	-44.9	-178.5	178.9	0	0	0	0	111.7	L653 G654 V655 P763 P765 I910	L653-V657 HydrophobicContact CB-CB 3.92Å; L653-V657 HydrophobicContact CB-CG1 4.29Å; L653-V657 HydrophobicContact CB-CG2 4.06Å; L653-V657 HydrophobicContact CD1-CG1 4.09Å; G654-V657 PolarHBondContact O-N 2.85Å; V655-V657 VanDerWaalsContact C-N 3.26Å; V655-V657 PolarHBondContact O-N 2.86Å; V657-P763 HydrophobicContact CG2-CB 3.83Å; V657-P763 HydrophobicContact CG2-CG 3.65Å; V657-P765 HydrophobicContact CG1-CG 3.99Å; V657-I910 HydrophobicContact CG1-CD1 3.58Å; V657-I910 HydrophobicContact CG2-CD1 4.42Å
658	L	94	Very high	90.7	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-80.7	-29.1	-174.4	-61.3	179	0	0	0	112.5	M527 Y530 V650 G654 L897 F937 R940	M527-L658 HydrophobicContact CE-CD1 4.11Å; M527-L658 HydrophobicContact SD-CD1 4.07Å; Y530-L658 HydrophobicContact CD1-CD1 4.36Å; Y530-L658 HydrophobicContact CE1-CD1 4.08Å; V650-L658 HydrophobicContact CG1-CD1 4.28Å; V650-L658 HydrophobicContact CG2-CD2 4.08Å; G654-L658 PolarHBondContact O-N 3.47Å; L658-L897 HydrophobicContact CD2-CD2 3.89Å; L658-F937 HydrophobicContact CD2-CE2 4.18Å; L658-F937 HydrophobicContact CD2-CZ 4.36Å; L658-R940 VanDerWaalsContact O-CZ 3.28Å; L658-R940 PolarHBondContact O-NH1 3.15Å; L658-R940 PolarHBondContact O-NH2 3.02Å
659	F	94.9	Very high	90.6	Very high	8 Å²	8	61.1 Å²	61.1	4%	0.035	32%	0.317	C	S	.	.	S	Bend	trans	-139.2	57.2	-173.8	-65.1	-85.4	0	0	0	111.3	L525 N526 M527 Y530 V655 E661 R944	L525-F659 HydrophobicContact CG-CE1 4.23Å; L525-F659 HydrophobicContact CG-CZ 4.05Å; L525-F659 WeakPolarHBondContact O-CE1 3.43Å; N526-F659 WeakPolarHBondContact O-CZ 3.29Å; M527-F659 HydrophobicContact CB-CD2 4.39Å; M527-F659 HydrophobicContact CB-CE2 4.25Å; M527-F659 HydrophobicContact SD-CD2 3.91Å; M527-F659 HydrophobicContact SD-CE2 3.92Å; Y530-F659 AromaticContact CD2-CE2 3.74Å; Y530-F659 HydrophobicContact CD2-CE2 3.74Å; Y530-F659 AromaticContact CD2-CZ 3.61Å; Y530-F659 HydrophobicContact CD2-CZ 3.61Å; Y530-F659 HydrophobicContact CE2-CE2 4.24Å; Y530-F659 HydrophobicContact CE2-CZ 4.17Å; Y530-F659 HydrophobicContact CG-CE2 4.38Å; V655-F659 HydrophobicContact CG1-CB 3.83Å; V655-F659 CarbonylContact O-C 3.6Å; V655-F659 WeakPolarHBondContact O-CA 3.47Å; V655-F659 PolarHBondContact O-N 3.45Å; F659-E661 PolarHBondContact O-N 3.13Å; F659-R944 VanDerWaalsContact CE1-NH2 3.35Å
660	P	92.2	Very high	90.5	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.31	C	S	.	.			trans	-64.2	125	-176.2	25.2	-33.6	0	0	0	111.7	L764 L941 Y947	P660-L764 HydrophobicContact CB-CD2 4.19Å; P660-L764 HydrophobicContact CB-CG 4.2Å; P660-L941 HydrophobicContact CG-CD2 3.74Å; P660-Y947 HydrophobicContact CB-CE2 3.91Å; P660-Y947 HydrophobicContact CG-CD2 4.19Å; P660-Y947 HydrophobicContact CG-CE2 3.43Å; P660-Y947 VanDerWaalsContact CG-CE2 3.43Å
661	E	89.3	Confident	89.7	Confident	135 Å²	135	65 Å²	65	63%	0.631	35%	0.346	S	S	*	.			trans	-123.7	-39.5	179.3	-72	177.3	-179.1	0	0	111.7	F659 R944	F659-E661 PolarHBondContact O-N 3.13Å; E661-R944 IonicContact OE1-NH1 2.99Å
662	E	86.8	Confident	88.5	Confident	154 Å²	154	62 Å²	62	72%	0.72	34%	0.336	S	S	*	.	S	Bend	trans	-117.5	145.2	179.8	-63.5	-177.6	172.6	0	0	111.6
663	I	90.1	Very high	87.4	Confident	56 Å²	56	66.4 Å²	66.4	29%	0.287	36%	0.362	S	S	.	.			trans	-102.1	114.6	178	-57.5	173.5	0	0	0	108.6	L665 C761 L764 N961 L964	I663-L665 HydrophobicContact CG2-CD2 4.32Å; I663-C761 VanDerWaalsContact CG2-SG 3.57Å; I663-L764 HydrophobicContact CG1-CD2 4.39Å; I663-N961 WeakPolarHBondContact CD1-ND2 3.49Å; I663-L964 HydrophobicContact CD1-CD1 3.51Å; I663-L964 HydrophobicContact CD1-CG 4Å; I663-L964 HydrophobicContact CG1-CD1 3.92Å; I663-L964 HydrophobicContact CG1-CG 4.5Å
664	I	87.7	Confident	86.6	Confident	90 Å²	90	68.4 Å²	68.4	46%	0.462	37%	0.369	S	S	.	.			trans	-109.1	112.8	175.4	-56.6	173.4	0	0	0	108.1
665	L	91.9	Very high	85.2	Confident	109 Å²	109	71.2 Å²	71.2	57%	0.571	38%	0.379	S	S	*	.	P	Polyproline II helix	trans	-72.5	130.8	179.3	-63.7	177.3	0	0	0	111.1	I663 D760 L963	I663-L665 HydrophobicContact CG2-CD2 4.32Å; L665-D760 CarbonylContact C-O 3.55Å; L665-D760 WeakPolarHBondContact CA-O 3.43Å; L665-D760 HydrophobicContact CD2-CB 4.13Å; L665-L963 HydrophobicContact CD2-CD1 4.11Å; L665-L963 HydrophobicContact CD2-CD2 4.5Å
666	Q	90.6	Very high	83.2	Confident	87 Å²	87	73.5 Å²	73.5	41%	0.407	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-98	165.3	171.1	-59.7	-57.2	-39.7	0	0	110.2	D760 R762	Q666-D760 PolarHBondContact N-O 2.84Å; Q666-R762 WeakPolarHBondContact CG-O 3.26Å
667	S	89.6	Confident	80.8	Confident	91 Å²	91	71.5 Å²	71.5	64%	0.636	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-61.9	137.5	168.5	49.5	0	0	0	0	110.5	Q669 R762	S667-Q669 PolarHBondContact O-N 3.44Å; S667-R762 PolarHBondContact O-NH2 3.03Å
668	P	90	Very high	78.1	Confident	60 Å²	60	79.5 Å²	79.5	39%	0.39	43%	0.43	S	S	.	.	P	Polyproline II helix	trans	-57.6	135	174.6	-23.1	30.9	0	0	0	110.9	V670 T671 S758 D760	P668-V670 PolarHBondContact O-N 3.23Å; P668-T671 HydrophobicContact CB-CG2 4.08Å; P668-T671 HydrophobicContact CG-CG2 4.33Å; P668-S758 CarbonylContact C-O 3.59Å; P668-S758 VanDerWaalsContact CA-O 3.25Å; P668-S758 WeakPolarHBondContact CA-O 3.43Å; P668-D760 WeakPolarHBondContact CG-OD1 3.33Å
669	Q	90	Very high	75.5	Confident	46 Å²	46	83 Å²	83	22%	0.215	45%	0.448	C	S	.	.	S	Bend	trans	-64.8	-33.3	175.4	-65.9	177.5	-92.3	0	0	111.9	S667 S758 R762 L791 H882	S667-Q669 PolarHBondContact O-N 3.44Å; Q669-S758 PolarHBondContact N-O 3.17Å; Q669-R762 VanDerWaalsContact NE2-NH1 3.14Å; Q669-R762 VanDerWaalsContact OE1-CD 3.3Å; Q669-L791 HydrophobicContact CB-CD1 4.16Å; Q669-L791 HydrophobicContact CB-CD2 4.23Å; Q669-H882 PolarHBondContact NE2-NE2 2.74Å
670	V	86.5	Confident	72.4	Confident	32 Å²	32	88.2 Å²	88.2	19%	0.194	48%	0.481	C	S	.	.			trans	-138.3	123	178.4	-168.7	0	0	0	0	110.4	P668 M738 L757 A790 L791	P668-V670 PolarHBondContact O-N 3.23Å; V670-M738 HydrophobicContact CB-CE 4.31Å; V670-M738 HydrophobicContact CG1-CE 3.34Å; V670-M738 HydrophobicContact CG1-SD 3.97Å; V670-L757 HydrophobicContact CB-CG 4.1Å; V670-L757 HydrophobicContact CG2-CD1 4.06Å; V670-L757 HydrophobicContact CG2-CG 4.06Å; V670-A790 HydrophobicContact CG2-CB 3.98Å; V670-L791 HydrophobicContact CG2-CD2 3.55Å; V670-L791 HydrophobicContact CG2-CG 3.98Å
671	T	75.1	Confident	69.4	Low	122 Å²	122	97.6 Å²	97.6	75%	0.748	52%	0.522	S	S	*	.			trans	-102.1	74.9	172.9	44	0	0	0	0	109.5	P668	P668-T671 HydrophobicContact CB-CG2 4.08Å; P668-T671 HydrophobicContact CG-CG2 4.33Å
672	G	65.2	Low	66.6	Low	23 Å²	23	96.4 Å²	96.4	24%	0.237	53%	0.528	C	S	.	.			trans	-92	129.1	179.5	0	0	0	0	0	113.1	W674	G672-W674 PolarHBondContact O-N 3.06Å
673	N	68.8	Low	63.6	Low	154 Å²	154	94.2 Å²	94.2	82%	0.824	53%	0.53	S	S	*	.			trans	-73.7	104.7	162.1	-78.4	-10.9	0	0	0	108.8
674	W	73.8	Confident	60.5	Low	46 Å²	46	95.3 Å²	95.3	17%	0.174	56%	0.555	C	S	.	*	B	Isolated β-bridge	trans	-69.9	135.4	172.8	-65	82.8	0	0	0	109.9	G672 H676 M738 F740 V753 K754 L757	G672-W674 PolarHBondContact O-N 3.06Å; W674-H676 PolarHBondContact O-N 3.41Å; W674-M738 HydrophobicContact CD2-CB 4.27Å; W674-M738 HydrophobicContact CE3-CB 4.13Å; W674-M738 HydrophobicContact CZ2-SD 4.44Å; W674-M738 HydrophobicContact CZ3-CB 4.26Å; W674-F740 HydrophobicContact CD2-CE2 4.41Å; W674-F740 HydrophobicContact CD2-CZ 4.37Å; W674-F740 HydrophobicContact CE3-CD2 4.01Å; W674-F740 HydrophobicContact CE3-CE1 4.32Å; W674-F740 AromaticContact CE3-CE2 3.41Å; W674-F740 HydrophobicContact CE3-CE2 3.41Å; W674-F740 VanDerWaalsContact CE3-CE2 3.41Å; W674-F740 AromaticContact CE3-CZ 3.6Å; W674-F740 HydrophobicContact CE3-CZ 3.6Å; W674-F740 HydrophobicContact CH2-CD1 4.13Å; W674-F740 AromaticContact CH2-CE1 3.51Å; W674-F740 HydrophobicContact CH2-CE1 3.51Å; W674-F740 HydrophobicContact CH2-CE2 4.15Å; W674-F740 AromaticContact CH2-CZ 3.51Å; W674-F740 HydrophobicContact CH2-CZ 3.51Å; W674-F740 HydrophobicContact CZ2-CZ 4.3Å; W674-F740 AromaticContact CZ3-CD1 3.78Å; W674-F740 HydrophobicContact CZ3-CD1 3.78Å; W674-F740 AromaticContact CZ3-CD2 3.67Å; W674-F740 HydrophobicContact CZ3-CD2 3.67Å; W674-F740 AromaticContact CZ3-CE1 3.39Å; W674-F740 HydrophobicContact CZ3-CE1 3.39Å; W674-F740 AromaticContact CZ3-CE2 3.26Å; W674-F740 HydrophobicContact CZ3-CE2 3.26Å; W674-F740 AromaticContact CZ3-CG 3.91Å; W674-F740 HydrophobicContact CZ3-CG 3.91Å; W674-F740 AromaticContact CZ3-CZ 3.11Å; W674-F740 HydrophobicContact CZ3-CZ 3.11Å; W674-V753 HydrophobicContact CH2-CG1 4.42Å; W674-K754 HydrophobicContact CD2-CG 4.29Å; W674-K754 HydrophobicContact CH2-CG 4.3Å; W674-K754 HydrophobicContact CZ2-CG 3.52Å; W674-L757 HydrophobicContact CH2-CD2 4.37Å; W674-L757 HydrophobicContact CZ2-CD2 3.88Å
675	N	59.8	Low	57.2	Low	79 Å²	79	100.8 Å²	100.8	42%	0.422	58%	0.579	S	S	.	*			trans	-66.8	103.6	172.8	-78.1	-22.1	0	0	0	109.7	A677 E739	N675-A677 PolarHBondContact O-N 2.96Å; N675-E739 PolarHBondContact ND2-OE1 3.45Å; N675-E739 VanDerWaalsContact ND2-OE1 3.11Å
676	H	49.1	Very low	53.9	Low	123 Å²	123	100.5 Å²	100.5	57%	0.569	59%	0.586	S	S	*	*			trans	-76.5	8.4	174	-84.5	-69.9	0	0	0	114.4	W674 Q678 D679	W674-H676 PolarHBondContact O-N 3.41Å; H676-Q678 PolarHBondContact O-N 2.63Å; H676-D679 IonicContact ND1-OD2 3.1Å; H676-D679 PolarHBondContact O-N 2.91Å
677	A	39.3	Very low	50.6	Low	86 Å²	86	102.3 Å²	102.3	71%	0.711	60%	0.603	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-5.4	-168.3	0	0	0	0	0	115.8	N675	N675-A677 PolarHBondContact O-N 2.96Å
678	Q	36.1	Very low	47.3	Very low	169 Å²	169	102.6 Å²	102.6	79%	0.79	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.7	-12.5	178	-72.4	-171.8	-3.8	0	0	115.2	H676 T680	H676-Q678 PolarHBondContact O-N 2.63Å; Q678-T680 PolarHBondContact O-N 3.49Å
679	D	39.8	Very low	44	Very low	72 Å²	72	108.5 Å²	108.5	39%	0.385	62%	0.624	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85	-3.8	-174.6	-63.7	-33.2	0	0	0	113.8	H676 K750	H676-D679 IonicContact ND1-OD2 3.1Å; H676-D679 PolarHBondContact O-N 2.91Å; D679-K750 IonicContact OD1-NZ 2.86Å; D679-K750 PolarHBondContact OD1-NZ 3.43Å
680	T	28.4	Very low	40.6	Very low	119 Å²	119	115.6 Å²	115.6	73%	0.73	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.3	15.2	-178.8	-10.2	0	0	0	0	115.4	Q678	Q678-T680 PolarHBondContact O-N 3.49Å
681	K	30.7	Very low	37.7	Very low	197 Å²	197	121.7 Å²	121.7	86%	0.857	69%	0.686	S	S	*	*	S	Bend	trans	-98.2	4.4	177.7	-79	-168.9	178.5	179.8	0	116
682	S	29.2	Very low	35	Very low	110 Å²	110	126.1 Å²	126.1	77%	0.769	69%	0.689	S	S	*	*	S	Bend	trans	-137.2	49.4	177.9	67.5	0	0	0	0	114.4
683	S	23.4	Very low	32.9	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	71%	0.711	S	S	*	*	S	Bend	trans	-175.2	111.3	154.2	56.1	0	0	0	0	109.7
684	G	24.6	Very low	30.5	Very low	79 Å²	79	131.1 Å²	131.1	81%	0.814	71%	0.708	S	S	*	*			trans	163.1	57.5	175.6	0	0	0	0	0	115.7	S686	G684-S686 PolarHBondContact O-N 2.77Å
685	Q	19.1	Very low	28	Very low	206 Å²	206	136.7 Å²	136.7	96%	0.963	74%	0.737	S	S	*	*			trans	-72	107.9	150	-77.8	177.5	-18.4	0	0	108
686	S	23.4	Very low	26	Very low	103 Å²	103	139 Å²	139	72%	0.72	76%	0.755	S	S	*	*			trans	-161.9	99.9	150	-175.3	0	0	0	0	111	G684	G684-S686 PolarHBondContact O-N 2.77Å
687	T	20.3	Very low	24.8	Very low	124 Å²	124	140.2 Å²	140.2	76%	0.761	77%	0.765	S	S	*	*			trans	6.8	122	137.9	44.5	0	0	0	0	120.9
688	S	20	Very low	23.8	Very low	98 Å²	98	145 Å²	145	69%	0.685	77%	0.773	S	S	*	*				83	126.8	122.2	-129.2	0	0	0	0	121.9
689	K	21.8	Very low	23	Very low	183 Å²	183	141 Å²	141	80%	0.796	77%	0.769	S	S	*	*			trans	89.8	102.4	140.3	-77	163.4	177.1	179.5	0	120.6
690	K	18.9	Very low	22.2	Very low	195 Å²	195	145.6 Å²	145.6	85%	0.848	79%	0.788	S	S	*	*				41.2	115.6	115.9	-75.2	-178.6	174.1	176.4	0	118.9
691	N	23.7	Very low	21.8	Very low	160 Å²	160	148.5 Å²	148.5	86%	0.856	79%	0.793	S	S	*	*				-172.3	106.2	125.1	-90.7	-17.9	0	0	0	107.5
692	R	19.5	Very low	21.2	Very low	215 Å²	215	142 Å²	142	81%	0.811	78%	0.782	S	S	*	*				58	108.8	81.6	-115.8	-169	-179.5	171.3	1	116
693	K	20.7	Very low	20.8	Very low	161 Å²	161	143 Å²	143	70%	0.7	78%	0.783	S	S	*	*			trans	89.1	129.1	131.4	-88.8	-179.9	177	-166.5	0	122.2
694	T	18.7	Very low	20.6	Very low	122 Å²	122	145.4 Å²	145.4	75%	0.748	78%	0.783	S	S	*	*			trans	69.7	121.4	138	50.4	0	0	0	0	119.9
695	M	21.1	Very low	20.4	Very low	162 Å²	162	149.8 Å²	149.8	80%	0.798	78%	0.782	S	S	*	*				-168.6	137	86.5	-87.3	-171.5	98.2	0	0	111.5
696	T	17.5	Very low	20.3	Very low	129 Å²	129	151 Å²	151	79%	0.791	78%	0.778	S	S	*	*			trans	-83.8	139.3	155	31.9	0	0	0	0	108.5
697	D	24.2	Very low	20.2	Very low	147 Å²	147	158 Å²	158	79%	0.786	79%	0.789	S	S	*	*			trans	-142.1	136.8	156	-93.2	-31	0	0	0	111.3
698	Q	18.1	Very low	20.2	Very low	186 Å²	186	159 Å²	159	87%	0.869	79%	0.794	S	S	*	*			trans	-71.6	169.5	167.5	-56	166.7	-3.7	0	0	107.8
699	A	20.2	Very low	20.2	Very low	86 Å²	86	157.5 Å²	157.5	71%	0.711	79%	0.794	S	S	*	*			cis	-175.9	178.7	35.9	0	0	0	0	0	108.9
700	E	22.1	Very low	20.2	Very low	169 Å²	169	155.7 Å²	155.7	79%	0.79	79%	0.793	S	S	*	*			trans	123.7	110.3	143.2	-60.9	-156.3	156.2	0	0	118.9
701	H	21.1	Very low	20.4	Very low	180 Å²	180	154.2 Å²	154.2	83%	0.833	79%	0.786	S	S	*	*			trans	48.1	136.8	130.5	-63.7	-74.5	0	0	0	120.4
702	G	18.3	Very low	20.6	Very low	60 Å²	60	154.3 Å²	154.3	62%	0.619	79%	0.787	S	S	*	*			cis	132	155.2	17.9	0	0	0	0	0	109.9
703	T	19.8	Very low	20.8	Very low	130 Å²	130	152.2 Å²	152.2	80%	0.798	79%	0.791	S	S	*	*			trans	76.2	135.6	167.2	7.9	0	0	0	0	116.8
704	E	19.6	Very low	21.2	Very low	159 Å²	159	150.1 Å²	150.1	74%	0.743	79%	0.794	S	S	*	*			cis	-176.4	165.3	-5.9	-131.9	176.5	-173	0	0	110.7
705	E	20.6	Very low	21.4	Very low	171 Å²	171	151.2 Å²	151.2	80%	0.799	80%	0.8	S	S	*	*			trans	100.9	134.1	142.3	-81.9	-170.1	166.7	0	0	124.7
706	R	16.9	Very low	21.4	Very low	232 Å²	232	151.9 Å²	151.9	88%	0.875	81%	0.806	S	S	*	*			trans	-102.8	160.5	-170.4	-66.4	165.4	161.7	170.6	-5.9	110.5
707	R	21.8	Very low	21.9	Very low	250 Å²	250	150.2 Å²	150.2	94%	0.943	81%	0.805	S	S	*	*			trans	-169.8	161.9	136.3	-105.4	170.5	-153.7	-149	8.4	113.1
708	V	19.8	Very low	22.1	Very low	144 Å²	144	148.7 Å²	148.7	87%	0.873	80%	0.803	S	S	*	*			trans	-122.3	147.2	-153.4	164.6	0	0	0	0	110.6
709	G	20.8	Very low	22.3	Very low	66 Å²	66	149.7 Å²	149.7	68%	0.68	81%	0.805	S	S	*	*			trans	103.8	110.5	131.5	0	0	0	0	0	122
710	D	21.7	Very low	22.6	Very low	146 Å²	146	152.3 Å²	152.3	78%	0.781	81%	0.813	S	S	*	*				89.4	133.5	118.6	-134.7	18.5	0	0	0	123.5
711	K	23	Very low	22.7	Very low	163 Å²	163	148.3 Å²	148.3	71%	0.709	81%	0.808	S	S	*	*			trans	82.1	112.3	156.8	-60.4	-178.9	-178	176.2	0	122.7
712	D	26.8	Very low	22.9	Very low	162 Å²	162	148.5 Å²	148.5	87%	0.866	81%	0.81	S	S	*	*				169.1	153.4	104.3	-89.9	-29.1	0	0	0	114
713	L	23.7	Very low	23.3	Very low	171 Å²	171	153.9 Å²	153.9	90%	0.895	82%	0.821	S	S	*	*			trans	-76.6	165.7	-165.1	-107.1	89.9	0	0	0	117.2
714	P	28.7	Very low	23.5	Very low	117 Å²	117	152 Å²	152	76%	0.76	81%	0.813	S	S	*	*			trans	-106.2	158.3	-162.2	39.4	-32.6	0	0	0	117.3
715	V	23.7	Very low	23.9	Very low	145 Å²	145	152 Å²	152	88%	0.879	82%	0.818	S	S	*	*			trans	-119.6	136.6	168.6	173.5	0	0	0	0	109.6
716	L	20.7	Very low	24.1	Very low	176 Å²	176	155.3 Å²	155.3	92%	0.921	82%	0.823	S	S	*	*			trans	-58.9	126.8	178.9	-104.1	87.3	0	0	0	113.8
717	A	28.5	Very low	24.5	Very low	94 Å²	94	150.5 Å²	150.5	78%	0.777	82%	0.819	S	S	*	*			trans	-156.5	144.1	143.6	0	0	0	0	0	109.9
718	P	27.8	Very low	24.8	Very low	115 Å²	115	145.9 Å²	145.9	75%	0.747	81%	0.813	S	S	*	*			trans	-104.4	122.5	-166.7	34.8	-23.4	0	0	0	111.6
719	F	23.3	Very low	25.3	Very low	207 Å²	207	146.6 Å²	146.6	91%	0.908	81%	0.807	S	S	*	*			trans	-151	113.2	150.2	-101.6	-80.8	0	0	0	107.7	A721	F719-A721 PolarHBondContact O-N 2.92Å
720	T	25.1	Very low	25.7	Very low	142 Å²	142	151.7 Å²	151.7	87%	0.871	82%	0.817	S	S	*	*			trans	-55.9	100.2	-179.9	44.1	0	0	0	0	111.3
721	A	25	Very low	25.8	Very low	84 Å²	84	150.3 Å²	150.3	69%	0.694	81%	0.806	S	S	*	*			trans	-113.3	75.4	162.6	0	0	0	0	0	108.1	F719	F719-A721 PolarHBondContact O-N 2.92Å
722	E	25.1	Very low	26.2	Very low	185 Å²	185	148.2 Å²	148.2	86%	0.864	81%	0.807	S	S	*	*			trans	-115.3	75	165.1	-77.4	-172.7	169.8	0	0	108.1
723	M	26.5	Very low	26.7	Very low	172 Å²	172	146.3 Å²	146.3	85%	0.847	80%	0.804	S	S	*	*			trans	-165.2	55.9	156.2	-138.6	173	-92.2	0	0	110.7
724	S	25.3	Very low	27.2	Very low	91 Å²	91	146 Å²	146	64%	0.636	80%	0.795	S	S	*	*			trans	-104.3	1.4	-176	-46.6	0	0	0	0	114.9
725	D	27.1	Very low	28.1	Very low	160 Å²	160	144.6 Å²	144.6	86%	0.856	79%	0.793	S	S	*	*	S	Bend	trans	-106.9	9.6	-177.7	-88.9	-6.2	0	0	0	114.9
726	W	24.5	Very low	29.6	Very low	239 Å²	239	145.3 Å²	145.3	91%	0.905	78%	0.78	S	S	*	*			trans	-118.3	36.1	176.3	-79.3	35.8	0	0	0	112.3	D728	W726-D728 VanDerWaalsContact C-N 3.29Å; W726-D728 PolarHBondContact O-N 3.41Å
727	V	26.6	Very low	31.7	Very low	131 Å²	131	144.2 Å²	144.2	79%	0.794	77%	0.768	S	S	*	*			trans	-98.3	57.2	167.2	-164.8	0	0	0	0	109
728	D	28.2	Very low	33.8	Very low	153 Å²	153	140.7 Å²	140.7	82%	0.818	74%	0.735	S	S	*	*	S	Bend	trans	-114.8	115.6	160.2	-105.5	-18.9	0	0	0	107.6	W726	W726-D728 VanDerWaalsContact C-N 3.29Å; W726-D728 PolarHBondContact O-N 3.41Å
729	E	28.7	Very low	36.7	Very low	160 Å²	160	141.2 Å²	141.2	75%	0.748	73%	0.728	S	S	*	*			trans	51.1	96.9	172	-65.7	-174.4	158.9	0	0	117.3	Q731	E729-Q731 HydrophobicContact CB-CG 4.44Å; E729-Q731 PolarHBondContact O-N 3.34Å
730	I	30	Very low	40	Very low	173 Å²	173	133.3 Å²	133.3	89%	0.887	69%	0.693	S	S	*	*			trans	-58	91	147.4	-61.4	170.7	0	0	0	106.6	T732	I730-T732 VanDerWaalsContact C-N 3.35Å; I730-T732 PolarHBondContact O-N 2.79Å
731	Q	24	Very low	43.2	Very low	117 Å²	117	129.2 Å²	129.2	55%	0.547	66%	0.664	S	S	.	*			trans	-63.5	98.4	170.1	-72.3	-178.3	9.2	0	0	107.3	E729	E729-Q731 HydrophobicContact CB-CG 4.44Å; E729-Q731 PolarHBondContact O-N 3.34Å
732	T	30	Very low	46.3	Very low	119 Å²	119	127.6 Å²	127.6	73%	0.73	64%	0.643	S	S	*	*			trans	-44.3	131.8	150.4	15.9	0	0	0	0	107	I730 K734	I730-T732 VanDerWaalsContact C-N 3.35Å; I730-T732 PolarHBondContact O-N 2.79Å; T732-K734 PolarHBondContact O-N 3.47Å
733	P	37.7	Very low	49.4	Very low	122 Å²	122	123.9 Å²	123.9	79%	0.792	64%	0.635	S	S	*	*			trans	-51.9	115.4	-170.4	17.6	-29.7	0	0	0	108.6	A735	P733-A735 PolarHBondContact O-N 3.48Å
734	K	35.6	Very low	52.4	Low	165 Å²	165	121.2 Å²	121.2	72%	0.717	63%	0.628	S	S	*	*			trans	-43.3	109.3	-176.9	-75.9	177.8	177.3	172.3	0	108.1	T732 R736	T732-K734 PolarHBondContact O-N 3.47Å; K734-R736 PolarHBondContact O-N 3.09Å
735	A	47.5	Very low	55.7	Low	87 Å²	87	117.2 Å²	117.2	72%	0.719	60%	0.6	S	S	*	*			trans	-52.7	110.9	-177.4	0	0	0	0	0	108	P733 K737	P733-A735 PolarHBondContact O-N 3.48Å; A735-K737 PolarHBondContact O-N 3.26Å; A735-K737 VanDerWaalsContact O-N 3.11Å
736	R	55.5	Low	58.9	Low	160 Å²	160	110.1 Å²	110.1	60%	0.604	56%	0.562	S	S	*	*			trans	-54.6	122.4	172.8	-178.9	-179.4	175	-174.4	-1.8	106.2	K734 M738	K734-R736 PolarHBondContact O-N 3.09Å; R736-M738 PolarHBondContact O-N 2.94Å
737	K	63.1	Low	62.2	Low	152 Å²	152	103.2 Å²	103.2	66%	0.661	54%	0.54	S	S	*	.			trans	-53.5	119.5	173.3	-72.1	-176.5	179.2	-179.5	0	107.7	A735 E739	A735-K737 PolarHBondContact O-N 3.26Å; A735-K737 VanDerWaalsContact O-N 3.11Å; K737-E739 PolarHBondContact O-N 3Å
738	M	73.9	Confident	65.5	Low	20 Å²	20	99.2 Å²	99.2	10%	0.099	51%	0.514	C	S	.	.	B	Isolated β-bridge	trans	-81.3	112.9	-173	-71.4	-172.8	143.3	0	0	109.6	V670 W674 R736 L757 A790	V670-M738 HydrophobicContact CB-CE 4.31Å; V670-M738 HydrophobicContact CG1-CE 3.34Å; V670-M738 HydrophobicContact CG1-SD 3.97Å; W674-M738 HydrophobicContact CD2-CB 4.27Å; W674-M738 HydrophobicContact CE3-CB 4.13Å; W674-M738 HydrophobicContact CZ2-SD 4.44Å; W674-M738 HydrophobicContact CZ3-CB 4.26Å; R736-M738 PolarHBondContact O-N 2.94Å; M738-L757 HydrophobicContact CE-CD2 3.54Å; M738-L757 HydrophobicContact CE-CG 4.41Å; M738-L757 HydrophobicContact SD-CD2 3.74Å; M738-A790 HydrophobicContact CE-CB 3.4Å; M738-A790 VanDerWaalsContact CE-CB 3.4Å
739	E	87.8	Confident	68.7	Low	127 Å²	127	92.2 Å²	92.2	59%	0.593	48%	0.476	S	S	*	.			trans	-118.1	145.6	172	-65.2	-177.1	172	0	0	108.1	N675 K737 Q786	N675-E739 PolarHBondContact ND2-OE1 3.45Å; N675-E739 VanDerWaalsContact ND2-OE1 3.11Å; K737-E739 PolarHBondContact O-N 3Å; E739-Q786 PolarHBondContact O-NE2 2.86Å
740	F	92.6	Very high	71.9	Confident	41 Å²	41	86 Å²	86	18%	0.18	45%	0.446	C	S	.	.			trans	-70.2	136.7	174.9	-68.4	-79.9	0	0	0	109.7	W674 N742 L745 K750 V753 K754 E782	W674-F740 HydrophobicContact CD2-CE2 4.41Å; W674-F740 HydrophobicContact CD2-CZ 4.37Å; W674-F740 HydrophobicContact CE3-CD2 4.01Å; W674-F740 HydrophobicContact CE3-CE1 4.32Å; W674-F740 AromaticContact CE3-CE2 3.41Å; W674-F740 HydrophobicContact CE3-CE2 3.41Å; W674-F740 VanDerWaalsContact CE3-CE2 3.41Å; W674-F740 AromaticContact CE3-CZ 3.6Å; W674-F740 HydrophobicContact CE3-CZ 3.6Å; W674-F740 HydrophobicContact CH2-CD1 4.13Å; W674-F740 AromaticContact CH2-CE1 3.51Å; W674-F740 HydrophobicContact CH2-CE1 3.51Å; W674-F740 HydrophobicContact CH2-CE2 4.15Å; W674-F740 AromaticContact CH2-CZ 3.51Å; W674-F740 HydrophobicContact CH2-CZ 3.51Å; W674-F740 HydrophobicContact CZ2-CZ 4.3Å; W674-F740 AromaticContact CZ3-CD1 3.78Å; W674-F740 HydrophobicContact CZ3-CD1 3.78Å; W674-F740 AromaticContact CZ3-CD2 3.67Å; W674-F740 HydrophobicContact CZ3-CD2 3.67Å; W674-F740 AromaticContact CZ3-CE1 3.39Å; W674-F740 HydrophobicContact CZ3-CE1 3.39Å; W674-F740 AromaticContact CZ3-CE2 3.26Å; W674-F740 HydrophobicContact CZ3-CE2 3.26Å; W674-F740 AromaticContact CZ3-CG 3.91Å; W674-F740 HydrophobicContact CZ3-CG 3.91Å; W674-F740 AromaticContact CZ3-CZ 3.11Å; W674-F740 HydrophobicContact CZ3-CZ 3.11Å; F740-N742 VanDerWaalsContact C-N 3.33Å; F740-L745 HydrophobicContact CB-CD1 4.33Å; F740-L745 HydrophobicContact CD1-CD1 3.86Å; F740-L745 HydrophobicContact CG-CD1 4.33Å; F740-K750 HydrophobicContact CD1-CG 4.47Å; F740-K750 HydrophobicContact CD2-CD 4.32Å; F740-K750 HydrophobicContact CD2-CG 4.13Å; F740-K750 HydrophobicContact CE1-CB 4.05Å; F740-K750 HydrophobicContact CE1-CG 3.99Å; F740-K750 HydrophobicContact CE2-CB 4.01Å; F740-K750 HydrophobicContact CE2-CD 3.8Å; F740-K750 HydrophobicContact CE2-CG 3.61Å; F740-K750 HydrophobicContact CZ-CB 3.5Å; F740-K750 HydrophobicContact CZ-CD 4.18Å; F740-K750 HydrophobicContact CZ-CG 3.53Å; F740-V753 HydrophobicContact CD1-CG1 4.4Å; F740-V753 HydrophobicContact CE1-CB 4.05Å; F740-V753 HydrophobicContact CE1-CG1 3.86Å; F740-K754 HydrophobicContact CZ-CG 4.48Å; F740-E782 VanDerWaalsContact CA-OE1 3.31Å; F740-E782 WeakPolarHBondContact CA-OE1 3.25Å; F740-E782 HydrophobicContact CD1-CG 4.07Å
741	F	92.4	Very high	75	Confident	56 Å²	56	80.4 Å²	80.4	25%	0.246	42%	0.418	C	S	.	.	S	Bend	trans	-68.7	-37.6	176.5	-65	-82.2	0	0	0	110.8	P743 E782 L785 Q786 F789 V818	F741-P743 WeakPolarHBondContact O-CD 3.4Å; F741-E782 WeakPolarHBondContact CB-OE2 3.28Å; F741-E782 WeakPolarHBondContact CD2-OE1 3.44Å; F741-E782 PolarHBondContact N-OE1 2.94Å; F741-E782 PolarHBondContact N-OE2 3.17Å; F741-L785 HydrophobicContact CB-CD1 4.11Å; F741-L785 HydrophobicContact CD2-CB 3.6Å; F741-L785 HydrophobicContact CD2-CD1 4.15Å; F741-L785 HydrophobicContact CE2-CB 3.7Å; F741-L785 HydrophobicContact CG-CB 4.34Å; F741-L785 HydrophobicContact CG-CD1 4.1Å; F741-L785 HydrophobicContact CZ-CB 4.49Å; F741-Q786 HydrophobicContact CD2-CG 4.37Å; F741-Q786 HydrophobicContact CE2-CG 4.29Å; F741-F789 HydrophobicContact CE1-CD2 4.02Å; F741-F789 HydrophobicContact CE1-CE2 4.1Å; F741-F789 AromaticContact CE2-CD2 3.98Å; F741-F789 HydrophobicContact CE2-CD2 3.98Å; F741-F789 HydrophobicContact CZ-CB 4.25Å; F741-F789 AromaticContact CZ-CD2 3.3Å; F741-F789 HydrophobicContact CZ-CD2 3.3Å; F741-F789 AromaticContact CZ-CE2 3.84Å; F741-F789 HydrophobicContact CZ-CE2 3.84Å; F741-F789 AromaticContact CZ-CG 3.92Å; F741-F789 HydrophobicContact CZ-CG 3.92Å; F741-V818 HydrophobicContact CD1-CB 4.49Å; F741-V818 HydrophobicContact CD1-CG1 3.69Å; F741-V818 HydrophobicContact CD1-CG2 3.97Å; F741-V818 HydrophobicContact CE1-CG1 3.53Å; F741-V818 HydrophobicContact CZ-CG1 4.37Å
742	N	91.3	Very high	78.4	Confident	49 Å²	49	74.9 Å²	74.9	26%	0.262	39%	0.392	S	S	.	.	S	Bend	trans	-95.8	109.9	169.5	-175.7	-4.9	0	0	0	111.1	F740 V744 L745 V778 E782	F740-N742 VanDerWaalsContact C-N 3.33Å; N742-V744 PolarHBondContact O-N 3.35Å; N742-V744 WeakPolarHBondContact OD1-CB 3.07Å; N742-V744 PolarHBondContact OD1-N 3.02Å; N742-L745 HydrophobicContact CB-CD1 4.15Å; N742-L745 HydrophobicContact CB-CD2 4.33Å; N742-L745 HydrophobicContact CB-CG 3.91Å; N742-L745 WeakPolarHBondContact O-CG 3.28Å; N742-V778 VanDerWaalsContact ND2-CG1 3.32Å; N742-V778 WeakPolarHBondContact ND2-CG1 3.45Å; N742-E782 PolarHBondContact N-OE2 3.01Å
743	P	88.6	Confident	81.6	Confident	108 Å²	108	69.2 Å²	69.2	70%	0.701	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.3	-11.3	-178.6	30.2	-35.4	0	0	0	113.8	F741	F741-P743 WeakPolarHBondContact O-CD 3.4Å
744	V	90.7	Very high	84.3	Confident	115 Å²	115	66 Å²	66	70%	0.697	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.9	0.4	-174.7	-169.1	0	0	0	0	112.3	N742 N746	N742-V744 PolarHBondContact O-N 3.35Å; N742-V744 WeakPolarHBondContact OD1-CB 3.07Å; N742-V744 PolarHBondContact OD1-N 3.02Å; V744-N746 PolarHBondContact O-N 3.23Å
745	L	93.6	Very high	87.1	Confident	7 Å²	7	61.6 Å²	61.6	4%	0.037	31%	0.31	C	S	.	.			trans	-61.6	136.1	179.8	-65.7	174	0	0	0	111.7	F740 N742 Q749 K750 V778 E782	F740-L745 HydrophobicContact CB-CD1 4.33Å; F740-L745 HydrophobicContact CD1-CD1 3.86Å; F740-L745 HydrophobicContact CG-CD1 4.33Å; N742-L745 HydrophobicContact CB-CD1 4.15Å; N742-L745 HydrophobicContact CB-CD2 4.33Å; N742-L745 HydrophobicContact CB-CG 3.91Å; N742-L745 WeakPolarHBondContact O-CG 3.28Å; L745-Q749 HydrophobicContact CB-CB 4.24Å; L745-Q749 HydrophobicContact CD2-CB 4.05Å; L745-K750 HydrophobicContact CB-CG 4.05Å; L745-K750 VanDerWaalsContact O-CE 3.25Å; L745-K750 WeakPolarHBondContact O-CE 3.38Å; L745-V778 HydrophobicContact CD2-CG1 3.9Å; L745-E782 HydrophobicContact CD1-CB 3.85Å; L745-E782 HydrophobicContact CD1-CG 3.42Å; L745-E782 VanDerWaalsContact CD1-CG 3.42Å
746	N	95	Very high	89.4	Confident	11 Å²	11	57.5 Å²	57.5	6%	0.059	28%	0.276	C	S	.	.			trans	-81	170.5	174.1	70.2	56.4	0	0	0	112.3	V744 N748 Q749 K750 K970 Y972	V744-N746 PolarHBondContact O-N 3.23Å; N746-N748 VanDerWaalsContact C-N 3.34Å; N746-N748 PolarHBondContact O-N 2.94Å; N746-N748 PolarHBondContact OD1-N 3.43Å; N746-Q749 PolarHBondContact ND2-OE1 3.21Å; N746-Q749 VanDerWaalsContact ND2-OE1 3.12Å; N746-Q749 PolarHBondContact O-N 3.38Å; N746-Q749 VanDerWaalsContact O-N 3.12Å; N746-Q749 WeakPolarHBondContact OD1-CG 3.46Å; N746-Q749 PolarHBondContact OD1-N 3.48Å; N746-K750 WeakPolarHBondContact O-CG 3.29Å; N746-K750 PolarHBondContact O-N 3.09Å; N746-K970 HydrophobicContact CB-CD 3.77Å; N746-Y972 PolarHBondContact ND2-OH 3.12Å
747	E	94.1	Very high	91.3	Very high	95 Å²	95	50.1 Å²	50.1	44%	0.444	25%	0.249	S	C	.	.	H	α-helix	trans	-58.3	-37.8	-176.5	-60.7	-47.1	118.5	0	0	114.5	K750 L751	E747-K750 PolarHBondContact O-N 2.85Å; E747-K750 IonicContact OE1-NZ 2.77Å; E747-K750 PolarHBondContact OE1-NZ 3.48Å; E747-L751 WeakPolarHBondContact O-CB 3.49Å; E747-L751 PolarHBondContact O-N 2.86Å
748	N	94.7	Very high	92.8	Very high	46 Å²	46	43.6 Å²	43.6	25%	0.246	22%	0.222	C	C	.	.	H	α-helix	trans	-71.2	-35.9	178.3	-66.5	-3.2	0	0	0	111.4	N746 A752 T966 K967 L968 V969	N746-N748 VanDerWaalsContact C-N 3.34Å; N746-N748 PolarHBondContact O-N 2.94Å; N746-N748 PolarHBondContact OD1-N 3.43Å; N748-A752 WeakPolarHBondContact O-CB 3.4Å; N748-A752 PolarHBondContact O-N 2.88Å; N748-T966 HydrophobicContact CB-CG2 4.44Å; N748-T966 WeakPolarHBondContact O-CG2 3.27Å; N748-K967 PolarHBondContact ND2-O 3.05Å; N748-L968 HydrophobicContact CB-CD2 4.19Å; N748-V969 VanDerWaalsContact ND2-CG2 3.3Å; N748-V969 WeakPolarHBondContact ND2-CG2 3.48Å
749	Q	96.6	Very high	93.7	Very high	7 Å²	7	42.8 Å²	42.8	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-68.2	-45.4	174	-61.6	177.2	-59.7	0	0	111	L745 N746 L751 A752 V753 G775 T779 L968	L745-Q749 HydrophobicContact CB-CB 4.24Å; L745-Q749 HydrophobicContact CD2-CB 4.05Å; N746-Q749 PolarHBondContact ND2-OE1 3.21Å; N746-Q749 VanDerWaalsContact ND2-OE1 3.12Å; N746-Q749 PolarHBondContact O-N 3.38Å; N746-Q749 VanDerWaalsContact O-N 3.12Å; N746-Q749 WeakPolarHBondContact OD1-CG 3.46Å; N746-Q749 PolarHBondContact OD1-N 3.48Å; Q749-L751 VanDerWaalsContact C-N 3.32Å; Q749-L751 PolarHBondContact O-N 2.92Å; Q749-A752 PolarHBondContact O-N 3.02Å; Q749-V753 VanDerWaalsContact O-CG2 3.3Å; Q749-V753 WeakPolarHBondContact O-CG2 3.34Å; Q749-V753 PolarHBondContact O-N 3Å; Q749-G775 PolarHBondContact NE2-O 3.42Å; Q749-T779 HydrophobicContact CB-CG2 4.13Å; Q749-T779 HydrophobicContact CG-CG2 4.43Å; Q749-T779 VanDerWaalsContact CG-OG1 3.29Å; Q749-T779 WeakPolarHBondContact CG-OG1 3.34Å; Q749-T779 PolarHBondContact NE2-OG1 3.26Å; Q749-T779 VanDerWaalsContact NE2-OG1 3.12Å; Q749-L968 HydrophobicContact CG-CD2 3.82Å
750	K	95.9	Very high	93.9	Very high	28 Å²	28	37.8 Å²	37.8	12%	0.122	20%	0.196	C	C	.	.	H	α-helix	trans	-59	-44.1	174.3	-69.6	178.6	-175.4	164.8	0	111	D679 F740 L745 N746 E747 V753 K754	D679-K750 IonicContact OD1-NZ 2.86Å; D679-K750 PolarHBondContact OD1-NZ 3.43Å; F740-K750 HydrophobicContact CD1-CG 4.47Å; F740-K750 HydrophobicContact CD2-CD 4.32Å; F740-K750 HydrophobicContact CD2-CG 4.13Å; F740-K750 HydrophobicContact CE1-CB 4.05Å; F740-K750 HydrophobicContact CE1-CG 3.99Å; F740-K750 HydrophobicContact CE2-CB 4.01Å; F740-K750 HydrophobicContact CE2-CD 3.8Å; F740-K750 HydrophobicContact CE2-CG 3.61Å; F740-K750 HydrophobicContact CZ-CB 3.5Å; F740-K750 HydrophobicContact CZ-CD 4.18Å; F740-K750 HydrophobicContact CZ-CG 3.53Å; L745-K750 HydrophobicContact CB-CG 4.05Å; L745-K750 VanDerWaalsContact O-CE 3.25Å; L745-K750 WeakPolarHBondContact O-CE 3.38Å; N746-K750 WeakPolarHBondContact O-CG 3.29Å; N746-K750 PolarHBondContact O-N 3.09Å; E747-K750 PolarHBondContact O-N 2.85Å; E747-K750 IonicContact OE1-NZ 2.77Å; E747-K750 PolarHBondContact OE1-NZ 3.48Å; K750-V753 PolarHBondContact O-N 2.76Å; K750-K754 WeakPolarHBondContact O-CB 3.21Å; K750-K754 VanDerWaalsContact O-CG 3.24Å; K750-K754 WeakPolarHBondContact O-CG 3.34Å; K750-K754 PolarHBondContact O-N 3.4Å
751	L	94.3	Very high	93.9	Very high	57 Å²	57	36.2 Å²	36.2	30%	0.298	19%	0.19	S	C	.	.	H	α-helix	trans	-61	-46.3	176.6	178.3	62.5	0	0	0	111.1	E747 Q749 V753 K754 R755	E747-L751 WeakPolarHBondContact O-CB 3.49Å; E747-L751 PolarHBondContact O-N 2.86Å; Q749-L751 VanDerWaalsContact C-N 3.32Å; Q749-L751 PolarHBondContact O-N 2.92Å; L751-V753 VanDerWaalsContact C-N 3.35Å; L751-V753 PolarHBondContact O-N 2.8Å; L751-K754 WeakPolarHBondContact O-CB 3.36Å; L751-K754 PolarHBondContact O-N 3.39Å; L751-R755 HydrophobicContact CD1-CG 4.29Å; L751-R755 WeakPolarHBondContact O-CG 3.31Å; L751-R755 PolarHBondContact O-N 3.39Å
752	A	96.1	Very high	94	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-59.2	-46.8	177.4	0	0	0	0	0	111.9	N748 Q749 K754 R755 I756 Y766 L768 T779 T966	N748-A752 WeakPolarHBondContact O-CB 3.4Å; N748-A752 PolarHBondContact O-N 2.88Å; Q749-A752 PolarHBondContact O-N 3.02Å; A752-K754 VanDerWaalsContact C-N 3.35Å; A752-K754 PolarHBondContact O-N 2.88Å; A752-R755 PolarHBondContact O-N 3.39Å; A752-I756 VanDerWaalsContact O-CG1 3.26Å; A752-I756 WeakPolarHBondContact O-CG1 3.33Å; A752-I756 PolarHBondContact O-N 2.94Å; A752-Y766 WeakPolarHBondContact CA-OH 3.22Å; A752-L768 HydrophobicContact CB-CD1 3.77Å; A752-T779 HydrophobicContact CB-CG2 4.01Å; A752-T966 HydrophobicContact CB-CG2 3.89Å
753	V	96.5	Very high	94	Very high	1 Å²	1	33.4 Å²	33.4	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-61.5	-43.2	177.1	171.9	0	0	0	0	111.2	W674 F740 Q749 K750 L751 R755 I756 L757 T779 E782 A783 Q786	W674-V753 HydrophobicContact CH2-CG1 4.42Å; F740-V753 HydrophobicContact CD1-CG1 4.4Å; F740-V753 HydrophobicContact CE1-CB 4.05Å; F740-V753 HydrophobicContact CE1-CG1 3.86Å; Q749-V753 VanDerWaalsContact O-CG2 3.3Å; Q749-V753 WeakPolarHBondContact O-CG2 3.34Å; Q749-V753 PolarHBondContact O-N 3Å; K750-V753 PolarHBondContact O-N 2.76Å; L751-V753 VanDerWaalsContact C-N 3.35Å; L751-V753 PolarHBondContact O-N 2.8Å; V753-R755 VanDerWaalsContact C-N 3.35Å; V753-R755 PolarHBondContact O-N 2.88Å; V753-I756 PolarHBondContact O-N 3.02Å; V753-L757 VanDerWaalsContact O-CB 3.26Å; V753-L757 WeakPolarHBondContact O-CB 3.26Å; V753-L757 PolarHBondContact O-N 3.39Å; V753-T779 HydrophobicContact CG2-CG2 4.16Å; V753-E782 HydrophobicContact CB-CG 4.49Å; V753-E782 HydrophobicContact CG1-CG 4.06Å; V753-E782 HydrophobicContact CG2-CB 3.98Å; V753-E782 HydrophobicContact CG2-CG 3.71Å; V753-A783 HydrophobicContact CG2-CB 4.25Å; V753-Q786 HydrophobicContact CG1-CB 4.19Å; V753-Q786 HydrophobicContact CG1-CG 3.72Å
754	K	95	Very high	94.2	Very high	54 Å²	54	28.8 Å²	28.8	24%	0.235	15%	0.145	C	C	.	.	H	α-helix	trans	-59.2	-43.4	175.4	-75.7	172.9	179.5	-179.4	0	112.3	W674 F740 K750 L751 A752 L757 S758	W674-K754 HydrophobicContact CD2-CG 4.29Å; W674-K754 HydrophobicContact CH2-CG 4.3Å; W674-K754 HydrophobicContact CZ2-CG 3.52Å; F740-K754 HydrophobicContact CZ-CG 4.48Å; K750-K754 WeakPolarHBondContact O-CB 3.21Å; K750-K754 VanDerWaalsContact O-CG 3.24Å; K750-K754 WeakPolarHBondContact O-CG 3.34Å; K750-K754 PolarHBondContact O-N 3.4Å; L751-K754 WeakPolarHBondContact O-CB 3.36Å; L751-K754 PolarHBondContact O-N 3.39Å; A752-K754 VanDerWaalsContact C-N 3.35Å; A752-K754 PolarHBondContact O-N 2.88Å; K754-L757 PolarHBondContact O-N 3.43Å; K754-S758 WeakPolarHBondContact O-CB 3.33Å; K754-S758 PolarHBondContact O-N 2.98Å; K754-S758 PolarHBondContact O-OG 3.23Å
755	R	94.7	Very high	94.5	Very high	72 Å²	72	23.3 Å²	23.3	27%	0.272	11%	0.112	S	C	.	.	H	α-helix	trans	-69.4	-38.9	178.4	-69.3	-63.8	-176.8	-165.8	-0.5	112.9	L751 A752 V753 L757 S758 G759 D760 Y766	L751-R755 HydrophobicContact CD1-CG 4.29Å; L751-R755 WeakPolarHBondContact O-CG 3.31Å; L751-R755 PolarHBondContact O-N 3.39Å; A752-R755 PolarHBondContact O-N 3.39Å; V753-R755 VanDerWaalsContact C-N 3.35Å; V753-R755 PolarHBondContact O-N 2.88Å; R755-L757 VanDerWaalsContact C-N 3.31Å; R755-S758 PolarHBondContact O-OG 3.47Å; R755-S758 VanDerWaalsContact O-OG 3.12Å; R755-G759 PolarHBondContact O-N 3.36Å; R755-D760 IonicContact NH1-OD2 2.83Å; R755-Y766 HydrophobicContact CB-CD2 4.45Å; R755-Y766 HydrophobicContact CB-CE2 3.62Å; R755-Y766 HydrophobicContact CG-CE2 4.26Å
756	I	95.9	Very high	94.7	Very high	2 Å²	2	23.6 Å²	23.6	1%	0.01	11%	0.113	C	C	.	.	H	α-helix	trans	-64.4	-41.9	173.3	-67.2	163.7	0	0	0	109.6	A752 V753 G759 Y766 A783 V787 F884 Q909 V911	A752-I756 VanDerWaalsContact O-CG1 3.26Å; A752-I756 WeakPolarHBondContact O-CG1 3.33Å; A752-I756 PolarHBondContact O-N 2.94Å; V753-I756 PolarHBondContact O-N 3.02Å; I756-G759 PolarHBondContact O-N 3.37Å; I756-Y766 HydrophobicContact CD1-CD1 4.15Å; I756-Y766 HydrophobicContact CD1-CE1 4.01Å; I756-Y766 HydrophobicContact CG1-CD1 3.59Å; I756-Y766 HydrophobicContact CG1-CE1 3.64Å; I756-Y766 HydrophobicContact CG1-CG 4.44Å; I756-A783 HydrophobicContact CD1-CB 3.79Å; I756-A783 HydrophobicContact CG2-CB 4.2Å; I756-V787 HydrophobicContact CG2-CG2 4.16Å; I756-F884 HydrophobicContact CD1-CE1 4.4Å; I756-F884 HydrophobicContact CG2-CE1 4.13Å; I756-F884 HydrophobicContact CG2-CZ 3.89Å; I756-Q909 PolarHBondContact O-NE2 3.2Å; I756-Q909 PolarHBondContact O-OE1 3.19Å; I756-V911 HydrophobicContact CD1-CG1 3.95Å; I756-V911 HydrophobicContact CD1-CG2 4.35Å; I756-V911 HydrophobicContact CG1-CG1 4.37Å; I756-V911 HydrophobicContact CG1-CG2 4.01Å; I756-V911 HydrophobicContact CG2-CG2 3.98Å
757	L	94.9	Very high	94.9	Very high	5 Å²	5	23 Å²	23	3%	0.026	11%	0.11	C	C	.	.	H	α-helix	trans	-71.2	-32.9	-179.1	-163.6	62.1	0	0	0	113.4	V670 W674 M738 V753 K754 R755 Q786 V787 A790	V670-L757 HydrophobicContact CB-CG 4.1Å; V670-L757 HydrophobicContact CG2-CD1 4.06Å; V670-L757 HydrophobicContact CG2-CG 4.06Å; W674-L757 HydrophobicContact CH2-CD2 4.37Å; W674-L757 HydrophobicContact CZ2-CD2 3.88Å; M738-L757 HydrophobicContact CE-CD2 3.54Å; M738-L757 HydrophobicContact CE-CG 4.41Å; M738-L757 HydrophobicContact SD-CD2 3.74Å; V753-L757 VanDerWaalsContact O-CB 3.26Å; V753-L757 WeakPolarHBondContact O-CB 3.26Å; V753-L757 PolarHBondContact O-N 3.39Å; K754-L757 PolarHBondContact O-N 3.43Å; R755-L757 VanDerWaalsContact C-N 3.31Å; L757-Q786 HydrophobicContact CD1-CB 4.18Å; L757-Q786 HydrophobicContact CD2-CB 4.4Å; L757-V787 HydrophobicContact CD1-CG2 4.27Å; L757-A790 HydrophobicContact CD1-CB 3.8Å
758	S	93.6	Very high	95.1	Very high	14 Å²	14	18.5 Å²	18.5	10%	0.098	9%	0.089	C	C	.	.	H	α-helix	trans	-72.8	-43	173.9	71.7	0	0	0	0	111.2	P668 Q669 K754 R755 D760	P668-S758 CarbonylContact C-O 3.59Å; P668-S758 VanDerWaalsContact CA-O 3.25Å; P668-S758 WeakPolarHBondContact CA-O 3.43Å; Q669-S758 PolarHBondContact N-O 3.17Å; K754-S758 WeakPolarHBondContact O-CB 3.33Å; K754-S758 PolarHBondContact O-N 2.98Å; K754-S758 PolarHBondContact O-OG 3.23Å; R755-S758 PolarHBondContact O-OG 3.47Å; R755-S758 VanDerWaalsContact O-OG 3.12Å; S758-D760 VanDerWaalsContact C-N 3.28Å; S758-D760 VanDerWaalsContact CB-OD1 3.26Å; S758-D760 WeakPolarHBondContact CB-OD1 3.45Å; S758-D760 WeakPolarHBondContact CB-OD2 3.45Å; S758-D760 PolarHBondContact O-N 3.04Å; S758-D760 PolarHBondContact OG-OD1 3.43Å; S758-D760 PolarHBondContact OG-OD2 3.23Å
759	G	93.2	Very high	95.2	Very high	3 Å²	3	16.6 Å²	16.6	3%	0.031	8%	0.078	C	C	.	.			trans	62.6	35.5	177.8	0	0	0	0	0	112.8	R755 I756 C761 R762	R755-G759 PolarHBondContact O-N 3.36Å; I756-G759 PolarHBondContact O-N 3.37Å; G759-C761 VanDerWaalsContact C-N 3.26Å; G759-C761 PolarHBondContact O-N 2.94Å; G759-R762 WeakPolarHBondContact O-CD 3.27Å; G759-R762 VanDerWaalsContact O-CG 3.23Å; G759-R762 WeakPolarHBondContact O-CG 3.25Å; G759-R762 PolarHBondContact O-N 3.45Å; G759-R762 PolarHBondContact O-NE 3.37Å
760	D	92.8	Very high	95.1	Very high	22 Å²	22	16.3 Å²	16.3	12%	0.118	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.7	-169.8	-54.5	-40.8	0	0	0	113.4	L665 Q666 P668 R755 S758	L665-D760 CarbonylContact C-O 3.55Å; L665-D760 WeakPolarHBondContact CA-O 3.43Å; L665-D760 HydrophobicContact CD2-CB 4.13Å; Q666-D760 PolarHBondContact N-O 2.84Å; P668-D760 WeakPolarHBondContact CG-OD1 3.33Å; R755-D760 IonicContact NH1-OD2 2.83Å; S758-D760 VanDerWaalsContact C-N 3.28Å; S758-D760 VanDerWaalsContact CB-OD1 3.26Å; S758-D760 WeakPolarHBondContact CB-OD1 3.45Å; S758-D760 WeakPolarHBondContact CB-OD2 3.45Å; S758-D760 PolarHBondContact O-N 3.04Å; S758-D760 PolarHBondContact OG-OD1 3.43Å; S758-D760 PolarHBondContact OG-OD2 3.23Å
761	C	92.9	Very high	95.1	Very high	9 Å²	9	15 Å²	15	6%	0.061	7%	0.071	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	12.2	-176.1	-64.2	0	0	0	0	113.7	I663 G759 L764 L964	I663-C761 VanDerWaalsContact CG2-SG 3.57Å; G759-C761 VanDerWaalsContact C-N 3.26Å; G759-C761 PolarHBondContact O-N 2.94Å; C761-L764 HydrophobicContact CB-CB 4.38Å; C761-L764 WeakPolarHBondContact O-CB 3.39Å; C761-L764 PolarHBondContact O-N 3.49Å; C761-L964 HydrophobicContact CB-CD2 3.84Å
762	R	93.1	Very high	95.1	Very high	35 Å²	35	12.4 Å²	12.4	13%	0.132	6%	0.058	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	142	-178	-71.4	172.4	-59.9	146.7	3.9	111.8	Q666 S667 Q669 G759 S907 Q909	Q666-R762 WeakPolarHBondContact CG-O 3.26Å; S667-R762 PolarHBondContact O-NH2 3.03Å; Q669-R762 VanDerWaalsContact NE2-NH1 3.14Å; Q669-R762 VanDerWaalsContact OE1-CD 3.3Å; G759-R762 WeakPolarHBondContact O-CD 3.27Å; G759-R762 VanDerWaalsContact O-CG 3.23Å; G759-R762 WeakPolarHBondContact O-CG 3.25Å; G759-R762 PolarHBondContact O-N 3.45Å; G759-R762 PolarHBondContact O-NE 3.37Å; R762-S907 PolarHBondContact NH1-O 3.28Å; R762-Q909 HydrophobicContact CG-CB 3.85Å; R762-Q909 HydrophobicContact CG-CG 3.8Å
763	P	91.7	Very high	95	Very high	10 Å²	10	13.1 Å²	13.1	7%	0.065	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	cis	-86.9	10	2	40.3	-44.1	0	0	0	114.5	V657 D905	V657-P763 HydrophobicContact CG2-CB 3.83Å; V657-P763 HydrophobicContact CG2-CG 3.65Å; P763-D905 WeakPolarHBondContact CB-O 3.39Å; P763-D905 WeakPolarHBondContact CD-O 3.48Å; P763-D905 WeakPolarHBondContact CG-O 3.47Å
764	L	94.1	Very high	94.9	Very high	12 Å²	12	13.1 Å²	13.1	6%	0.063	7%	0.065	C	C	.	.	S	Bend	trans	-56.1	135.1	-176.8	-81.5	60.8	0	0	0	109.9	K656 P660 I663 C761 Y766 L964	K656-L764 HydrophobicContact CB-CD1 4.4Å; P660-L764 HydrophobicContact CB-CD2 4.19Å; P660-L764 HydrophobicContact CB-CG 4.2Å; I663-L764 HydrophobicContact CG1-CD2 4.39Å; C761-L764 HydrophobicContact CB-CB 4.38Å; C761-L764 WeakPolarHBondContact O-CB 3.39Å; C761-L764 PolarHBondContact O-N 3.49Å; L764-Y766 PolarHBondContact O-N 3.15Å; L764-L964 HydrophobicContact CB-CD2 4.21Å; L764-L964 HydrophobicContact CD2-CD2 3.95Å
765	P	96.3	Very high	94.8	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	P	Polyproline II helix	trans	-59.3	121.8	177.2	-26.3	36	0	0	0	111.6	V657 I910 L912 F937 L941 Y947	V657-P765 HydrophobicContact CG1-CG 3.99Å; P765-I910 HydrophobicContact CB-CB 4.36Å; P765-I910 HydrophobicContact CB-CG2 3.94Å; P765-I910 HydrophobicContact CG-CB 4.44Å; P765-I910 HydrophobicContact CG-CD1 4.46Å; P765-I910 HydrophobicContact CG-CG2 4.16Å; P765-L912 HydrophobicContact CB-CD1 3.89Å; P765-L912 HydrophobicContact CB-CG 4.18Å; P765-F937 HydrophobicContact CG-CE1 4.3Å; P765-F937 HydrophobicContact CG-CZ 4.46Å; P765-L941 HydrophobicContact CB-CD1 3.87Å; P765-L941 HydrophobicContact CG-CD1 3.86Å; P765-Y947 WeakPolarHBondContact O-CE1 3.11Å; P765-Y947 PolarHBondContact O-OH 2.84Å
766	Y	97.7	Very high	94.9	Very high	12 Å²	12	8.9 Å²	8.9	5%	0.047	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.7	169.7	-178.6	-95	0	0	0	109.5	A752 R755 I756 L764 I910 V911 L912 L963 T966	A752-Y766 WeakPolarHBondContact CA-OH 3.22Å; R755-Y766 HydrophobicContact CB-CD2 4.45Å; R755-Y766 HydrophobicContact CB-CE2 3.62Å; R755-Y766 HydrophobicContact CG-CE2 4.26Å; I756-Y766 HydrophobicContact CD1-CD1 4.15Å; I756-Y766 HydrophobicContact CD1-CE1 4.01Å; I756-Y766 HydrophobicContact CG1-CD1 3.59Å; I756-Y766 HydrophobicContact CG1-CE1 3.64Å; I756-Y766 HydrophobicContact CG1-CG 4.44Å; L764-Y766 PolarHBondContact O-N 3.15Å; Y766-I910 PolarHBondContact N-O 3.26Å; Y766-V911 HydrophobicContact CD1-CG1 4.37Å; Y766-V911 CarbonylContact O-C 3.53Å; Y766-V911 WeakPolarHBondContact O-CA 3.47Å; Y766-L912 PolarHBondContact O-N 2.91Å; Y766-L963 WeakPolarHBondContact CD2-O 3.45Å; Y766-T966 WeakPolarHBondContact OH-CB 3.26Å; Y766-T966 PolarHBondContact OH-OG1 3.1Å
767	I	98.2	Very high	94.7	Very high	0 Å²	0	10 Å²	10	0%	0	6%	0.061	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	115.7	-175.8	-62.7	-179.7	0	0	0	110.7	F769 L912 L938 L941 M942 Y947 L964 V965 T966	I767-F769 HydrophobicContact CG2-CB 4.28Å; I767-F769 PolarHBondContact O-N 3.42Å; I767-L912 CarbonylContact C-O 3.44Å; I767-L912 WeakPolarHBondContact CA-O 3.43Å; I767-L938 HydrophobicContact CB-CD1 4.44Å; I767-L938 HydrophobicContact CD1-CD1 3.98Å; I767-L938 HydrophobicContact CG1-CD1 4.05Å; I767-L938 HydrophobicContact CG2-CD1 3.67Å; I767-L941 HydrophobicContact CD1-CB 4.24Å; I767-M942 HydrophobicContact CD1-CG 3.67Å; I767-M942 HydrophobicContact CD1-SD 4.47Å; I767-M942 HydrophobicContact CG2-SD 4.3Å; I767-Y947 HydrophobicContact CD1-CD1 3.49Å; I767-Y947 VanDerWaalsContact CD1-CD1 3.49Å; I767-Y947 HydrophobicContact CD1-CE1 3.64Å; I767-Y947 HydrophobicContact CD1-CG 4.43Å; I767-Y947 HydrophobicContact CG1-CD1 4.18Å; I767-Y947 HydrophobicContact CG1-CE1 3.91Å; I767-L964 PolarHBondContact N-O 3.33Å; I767-V965 HydrophobicContact CB-CG1 4.37Å; I767-V965 HydrophobicContact CB-CG2 4.22Å; I767-V965 HydrophobicContact CG2-CG1 4.24Å; I767-V965 VanDerWaalsContact O-CA 3.32Å; I767-V965 WeakPolarHBondContact O-CA 3.42Å; I767-T966 PolarHBondContact O-N 2.83Å
768	L	98.1	Very high	94.7	Very high	0 Å²	0	11.8 Å²	11.8	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	92.6	163.7	-178.6	64.7	0	0	0	108.7	A752 G770 T779 I780 L912 A913 G914 L968	A752-L768 HydrophobicContact CB-CD1 3.77Å; L768-G770 PolarHBondContact O-N 3.37Å; L768-T779 HydrophobicContact CD1-CG2 4.13Å; L768-T779 HydrophobicContact CD2-CG2 3.91Å; L768-I780 HydrophobicContact CD2-CG1 3.97Å; L768-L912 PolarHBondContact N-O 2.94Å; L768-A913 HydrophobicContact CB-CB 3.99Å; L768-A913 HydrophobicContact CD2-CB 4.1Å; L768-A913 HydrophobicContact CG-CB 4.42Å; L768-A913 WeakPolarHBondContact O-CA 3.35Å; L768-G914 PolarHBondContact O-N 3.01Å; L768-G914 VanDerWaalsContact O-N 3.16Å; L768-L968 HydrophobicContact CD1-CD1 4.05Å; L768-L968 HydrophobicContact CD1-CD2 3.9Å; L768-L968 HydrophobicContact CD1-CG 3.88Å; L768-L968 HydrophobicContact CG-CD1 4.42Å
769	F	97.3	Very high	94.9	Very high	6 Å²	6	11.1 Å²	11.1	3%	0.026	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	105.4	177.3	-179	-172.1	0	0	0	109	I767 P771 D915 P916 M942 V965 T966 K967 L968 Y987	I767-F769 HydrophobicContact CG2-CB 4.28Å; I767-F769 PolarHBondContact O-N 3.42Å; F769-P771 HydrophobicContact CD2-CG 4.4Å; F769-P771 HydrophobicContact CE2-CG 4.02Å; F769-P771 HydrophobicContact CZ-CG 4.48Å; F769-P771 WeakPolarHBondContact O-CD 3.43Å; F769-D915 HydrophobicContact CE2-CB 4.35Å; F769-D915 WeakPolarHBondContact CE2-OD1 3.48Å; F769-P916 HydrophobicContact CE2-CG 4.4Å; F769-P916 HydrophobicContact CZ-CG 4.42Å; F769-M942 HydrophobicContact CD1-CE 3.78Å; F769-M942 HydrophobicContact CE1-CE 4.01Å; F769-M942 HydrophobicContact CG-CE 4.3Å; F769-V965 HydrophobicContact CB-CG1 4.09Å; F769-T966 PolarHBondContact N-O 3.42Å; F769-K967 HydrophobicContact CB-CB 4.39Å; F769-K967 HydrophobicContact CD1-CB 4.22Å; F769-K967 HydrophobicContact CD1-CD 4.04Å; F769-K967 HydrophobicContact CD1-CG 3.87Å; F769-K967 HydrophobicContact CE1-CD 4.07Å; F769-K967 HydrophobicContact CE1-CG 4.31Å; F769-K967 HydrophobicContact CG-CG 4.2Å; F769-K967 CarbonylContact O-C 3.53Å; F769-K967 VanDerWaalsContact O-CA 3.3Å; F769-K967 WeakPolarHBondContact O-CA 3.49Å; F769-L968 PolarHBondContact O-N 3.02Å; F769-Y987 HydrophobicContact CE2-CD1 4.37Å; F769-Y987 HydrophobicContact CE2-CE1 4.06Å; F769-Y987 AromaticContact CZ-CD1 3.94Å; F769-Y987 HydrophobicContact CZ-CD1 3.94Å; F769-Y987 AromaticContact CZ-CE1 4Å; F769-Y987 HydrophobicContact CZ-CE1 4Å
770	G	95.6	Very high	95.1	Very high	0 Å²	0	11 Å²	11	0%	0	7%	0.066	C	C	.	.			trans	-120.9	95.8	-178.7	0	0	0	0	0	114	L768 K776 G914	L768-G770 PolarHBondContact O-N 3.37Å; G770-K776 VanDerWaalsContact CA-CG 3.43Å; G770-K776 WeakPolarHBondContact O-CD 3.12Å; G770-K776 PolarHBondContact O-NZ 3.41Å; G770-G914 PolarHBondContact N-O 3.27Å
771	P	95.8	Very high	95.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.064	C	C	.	.			trans	-49.2	163.9	166.5	-25.6	34.3	0	0	0	113	F769 G773 T774 D915 L968 Y987 L991	F769-P771 HydrophobicContact CD2-CG 4.4Å; F769-P771 HydrophobicContact CE2-CG 4.02Å; F769-P771 HydrophobicContact CZ-CG 4.48Å; F769-P771 WeakPolarHBondContact O-CD 3.43Å; P771-G773 PolarHBondContact O-N 2.92Å; P771-T774 HydrophobicContact CB-CG2 3.82Å; P771-T774 HydrophobicContact CG-CG2 4.34Å; P771-T774 WeakPolarHBondContact O-CB 3.49Å; P771-T774 WeakPolarHBondContact O-CG2 3.38Å; P771-T774 PolarHBondContact O-N 2.87Å; P771-T774 PolarHBondContact O-OG1 2.73Å; P771-D915 WeakPolarHBondContact CA-OD2 3.34Å; P771-L968 VanDerWaalsContact CD-O 3.3Å; P771-L968 WeakPolarHBondContact CD-O 3.3Å; P771-Y987 HydrophobicContact CB-CD1 3.94Å; P771-Y987 HydrophobicContact CB-CE1 3.65Å; P771-Y987 HydrophobicContact CB-CE2 4.31Å; P771-Y987 HydrophobicContact CB-CG 4.37Å; P771-Y987 HydrophobicContact CG-CD1 3.68Å; P771-Y987 HydrophobicContact CG-CE1 3.72Å; P771-Y987 HydrophobicContact CG-CG 4.35Å; P771-L991 HydrophobicContact CB-CD1 4.22Å; P771-L991 HydrophobicContact CB-CD2 3.83Å; P771-L991 HydrophobicContact CG-CD2 3.81Å
772	P	93.8	Very high	95.6	Very high	3 Å²	3	10.3 Å²	10.3	2%	0.019	6%	0.062	C	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	140.1	-175.5	24.3	-29.3	0	0	0	111.1	T774 Q918 N971 Y987 T1137	P772-T774 VanDerWaalsContact C-N 3.26Å; P772-T774 PolarHBondContact O-N 3.48Å; P772-Q918 VanDerWaalsContact CD-NE2 3.28Å; P772-N971 PolarHBondContact O-ND2 2.88Å; P772-Y987 WeakPolarHBondContact CD-OH 3.37Å; P772-T1137 HydrophobicContact CG-CG2 3.66Å
773	G	93.2	Very high	95.8	Very high	15 Å²	15	8.7 Å²	8.7	16%	0.155	6%	0.056	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.6	7	178.5	0	0	0	0	0	115.8	P771 Y972	P771-G773 PolarHBondContact O-N 2.92Å; G773-Y972 PolarHBondContact O-N 3.37Å
774	T	95.2	Very high	96.1	Very high	1 Å²	1	8.2 Å²	8.2	1%	0.006	5%	0.053	C	C	.	.	S	Bend	trans	-90.2	4.3	-174.5	60.8	0	0	0	0	115.6	P771 P772 L968 K970	P771-T774 HydrophobicContact CB-CG2 3.82Å; P771-T774 HydrophobicContact CG-CG2 4.34Å; P771-T774 WeakPolarHBondContact O-CB 3.49Å; P771-T774 WeakPolarHBondContact O-CG2 3.38Å; P771-T774 PolarHBondContact O-N 2.87Å; P771-T774 PolarHBondContact O-OG1 2.73Å; P772-T774 VanDerWaalsContact C-N 3.26Å; P772-T774 PolarHBondContact O-N 3.48Å; T774-L968 HydrophobicContact CG2-CB 4.39Å; T774-L968 WeakPolarHBondContact CG2-O 3.14Å; T774-K970 VanDerWaalsContact CA-O 3.27Å; T774-K970 WeakPolarHBondContact CA-O 3.49Å
775	G	93.7	Very high	96.2	Very high	21 Å²	21	7.8 Å²	7.8	22%	0.216	5%	0.051	C	C	.	.			trans	82.6	27.6	176.4	0	0	0	0	0	115.6	Q749 T777 V778 T779	Q749-G775 PolarHBondContact NE2-O 3.42Å; G775-T777 PolarHBondContact O-N 3.41Å; G775-V778 WeakPolarHBondContact O-CB 3.48Å; G775-V778 PolarHBondContact O-N 3.06Å; G775-V778 VanDerWaalsContact O-N 3.15Å; G775-T779 PolarHBondContact O-N 3.03Å; G775-T779 PolarHBondContact O-OG1 2.79Å; G775-T779 VanDerWaalsContact O-OG1 3.05Å
776	K	95.2	Very high	96.2	Very high	17 Å²	17	8.1 Å²	8.1	7%	0.074	5%	0.052	C	C	.	.	H	α-helix	trans	-41.6	-61.7	175.2	-78.6	-160.2	-60.4	-72.5	0	114	G770 V778 T779 I780 E887 L968	G770-K776 VanDerWaalsContact CA-CG 3.43Å; G770-K776 WeakPolarHBondContact O-CD 3.12Å; G770-K776 PolarHBondContact O-NZ 3.41Å; K776-V778 PolarHBondContact O-N 3.12Å; K776-T779 WeakPolarHBondContact O-CB 3.38Å; K776-T779 PolarHBondContact O-N 3.02Å; K776-I780 WeakPolarHBondContact O-CG1 3.4Å; K776-I780 PolarHBondContact O-N 2.71Å; K776-E887 WeakPolarHBondContact CE-OE1 3.4Å; K776-E887 IonicContact NZ-OE1 3.29Å; K776-L968 HydrophobicContact CG-CD1 4.42Å
777	T	93.3	Very high	96.1	Very high	25 Å²	25	7.6 Å²	7.6	15%	0.153	5%	0.05	C	C	.	.	H	α-helix	trans	-62.9	-34.8	-174.3	-46.9	0	0	0	0	111.5	G775 I780 I781 L808 V809 R812	G775-T777 PolarHBondContact O-N 3.41Å; T777-I780 PolarHBondContact O-N 3.04Å; T777-I781 HydrophobicContact CG2-CD1 4.22Å; T777-I781 WeakPolarHBondContact O-CB 3.12Å; T777-I781 WeakPolarHBondContact O-CD1 3.49Å; T777-I781 WeakPolarHBondContact O-CG1 3.41Å; T777-I781 PolarHBondContact O-N 3.16Å; T777-L808 HydrophobicContact CG2-CD2 4.31Å; T777-L808 HydrophobicContact CG2-CG 4.21Å; T777-V809 HydrophobicContact CG2-CG2 4.11Å; T777-R812 HydrophobicContact CG2-CG 4.34Å
778	V	95.1	Very high	96	Very high	42 Å²	42	8.4 Å²	8.4	26%	0.255	5%	0.054	S	C	.	.	H	α-helix	trans	-64.3	-42.5	175.4	179.6	0	0	0	0	110.9	N742 L745 G775 K776 I781 E782	N742-V778 VanDerWaalsContact ND2-CG1 3.32Å; N742-V778 WeakPolarHBondContact ND2-CG1 3.45Å; L745-V778 HydrophobicContact CD2-CG1 3.9Å; G775-V778 WeakPolarHBondContact O-CB 3.48Å; G775-V778 PolarHBondContact O-N 3.06Å; G775-V778 VanDerWaalsContact O-N 3.15Å; K776-V778 PolarHBondContact O-N 3.12Å; V778-I781 PolarHBondContact O-N 2.84Å; V778-E782 PolarHBondContact O-N 3.27Å
779	T	97.3	Very high	95.8	Very high	0 Å²	0	12 Å²	12	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-65.4	-41	175.4	-46.9	0	0	0	0	111.9	Q749 A752 V753 L768 G775 K776 E782 A783	Q749-T779 HydrophobicContact CB-CG2 4.13Å; Q749-T779 HydrophobicContact CG-CG2 4.43Å; Q749-T779 VanDerWaalsContact CG-OG1 3.29Å; Q749-T779 WeakPolarHBondContact CG-OG1 3.34Å; Q749-T779 PolarHBondContact NE2-OG1 3.26Å; Q749-T779 VanDerWaalsContact NE2-OG1 3.12Å; A752-T779 HydrophobicContact CB-CG2 4.01Å; V753-T779 HydrophobicContact CG2-CG2 4.16Å; L768-T779 HydrophobicContact CD1-CG2 4.13Å; L768-T779 HydrophobicContact CD2-CG2 3.91Å; G775-T779 PolarHBondContact O-N 3.03Å; G775-T779 PolarHBondContact O-OG1 2.79Å; G775-T779 VanDerWaalsContact O-OG1 3.05Å; K776-T779 WeakPolarHBondContact O-CB 3.38Å; K776-T779 PolarHBondContact O-N 3.02Å; T779-E782 PolarHBondContact O-N 2.88Å; T779-A783 WeakPolarHBondContact O-CB 3.17Å; T779-A783 PolarHBondContact O-N 3.26Å
780	I	97.6	Very high	95.7	Very high	1 Å²	1	13 Å²	13	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-62.3	-45.2	175.4	-64.8	168.6	0	0	0	110.3	L768 K776 T777 E782 A783 V784 F884 D886 A913	L768-I780 HydrophobicContact CD2-CG1 3.97Å; K776-I780 WeakPolarHBondContact O-CG1 3.4Å; K776-I780 PolarHBondContact O-N 2.71Å; T777-I780 PolarHBondContact O-N 3.04Å; I780-E782 PolarHBondContact O-N 3.18Å; I780-A783 PolarHBondContact O-N 2.94Å; I780-V784 HydrophobicContact CG2-CG2 4.21Å; I780-V784 WeakPolarHBondContact O-CB 3.45Å; I780-V784 VanDerWaalsContact O-CG2 3.29Å; I780-V784 WeakPolarHBondContact O-CG2 3.17Å; I780-V784 PolarHBondContact O-N 3.24Å; I780-F884 HydrophobicContact CG2-CD1 4.21Å; I780-D886 HydrophobicContact CD1-CB 3.8Å; I780-D886 WeakPolarHBondContact CD1-OD1 3.46Å; I780-A913 HydrophobicContact CD1-CB 3.39Å; I780-A913 HydrophobicContact CG1-CB 3.93Å
781	I	97.4	Very high	95.6	Very high	14 Å²	14	14.4 Å²	14.4	7%	0.072	9%	0.087	C	C	.	.	H	α-helix	trans	-58.5	-49.1	178	-69.7	-10.4	0	0	0	110.2	T777 V778 A783 V784 L785 V809 R812 L813	T777-I781 HydrophobicContact CG2-CD1 4.22Å; T777-I781 WeakPolarHBondContact O-CB 3.12Å; T777-I781 WeakPolarHBondContact O-CD1 3.49Å; T777-I781 WeakPolarHBondContact O-CG1 3.41Å; T777-I781 PolarHBondContact O-N 3.16Å; V778-I781 PolarHBondContact O-N 2.84Å; I781-A783 PolarHBondContact O-N 3.4Å; I781-V784 PolarHBondContact O-N 2.94Å; I781-L785 HydrophobicContact CG2-CD1 4.15Å; I781-L785 WeakPolarHBondContact O-CG 2.94Å; I781-L785 PolarHBondContact O-N 3.12Å; I781-V809 HydrophobicContact CD1-CB 4.36Å; I781-V809 HydrophobicContact CD1-CG1 3.79Å; I781-R812 HydrophobicContact CD1-CB 4.19Å; I781-R812 HydrophobicContact CG1-CB 3.55Å; I781-L813 HydrophobicContact CB-CD2 4.48Å; I781-L813 HydrophobicContact CD1-CD1 4.25Å; I781-L813 HydrophobicContact CD1-CD2 4.4Å; I781-L813 HydrophobicContact CD1-CG 3.84Å; I781-L813 HydrophobicContact CG1-CG 4.27Å; I781-L813 HydrophobicContact CG2-CD2 3.86Å; I781-L813 HydrophobicContact CG2-CG 4.31Å
782	E	97.3	Very high	95.4	Very high	3 Å²	3	18.9 Å²	18.9	1%	0.014	12%	0.116	C	C	.	.	H	α-helix	trans	-58.2	-48.1	176.4	-177.9	71.1	-155.1	0	0	111.3	F740 F741 N742 L745 V753 V778 T779 I780 V784 L785 Q786	F740-E782 VanDerWaalsContact CA-OE1 3.31Å; F740-E782 WeakPolarHBondContact CA-OE1 3.25Å; F740-E782 HydrophobicContact CD1-CG 4.07Å; F741-E782 WeakPolarHBondContact CB-OE2 3.28Å; F741-E782 WeakPolarHBondContact CD2-OE1 3.44Å; F741-E782 PolarHBondContact N-OE1 2.94Å; F741-E782 PolarHBondContact N-OE2 3.17Å; N742-E782 PolarHBondContact N-OE2 3.01Å; L745-E782 HydrophobicContact CD1-CB 3.85Å; L745-E782 HydrophobicContact CD1-CG 3.42Å; L745-E782 VanDerWaalsContact CD1-CG 3.42Å; V753-E782 HydrophobicContact CB-CG 4.49Å; V753-E782 HydrophobicContact CG1-CG 4.06Å; V753-E782 HydrophobicContact CG2-CB 3.98Å; V753-E782 HydrophobicContact CG2-CG 3.71Å; V778-E782 PolarHBondContact O-N 3.27Å; T779-E782 PolarHBondContact O-N 2.88Å; I780-E782 PolarHBondContact O-N 3.18Å; E782-V784 VanDerWaalsContact C-N 3.34Å; E782-V784 PolarHBondContact O-N 2.86Å; E782-L785 PolarHBondContact O-N 2.77Å; E782-Q786 HydrophobicContact CG-CG 4.22Å; E782-Q786 VanDerWaalsContact O-CG 3.32Å; E782-Q786 WeakPolarHBondContact O-CG 3.18Å; E782-Q786 PolarHBondContact O-N 2.9Å; E782-Q786 PolarHBondContact OE1-NE2 2.72Å
783	A	97.5	Very high	95.4	Very high	1 Å²	1	25.9 Å²	25.9	1%	0.008	15%	0.153	C	C	.	.	H	α-helix	trans	-59.9	-43.2	-179.4	0	0	0	0	0	112.1	V753 I756 T779 I780 I781 Q786 V787 F884	V753-A783 HydrophobicContact CG2-CB 4.25Å; I756-A783 HydrophobicContact CD1-CB 3.79Å; I756-A783 HydrophobicContact CG2-CB 4.2Å; T779-A783 WeakPolarHBondContact O-CB 3.17Å; T779-A783 PolarHBondContact O-N 3.26Å; I780-A783 PolarHBondContact O-N 2.94Å; I781-A783 PolarHBondContact O-N 3.4Å; A783-Q786 PolarHBondContact O-N 3.36Å; A783-V787 WeakPolarHBondContact O-CB 3.3Å; A783-V787 VanDerWaalsContact O-CG2 3.28Å; A783-V787 WeakPolarHBondContact O-CG2 3.36Å; A783-V787 PolarHBondContact O-N 3.1Å; A783-F884 HydrophobicContact CB-CE1 3.95Å; A783-F884 HydrophobicContact CB-CZ 4.3Å
784	V	97.9	Very high	95.5	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-44.2	176.5	168.8	0	0	0	0	111.1	I780 I781 E782 H788 I796 V798 L813 I859 F884	I780-V784 HydrophobicContact CG2-CG2 4.21Å; I780-V784 WeakPolarHBondContact O-CB 3.45Å; I780-V784 VanDerWaalsContact O-CG2 3.29Å; I780-V784 WeakPolarHBondContact O-CG2 3.17Å; I780-V784 PolarHBondContact O-N 3.24Å; I781-V784 PolarHBondContact O-N 2.94Å; E782-V784 VanDerWaalsContact C-N 3.34Å; E782-V784 PolarHBondContact O-N 2.86Å; V784-H788 VanDerWaalsContact O-CB 3.25Å; V784-H788 WeakPolarHBondContact O-CB 3.48Å; V784-H788 PolarHBondContact O-N 3.2Å; V784-I796 HydrophobicContact CG1-CD1 4.13Å; V784-I796 HydrophobicContact CG1-CG2 4.4Å; V784-I796 HydrophobicContact CG2-CG2 4.35Å; V784-I796 WeakPolarHBondContact O-CD1 3.38Å; V784-V798 HydrophobicContact CG2-CG2 3.93Å; V784-L813 HydrophobicContact CG1-CD1 4.38Å; V784-L813 HydrophobicContact CG1-CD2 4.15Å; V784-I859 HydrophobicContact CG1-CD1 4.03Å; V784-I859 HydrophobicContact CG1-CG2 4.28Å; V784-F884 HydrophobicContact CG2-CD1 4.39Å; V784-F884 HydrophobicContact CG2-CD2 4.14Å; V784-F884 HydrophobicContact CG2-CE1 4.36Å; V784-F884 HydrophobicContact CG2-CE2 4.1Å; V784-F884 HydrophobicContact CG2-CG 4.29Å; V784-F884 HydrophobicContact CG2-CZ 4.22Å
785	L	97	Very high	95.6	Very high	2 Å²	2	29.1 Å²	29.1	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-63.7	-46.7	177	-67.5	175.9	0	0	0	111.3	F741 I781 E782 V787 H788 F789 L813 V818 L819	F741-L785 HydrophobicContact CB-CD1 4.11Å; F741-L785 HydrophobicContact CD2-CB 3.6Å; F741-L785 HydrophobicContact CD2-CD1 4.15Å; F741-L785 HydrophobicContact CE2-CB 3.7Å; F741-L785 HydrophobicContact CG-CB 4.34Å; F741-L785 HydrophobicContact CG-CD1 4.1Å; F741-L785 HydrophobicContact CZ-CB 4.49Å; I781-L785 HydrophobicContact CG2-CD1 4.15Å; I781-L785 WeakPolarHBondContact O-CG 2.94Å; I781-L785 PolarHBondContact O-N 3.12Å; E782-L785 PolarHBondContact O-N 2.77Å; L785-V787 PolarHBondContact O-N 3Å; L785-H788 PolarHBondContact O-N 3.21Å; L785-F789 HydrophobicContact CD2-CE2 4.49Å; L785-F789 VanDerWaalsContact O-CD2 3.27Å; L785-F789 WeakPolarHBondContact O-CD2 3.47Å; L785-F789 PolarHBondContact O-N 3.32Å; L785-L813 HydrophobicContact CD2-CD2 3.98Å; L785-L813 HydrophobicContact CG-CD2 4.12Å; L785-V818 HydrophobicContact CD1-CG2 4.35Å; L785-V818 HydrophobicContact CD2-CB 4.36Å; L785-L819 HydrophobicContact CD2-CD1 4.18Å; L785-L819 HydrophobicContact CD2-CD2 3.64Å; L785-L819 HydrophobicContact CD2-CG 3.72Å
786	Q	96	Very high	95.8	Very high	8 Å²	8	28.2 Å²	28.2	4%	0.037	15%	0.151	C	C	.	.	H	α-helix	trans	-60.8	-46.8	179.2	-68.8	-65.3	-12.7	0	0	111.7	E739 F741 V753 L757 E782 A783 H788 F789 A790	E739-Q786 PolarHBondContact O-NE2 2.86Å; F741-Q786 HydrophobicContact CD2-CG 4.37Å; F741-Q786 HydrophobicContact CE2-CG 4.29Å; V753-Q786 HydrophobicContact CG1-CB 4.19Å; V753-Q786 HydrophobicContact CG1-CG 3.72Å; L757-Q786 HydrophobicContact CD1-CB 4.18Å; L757-Q786 HydrophobicContact CD2-CB 4.4Å; E782-Q786 HydrophobicContact CG-CG 4.22Å; E782-Q786 VanDerWaalsContact O-CG 3.32Å; E782-Q786 WeakPolarHBondContact O-CG 3.18Å; E782-Q786 PolarHBondContact O-N 2.9Å; E782-Q786 PolarHBondContact OE1-NE2 2.72Å; A783-Q786 PolarHBondContact O-N 3.36Å; Q786-H788 VanDerWaalsContact C-N 3.34Å; Q786-H788 PolarHBondContact O-N 3.07Å; Q786-F789 PolarHBondContact O-N 3.21Å; Q786-A790 WeakPolarHBondContact O-CB 3.49Å; Q786-A790 PolarHBondContact O-N 2.79Å
787	V	96.1	Very high	95.9	Very high	1 Å²	1	27.4 Å²	27.4	1%	0.006	15%	0.147	C	C	.	.	H	α-helix	trans	-61.1	-42.3	175.5	170.3	0	0	0	0	111.3	I756 L757 A783 L785 F789 L791 S794 I796 H882 F884	I756-V787 HydrophobicContact CG2-CG2 4.16Å; L757-V787 HydrophobicContact CD1-CG2 4.27Å; A783-V787 WeakPolarHBondContact O-CB 3.3Å; A783-V787 VanDerWaalsContact O-CG2 3.28Å; A783-V787 WeakPolarHBondContact O-CG2 3.36Å; A783-V787 PolarHBondContact O-N 3.1Å; L785-V787 PolarHBondContact O-N 3Å; V787-F789 PolarHBondContact O-N 3.07Å; V787-L791 HydrophobicContact CG1-CD1 4.38Å; V787-L791 WeakPolarHBondContact O-CB 3.31Å; V787-L791 PolarHBondContact O-N 3.1Å; V787-L791 VanDerWaalsContact O-N 3.09Å; V787-S794 PolarHBondContact O-OG 3.33Å; V787-S794 VanDerWaalsContact O-OG 3.14Å; V787-I796 HydrophobicContact CB-CD1 4.03Å; V787-I796 HydrophobicContact CG1-CD1 3.67Å; V787-I796 HydrophobicContact CG1-CG1 4.04Å; V787-H882 HydrophobicContact CG1-CB 4.48Å; V787-F884 HydrophobicContact CG2-CZ 4.5Å
788	H	95.9	Very high	96.2	Very high	17 Å²	17	26.2 Å²	26.2	8%	0.079	14%	0.14	C	C	.	.	H	α-helix	trans	-61.6	-44.7	-179.5	176.1	64.7	0	0	0	112.8	V784 L785 Q786 I796 T823 R858 I859	V784-H788 VanDerWaalsContact O-CB 3.25Å; V784-H788 WeakPolarHBondContact O-CB 3.48Å; V784-H788 PolarHBondContact O-N 3.2Å; L785-H788 PolarHBondContact O-N 3.21Å; Q786-H788 VanDerWaalsContact C-N 3.34Å; Q786-H788 PolarHBondContact O-N 3.07Å; H788-I796 HydrophobicContact CB-CD1 4.03Å; H788-T823 WeakPolarHBondContact CE1-CG2 3.47Å; H788-T823 WeakPolarHBondContact NE2-CG2 3.34Å; H788-R858 PolarHBondContact CE1-NH1 3.19Å; H788-R858 PolarHBondContact O-NH2 3.48Å; H788-R858 VanDerWaalsContact O-NH2 3.12Å; H788-I859 HydrophobicContact CB-CD1 4.24Å
789	F	94.4	Very high	96.3	Very high	74 Å²	74	24.3 Å²	24.3	33%	0.325	13%	0.129	S	C	.	.	H	α-helix	trans	-85	-32.2	-176.7	-78.6	-73.7	0	0	0	114.1	F741 L785 Q786 V787 V818 L819	F741-F789 HydrophobicContact CE1-CD2 4.02Å; F741-F789 HydrophobicContact CE1-CE2 4.1Å; F741-F789 AromaticContact CE2-CD2 3.98Å; F741-F789 HydrophobicContact CE2-CD2 3.98Å; F741-F789 HydrophobicContact CZ-CB 4.25Å; F741-F789 AromaticContact CZ-CD2 3.3Å; F741-F789 HydrophobicContact CZ-CD2 3.3Å; F741-F789 AromaticContact CZ-CE2 3.84Å; F741-F789 HydrophobicContact CZ-CE2 3.84Å; F741-F789 AromaticContact CZ-CG 3.92Å; F741-F789 HydrophobicContact CZ-CG 3.92Å; L785-F789 HydrophobicContact CD2-CE2 4.49Å; L785-F789 VanDerWaalsContact O-CD2 3.27Å; L785-F789 WeakPolarHBondContact O-CD2 3.47Å; L785-F789 PolarHBondContact O-N 3.32Å; Q786-F789 PolarHBondContact O-N 3.21Å; V787-F789 PolarHBondContact O-N 3.07Å; F789-V818 HydrophobicContact CD2-CG1 4.49Å; F789-V818 HydrophobicContact CE2-CG1 3.45Å; F789-V818 VanDerWaalsContact CE2-CG1 3.45Å; F789-V818 HydrophobicContact CZ-CG1 3.72Å; F789-L819 HydrophobicContact CE2-CD2 4.38Å
790	A	93.6	Very high	96.3	Very high	28 Å²	28	24.4 Å²	24.4	23%	0.231	13%	0.129	C	C	.	.	H	α-helix	trans	-81.5	-29	-179.2	0	0	0	0	0	112.9	V670 M738 L757 Q786 P792	V670-A790 HydrophobicContact CG2-CB 3.98Å; M738-A790 HydrophobicContact CE-CB 3.4Å; M738-A790 VanDerWaalsContact CE-CB 3.4Å; L757-A790 HydrophobicContact CD1-CB 3.8Å; Q786-A790 WeakPolarHBondContact O-CB 3.49Å; Q786-A790 PolarHBondContact O-N 2.79Å; A790-P792 WeakPolarHBondContact O-CD 3.34Å
791	L	94	Very high	96.1	Very high	30 Å²	30	25.4 Å²	25.4	16%	0.157	14%	0.136	C	C	.	.			trans	-118.1	95.7	-179.2	-59.9	176.2	0	0	0	109.4	Q669 V670 V787 D793 S794 R858	Q669-L791 HydrophobicContact CB-CD1 4.16Å; Q669-L791 HydrophobicContact CB-CD2 4.23Å; V670-L791 HydrophobicContact CG2-CD2 3.55Å; V670-L791 HydrophobicContact CG2-CG 3.98Å; V787-L791 HydrophobicContact CG1-CD1 4.38Å; V787-L791 WeakPolarHBondContact O-CB 3.31Å; V787-L791 PolarHBondContact O-N 3.1Å; V787-L791 VanDerWaalsContact O-N 3.09Å; L791-D793 PolarHBondContact O-N 3.25Å; L791-S794 WeakPolarHBondContact O-CB 3.32Å; L791-S794 PolarHBondContact O-N 3.17Å; L791-S794 PolarHBondContact O-OG 3.34Å; L791-R858 PolarHBondContact O-NH2 2.82Å
792	P	92.1	Very high	95.7	Very high	93 Å²	93	26.1 Å²	26.1	60%	0.604	14%	0.142	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.1	-29.4	-177.6	-27	35.8	0	0	0	114.7	A790 S794 R858	A790-P792 WeakPolarHBondContact O-CD 3.34Å; P792-S794 VanDerWaalsContact C-N 3.32Å; P792-R858 PolarHBondContact O-NE 3.44Å; P792-R858 PolarHBondContact O-NH1 3.31Å; P792-R858 PolarHBondContact O-NH2 2.92Å; P792-R858 VanDerWaalsContact O-NH2 3.09Å
793	D	92.9	Very high	95.3	Very high	150 Å²	150	28.6 Å²	28.6	80%	0.802	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.6	3.1	178.9	-59.5	-43.3	0	0	0	113.2	L791 R795	L791-D793 PolarHBondContact O-N 3.25Å; D793-R795 PolarHBondContact O-N 3.25Å
794	S	95.4	Very high	94.8	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.014	18%	0.183	C	C	.	.			trans	-68.3	135.9	-179	68.1	0	0	0	0	112.2	V787 L791 P792 R858 T881	V787-S794 PolarHBondContact O-OG 3.33Å; V787-S794 VanDerWaalsContact O-OG 3.14Å; L791-S794 WeakPolarHBondContact O-CB 3.32Å; L791-S794 PolarHBondContact O-N 3.17Å; L791-S794 PolarHBondContact O-OG 3.34Å; P792-S794 VanDerWaalsContact C-N 3.32Å; S794-R858 PolarHBondContact O-NE 3.11Å; S794-R858 PolarHBondContact O-NH2 3.17Å; S794-R858 VanDerWaalsContact O-NH2 3.08Å; S794-R858 PolarHBondContact OG-NH2 2.86Å; S794-T881 WeakPolarHBondContact CA-OG1 3.24Å
795	R	97.2	Very high	94.5	Very high	83 Å²	83	33 Å²	33	31%	0.313	19%	0.187	S	C	.	.			trans	-123.2	111.6	169.8	-72.4	-177.3	177.8	-80.6	-1.6	107.5	D793 S855 R856 F857 H879 F880 T881 H882	D793-R795 PolarHBondContact O-N 3.25Å; R795-S855 PolarHBondContact NH1-O 2.95Å; R795-R856 PolarHBondContact NH1-O 3.45Å; R795-F857 PolarHBondContact NH1-O 2.97Å; R795-H879 WeakPolarHBondContact CB-O 3.44Å; R795-H879 WeakPolarHBondContact CD-O 3.44Å; R795-F880 HydrophobicContact CB-CD1 4.47Å; R795-T881 PolarHBondContact N-OG1 3.32Å; R795-T881 PolarHBondContact O-N 3.36Å; R795-T881 PolarHBondContact O-OG1 3.45Å; R795-H882 PolarHBondContact O-N 2.81Å
796	I	98.3	Very high	94.3	Very high	1 Å²	1	33 Å²	33	1%	0.005	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	122.4	-167.4	-50.8	176.2	0	0	0	108.9	V784 V787 H788 V798 R858 I859 I860 H882 F884	V784-I796 HydrophobicContact CG1-CD1 4.13Å; V784-I796 HydrophobicContact CG1-CG2 4.4Å; V784-I796 HydrophobicContact CG2-CG2 4.35Å; V784-I796 WeakPolarHBondContact O-CD1 3.38Å; V787-I796 HydrophobicContact CB-CD1 4.03Å; V787-I796 HydrophobicContact CG1-CD1 3.67Å; V787-I796 HydrophobicContact CG1-CG1 4.04Å; H788-I796 HydrophobicContact CB-CD1 4.03Å; I796-V798 HydrophobicContact CG2-CG2 3.9Å; I796-R858 PolarHBondContact N-O 2.98Å; I796-I859 HydrophobicContact CD1-CG1 4.38Å; I796-I859 WeakPolarHBondContact O-CA 3.38Å; I796-I860 PolarHBondContact O-N 3.2Å; I796-H882 WeakPolarHBondContact CA-O 3.45Å; I796-H882 HydrophobicContact CG1-CB 4.38Å; I796-H882 HydrophobicContact CG2-CB 4.46Å; I796-F884 HydrophobicContact CG2-CD2 3.69Å; I796-F884 HydrophobicContact CG2-CE2 3.79Å
797	L	98.3	Very high	94.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	114	171.8	176.9	63.4	0	0	0	109	I860 T862 F870 F880 H882 V883 F884 P899 L902	L797-I860 HydrophobicContact CD1-CB 3.99Å; L797-I860 HydrophobicContact CD1-CG2 3.89Å; L797-T862 HydrophobicContact CD1-CG2 3.7Å; L797-F870 HydrophobicContact CD1-CE2 4.24Å; L797-F880 HydrophobicContact CB-CB 4.4Å; L797-F880 HydrophobicContact CB-CD1 3.64Å; L797-F880 HydrophobicContact CB-CD2 4.5Å; L797-F880 HydrophobicContact CB-CE1 3.97Å; L797-F880 HydrophobicContact CB-CG 3.92Å; L797-F880 HydrophobicContact CD1-CE1 4.4Å; L797-F880 HydrophobicContact CD1-CZ 4.41Å; L797-F880 HydrophobicContact CD2-CD2 4.03Å; L797-F880 HydrophobicContact CD2-CE2 4.06Å; L797-F880 HydrophobicContact CD2-CG 4.28Å; L797-F880 HydrophobicContact CD2-CZ 4.33Å; L797-H882 PolarHBondContact N-O 3.38Å; L797-V883 HydrophobicContact CB-CG2 3.88Å; L797-V883 HydrophobicContact CD2-CG2 4Å; L797-V883 HydrophobicContact CG-CG2 4.26Å; L797-V883 CarbonylContact O-C 3.58Å; L797-V883 VanDerWaalsContact O-CA 3.31Å; L797-V883 WeakPolarHBondContact O-CA 3.44Å; L797-F884 PolarHBondContact O-N 3.09Å; L797-P899 HydrophobicContact CD2-CB 3.94Å; L797-L902 HydrophobicContact CD2-CD1 3.92Å
798	V	98.5	Very high	94	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.006	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	121.4	176.5	-168.8	0	0	0	0	109.1	V784 I796 V809 I860 I861 T862 F884	V784-V798 HydrophobicContact CG2-CG2 3.93Å; I796-V798 HydrophobicContact CG2-CG2 3.9Å; V798-V809 HydrophobicContact CG1-CG1 3.83Å; V798-I860 PolarHBondContact N-O 2.88Å; V798-I861 HydrophobicContact CB-CG1 4.33Å; V798-I861 WeakPolarHBondContact O-CA 3.23Å; V798-T862 PolarHBondContact O-N 2.73Å; V798-F884 CarbonylContact C-O 3.59Å; V798-F884 WeakPolarHBondContact CA-O 3.32Å; V798-F884 HydrophobicContact CB-CB 4.42Å; V798-F884 HydrophobicContact CG1-CB 4.03Å; V798-F884 HydrophobicContact CG2-CB 4.25Å
799	C	98.2	Very high	94	Very high	2 Å²	2	35.1 Å²	35.1	1%	0.014	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	152.8	-176.6	-66.4	0	0	0	0	111.4	T862 F884 V885 D886 P899	C799-T862 VanDerWaalsContact CA-O 3.26Å; C799-T862 WeakPolarHBondContact CA-O 3.45Å; C799-T862 VanDerWaalsContact SG-CG2 3.51Å; C799-F884 PolarHBondContact N-O 3.17Å; C799-V885 HydrophobicContact CB-CG2 4.49Å; C799-V885 CarbonylContact O-C 3.44Å; C799-V885 WeakPolarHBondContact O-CA 3.47Å; C799-D886 PolarHBondContact O-N 3.06Å; C799-P899 HydrophobicContact CB-CB 4.25Å; C799-P899 HydrophobicContact CB-CG 4.09Å; C799-P899 WeakPolarHBondContact SG-CB 3.36Å
800	A	96.1	Very high	94	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.008	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	154.8	166.6	0	0	0	0	0	109.8	S802 A805 A806 T862 T863 C864 D886	A800-S802 VanDerWaalsContact C-N 3.3Å; A800-S802 PolarHBondContact O-N 3.2Å; A800-A805 HydrophobicContact CB-CB 3.62Å; A800-A806 HydrophobicContact CB-CB 4.36Å; A800-T862 PolarHBondContact N-O 2.94Å; A800-T863 CarbonylContact O-C 3.48Å; A800-T863 WeakPolarHBondContact O-CA 3.48Å; A800-C864 VanDerWaalsContact C-SG 3.55Å; A800-C864 PolarHBondContact O-N 3.23Å; A800-D886 HydrophobicContact CB-CB 4.45Å
801	P	93.8	Very high	94.1	Very high	23 Å²	23	31.8 Å²	31.8	15%	0.149	18%	0.18	C	C	.	.	S	Bend	trans	-66.8	-31.7	177.6	23.1	-30.5	0	0	0	112.6	D886 E887 Q890 A891	P801-D886 WeakPolarHBondContact CD-O 3.14Å; P801-E887 HydrophobicContact CG-CB 4.14Å; P801-Q890 HydrophobicContact CG-CB 3.97Å; P801-Q890 HydrophobicContact CG-CG 4.27Å; P801-A891 HydrophobicContact CB-CB 4.07Å; P801-A891 HydrophobicContact CG-CB 4.32Å
802	S	89.4	Confident	94.1	Very high	29 Å²	29	35.7 Å²	35.7	20%	0.203	19%	0.193	C	C	.	.	S	Bend	trans	-108.1	150.1	-177.4	70.3	0	0	0	0	113.1	A800 S804 A805 A806	A800-S802 VanDerWaalsContact C-N 3.3Å; A800-S802 PolarHBondContact O-N 3.2Å; S802-S804 VanDerWaalsContact C-N 3.31Å; S802-S804 PolarHBondContact O-N 2.7Å; S802-S804 PolarHBondContact OG-OG 3.2Å; S802-A805 PolarHBondContact O-N 2.96Å; S802-A805 VanDerWaalsContact OG-CB 3.24Å; S802-A805 WeakPolarHBondContact OG-CB 3.49Å; S802-A805 PolarHBondContact OG-N 3.4Å; S802-A806 PolarHBondContact O-N 2.99Å
803	N	88.3	Confident	94.3	Very high	54 Å²	54	31.3 Å²	31.3	29%	0.289	16%	0.164	S	C	.	.	H	α-helix	trans	-63.5	-37.4	174.6	-81	-52	0	0	0	112.4	A806 D807 R826 T863	N803-A806 PolarHBondContact O-N 3.41Å; N803-D807 WeakPolarHBondContact O-CB 3.37Å; N803-D807 PolarHBondContact O-N 3.42Å; N803-R826 PolarHBondContact OD1-NH2 3.11Å; N803-T863 VanDerWaalsContact OD1-CG2 3.24Å; N803-T863 WeakPolarHBondContact OD1-CG2 3.32Å
804	S	87	Confident	94.3	Very high	85 Å²	85	27.9 Å²	27.9	59%	0.594	14%	0.144	S	C	*	.	H	α-helix	trans	-64.6	-41.1	179	49.3	0	0	0	0	112.2	S802 D807 L808	S802-S804 VanDerWaalsContact C-N 3.31Å; S802-S804 PolarHBondContact O-N 2.7Å; S802-S804 PolarHBondContact OG-OG 3.2Å; S804-D807 PolarHBondContact O-N 3.46Å; S804-L808 WeakPolarHBondContact O-CB 3.45Å; S804-L808 PolarHBondContact O-N 3.22Å
805	A	91.1	Very high	94.3	Very high	10 Å²	10	32.5 Å²	32.5	8%	0.083	17%	0.165	C	C	.	.	H	α-helix	trans	-66.1	-44.7	175.3	0	0	0	0	0	111.8	A800 S802 D807 L808 V809 E887	A800-A805 HydrophobicContact CB-CB 3.62Å; S802-A805 PolarHBondContact O-N 2.96Å; S802-A805 VanDerWaalsContact OG-CB 3.24Å; S802-A805 WeakPolarHBondContact OG-CB 3.49Å; S802-A805 PolarHBondContact OG-N 3.4Å; A805-D807 VanDerWaalsContact C-N 3.32Å; A805-D807 PolarHBondContact O-N 2.85Å; A805-L808 WeakPolarHBondContact O-CB 3.48Å; A805-L808 PolarHBondContact O-N 2.79Å; A805-V809 WeakPolarHBondContact O-CG2 3.27Å; A805-V809 PolarHBondContact O-N 2.82Å; A805-V809 VanDerWaalsContact O-N 3.09Å; A805-E887 HydrophobicContact CB-CG 4.35Å
806	A	93.9	Very high	94	Very high	1 Å²	1	30.3 Å²	30.3	1%	0.008	16%	0.162	C	C	.	.	H	α-helix	trans	-61.6	-39.9	176.1	0	0	0	0	0	112.2	A800 S802 N803 V809 C810 I861	A800-A806 HydrophobicContact CB-CB 4.36Å; S802-A806 PolarHBondContact O-N 2.99Å; N803-A806 PolarHBondContact O-N 3.41Å; A806-V809 PolarHBondContact O-N 2.77Å; A806-C810 PolarHBondContact O-N 3.32Å; A806-C810 VanDerWaalsContact O-N 3.1Å; A806-I861 HydrophobicContact CB-CG2 4.11Å; A806-I861 VanDerWaalsContact O-CG2 3.27Å; A806-I861 WeakPolarHBondContact O-CG2 3.46Å
807	D	93	Very high	93.7	Very high	5 Å²	5	39.3 Å²	39.3	3%	0.027	20%	0.201	C	C	.	.	H	α-helix	trans	-68.8	-37.7	176.8	-73	10.7	0	0	0	112.4	N803 S804 A805 V809 C810 L811 R826 R832	N803-D807 WeakPolarHBondContact O-CB 3.37Å; N803-D807 PolarHBondContact O-N 3.42Å; S804-D807 PolarHBondContact O-N 3.46Å; A805-D807 VanDerWaalsContact C-N 3.32Å; A805-D807 PolarHBondContact O-N 2.85Å; D807-V809 VanDerWaalsContact C-N 3.33Å; D807-V809 PolarHBondContact O-N 2.99Å; D807-C810 WeakPolarHBondContact O-CB 3.39Å; D807-C810 PolarHBondContact O-N 3.33Å; D807-L811 VanDerWaalsContact O-CB 3.32Å; D807-L811 WeakPolarHBondContact O-CB 3.31Å; D807-L811 PolarHBondContact O-N 2.87Å; D807-R826 IonicContact OD1-CZ 3.28Å; D807-R826 IonicContact OD1-NE 3.8Å; D807-R826 PolarHBondContact OD1-NE 2.85Å; D807-R826 IonicContact OD1-NH2 4Å; D807-R826 PolarHBondContact OD1-NH2 3.5Å; D807-R832 VanDerWaalsContact CG-NH1 3.34Å; D807-R832 IonicContact OD1-CZ 2.81Å; D807-R832 IonicContact OD1-NH1 2.64Å; D807-R832 PolarHBondContact OD1-NH1 2.9Å; D807-R832 IonicContact OD1-NH2 3.25Å; D807-R832 IonicContact OD2-CZ 3.81Å; D807-R832 VanDerWaalsContact OD2-CZ 3.29Å; D807-R832 IonicContact OD2-NH1 3.32Å; D807-R832 PolarHBondContact OD2-NH1 3.18Å; D807-R832 VanDerWaalsContact OD2-NH1 3.16Å; D807-R832 IonicContact OD2-NH2 2.91Å; D807-R832 PolarHBondContact OD2-NH2 3.23Å
808	L	92.8	Very high	93.4	Very high	65 Å²	65	41.2 Å²	41.2	34%	0.34	21%	0.213	S	C	.	.	H	α-helix	trans	-59.8	-44.6	174.7	179.9	64	0	0	0	110.9	T777 S804 A805 C810 L811 R812	T777-L808 HydrophobicContact CG2-CD2 4.31Å; T777-L808 HydrophobicContact CG2-CG 4.21Å; S804-L808 WeakPolarHBondContact O-CB 3.45Å; S804-L808 PolarHBondContact O-N 3.22Å; A805-L808 WeakPolarHBondContact O-CB 3.48Å; A805-L808 PolarHBondContact O-N 2.79Å; L808-C810 VanDerWaalsContact C-N 3.34Å; L808-C810 PolarHBondContact O-N 2.58Å; L808-L811 PolarHBondContact O-N 3Å; L808-R812 HydrophobicContact CD1-CG 4.16Å; L808-R812 HydrophobicContact CG-CG 4.47Å; L808-R812 VanDerWaalsContact O-CG 3.29Å; L808-R812 WeakPolarHBondContact O-CG 3.49Å; L808-R812 PolarHBondContact O-N 3.43Å
809	V	95.5	Very high	93.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-59.2	-46.7	174.6	173	0	0	0	0	110.8	T777 I781 V798 A805 A806 D807 L811 R812 L813 I861	T777-V809 HydrophobicContact CG2-CG2 4.11Å; I781-V809 HydrophobicContact CD1-CB 4.36Å; I781-V809 HydrophobicContact CD1-CG1 3.79Å; V798-V809 HydrophobicContact CG1-CG1 3.83Å; A805-V809 WeakPolarHBondContact O-CG2 3.27Å; A805-V809 PolarHBondContact O-N 2.82Å; A805-V809 VanDerWaalsContact O-N 3.09Å; A806-V809 PolarHBondContact O-N 2.77Å; D807-V809 VanDerWaalsContact C-N 3.33Å; D807-V809 PolarHBondContact O-N 2.99Å; V809-L811 PolarHBondContact O-N 2.67Å; V809-R812 PolarHBondContact O-N 3.23Å; V809-L813 HydrophobicContact CG1-CD1 3.91Å; V809-L813 WeakPolarHBondContact O-CB 3.24Å; V809-L813 WeakPolarHBondContact O-CG 3.29Å; V809-L813 PolarHBondContact O-N 2.77Å; V809-I861 HydrophobicContact CG1-CD1 4.04Å; V809-I861 HydrophobicContact CG1-CG1 4.49Å
810	C	95.7	Very high	92.7	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-43.9	178.5	-170.7	0	0	0	0	112.1	A806 D807 L808 L813 H814 V841 I861	A806-C810 PolarHBondContact O-N 3.32Å; A806-C810 VanDerWaalsContact O-N 3.1Å; D807-C810 WeakPolarHBondContact O-CB 3.39Å; D807-C810 PolarHBondContact O-N 3.33Å; L808-C810 VanDerWaalsContact C-N 3.34Å; L808-C810 PolarHBondContact O-N 2.58Å; C810-L813 PolarHBondContact O-N 3.39Å; C810-H814 WeakPolarHBondContact O-CB 3.3Å; C810-H814 PolarHBondContact O-N 3.48Å; C810-V841 HydrophobicContact CB-CG1 4.27Å; C810-V841 HydrophobicContact CB-CG2 4.39Å; C810-I861 VanDerWaalsContact CA-CD1 3.49Å; C810-I861 HydrophobicContact CB-CD1 3.71Å
811	L	94.8	Very high	92.1	Very high	31 Å²	31	54.2 Å²	54.2	16%	0.162	28%	0.284	C	S	.	.	H	α-helix	trans	-63.2	-47.6	178.2	178.6	63.4	0	0	0	111.1	D807 L808 V809 L813 H814 E815 A840 V841	D807-L811 VanDerWaalsContact O-CB 3.32Å; D807-L811 WeakPolarHBondContact O-CB 3.31Å; D807-L811 PolarHBondContact O-N 2.87Å; L808-L811 PolarHBondContact O-N 3Å; V809-L811 PolarHBondContact O-N 2.67Å; L811-L813 PolarHBondContact O-N 2.99Å; L811-H814 WeakPolarHBondContact O-CB 3.31Å; L811-H814 PolarHBondContact O-N 2.8Å; L811-H814 VanDerWaalsContact O-N 3.17Å; L811-E815 HydrophobicContact CD1-CG 4.36Å; L811-E815 HydrophobicContact CG-CG 4.5Å; L811-E815 WeakPolarHBondContact O-CG 3.35Å; L811-E815 PolarHBondContact O-N 3.36Å; L811-A840 HydrophobicContact CD1-CB 3.76Å; L811-V841 HydrophobicContact CB-CG2 4.27Å
812	R	94.5	Very high	91.8	Very high	112 Å²	112	56.8 Å²	56.8	42%	0.423	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-35.6	179.8	-65.5	-52.5	-172	125.1	0.2	112.7	T777 I781 L808 V809 E815 S816	T777-R812 HydrophobicContact CG2-CG 4.34Å; I781-R812 HydrophobicContact CD1-CB 4.19Å; I781-R812 HydrophobicContact CG1-CB 3.55Å; L808-R812 HydrophobicContact CD1-CG 4.16Å; L808-R812 HydrophobicContact CG-CG 4.47Å; L808-R812 VanDerWaalsContact O-CG 3.29Å; L808-R812 WeakPolarHBondContact O-CG 3.49Å; L808-R812 PolarHBondContact O-N 3.43Å; V809-R812 PolarHBondContact O-N 3.23Å; R812-E815 WeakPolarHBondContact CD-OE2 3.26Å; R812-E815 IonicContact NE-OE2 3.27Å; R812-E815 PolarHBondContact O-N 2.9Å; R812-S816 PolarHBondContact O-N 3.26Å; R812-S816 VanDerWaalsContact O-N 3.12Å
813	L	95.6	Very high	92	Very high	1 Å²	1	56.5 Å²	56.5	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-66.6	-39.5	171.9	-78.1	163.1	0	0	0	111.7	I781 V784 L785 V809 C810 L811 S816 L819 M824 I861	I781-L813 HydrophobicContact CB-CD2 4.48Å; I781-L813 HydrophobicContact CD1-CD1 4.25Å; I781-L813 HydrophobicContact CD1-CD2 4.4Å; I781-L813 HydrophobicContact CD1-CG 3.84Å; I781-L813 HydrophobicContact CG1-CG 4.27Å; I781-L813 HydrophobicContact CG2-CD2 3.86Å; I781-L813 HydrophobicContact CG2-CG 4.31Å; V784-L813 HydrophobicContact CG1-CD1 4.38Å; V784-L813 HydrophobicContact CG1-CD2 4.15Å; L785-L813 HydrophobicContact CD2-CD2 3.98Å; L785-L813 HydrophobicContact CG-CD2 4.12Å; V809-L813 HydrophobicContact CG1-CD1 3.91Å; V809-L813 WeakPolarHBondContact O-CB 3.24Å; V809-L813 WeakPolarHBondContact O-CG 3.29Å; V809-L813 PolarHBondContact O-N 2.77Å; C810-L813 PolarHBondContact O-N 3.39Å; L811-L813 PolarHBondContact O-N 2.99Å; L813-S816 WeakPolarHBondContact O-CB 3.38Å; L813-S816 PolarHBondContact O-N 3.12Å; L813-S816 PolarHBondContact O-OG 3.25Å; L813-L819 HydrophobicContact CB-CD1 4.25Å; L813-L819 HydrophobicContact CD2-CD1 4.08Å; L813-M824 HydrophobicContact CB-CE 4.26Å; L813-M824 HydrophobicContact CB-SD 3.64Å; L813-M824 HydrophobicContact CD1-SD 3.75Å; L813-M824 HydrophobicContact CG-SD 4.31Å; L813-I861 HydrophobicContact CD1-CD1 3.77Å
814	H	94	Very high	92.4	Very high	79 Å²	79	54.3 Å²	54.3	37%	0.366	29%	0.292	S	S	.	.	H	α-helix	trans	-61.4	-47.9	172.5	171.2	74.2	0	0	0	111.8	C810 L811 S816 K817 Y844	C810-H814 WeakPolarHBondContact O-CB 3.3Å; C810-H814 PolarHBondContact O-N 3.48Å; L811-H814 WeakPolarHBondContact O-CB 3.31Å; L811-H814 PolarHBondContact O-N 2.8Å; L811-H814 VanDerWaalsContact O-N 3.17Å; H814-S816 PolarHBondContact O-N 3.38Å; H814-K817 PolarHBondContact O-N 3.03Å; H814-Y844 HydrophobicContact CB-CE2 3.91Å; H814-Y844 AromaticContact CG-CE2 3.94Å; H814-Y844 AromaticContact ND1-CE2 3.61Å; H814-Y844 AromaticContact ND1-CZ 3.63Å; H814-Y844 PolarHBondContact ND1-OH 3.21Å
815	E	93.6	Very high	92.8	Very high	99 Å²	99	50.3 Å²	50.3	46%	0.463	26%	0.264	S	S	.	.	H	α-helix	trans	-62.5	-24.9	179.4	-74.4	173.1	175.6	0	0	113.5	L811 R812 K817	L811-E815 HydrophobicContact CD1-CG 4.36Å; L811-E815 HydrophobicContact CG-CG 4.5Å; L811-E815 WeakPolarHBondContact O-CG 3.35Å; L811-E815 PolarHBondContact O-N 3.36Å; R812-E815 WeakPolarHBondContact CD-OE2 3.26Å; R812-E815 IonicContact NE-OE2 3.27Å; R812-E815 PolarHBondContact O-N 2.9Å; E815-K817 PolarHBondContact O-N 3.35Å
816	S	92.6	Very high	93	Very high	37 Å²	37	49.8 Å²	49.8	26%	0.259	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-27.8	174	80	0	0	0	0	112.8	R812 L813 H814 V818	R812-S816 PolarHBondContact O-N 3.26Å; R812-S816 VanDerWaalsContact O-N 3.12Å; L813-S816 WeakPolarHBondContact O-CB 3.38Å; L813-S816 PolarHBondContact O-N 3.12Å; L813-S816 PolarHBondContact O-OG 3.25Å; H814-S816 PolarHBondContact O-N 3.38Å; S816-V818 VanDerWaalsContact O-CG2 3.3Å; S816-V818 WeakPolarHBondContact O-CG2 3.5Å; S816-V818 PolarHBondContact O-N 3.31Å; S816-V818 PolarHBondContact OG-N 3.35Å
817	K	90.8	Very high	93.1	Very high	189 Å²	189	49.8 Å²	49.8	82%	0.822	26%	0.26	S	S	*	.			trans	54.1	18.6	-175.7	-59.5	176	-176.8	178	0	114.4	H814 E815	H814-K817 PolarHBondContact O-N 3.03Å; E815-K817 PolarHBondContact O-N 3.35Å
818	V	91.8	Very high	92.9	Very high	40 Å²	40	49.9 Å²	49.9	24%	0.242	26%	0.26	C	S	.	.			trans	-89.6	-36.9	-179.5	-174.7	0	0	0	0	111.6	F741 L785 F789 S816	F741-V818 HydrophobicContact CD1-CB 4.49Å; F741-V818 HydrophobicContact CD1-CG1 3.69Å; F741-V818 HydrophobicContact CD1-CG2 3.97Å; F741-V818 HydrophobicContact CE1-CG1 3.53Å; F741-V818 HydrophobicContact CZ-CG1 4.37Å; L785-V818 HydrophobicContact CD1-CG2 4.35Å; L785-V818 HydrophobicContact CD2-CB 4.36Å; F789-V818 HydrophobicContact CD2-CG1 4.49Å; F789-V818 HydrophobicContact CE2-CG1 3.45Å; F789-V818 VanDerWaalsContact CE2-CG1 3.45Å; F789-V818 HydrophobicContact CZ-CG1 3.72Å; S816-V818 VanDerWaalsContact O-CG2 3.3Å; S816-V818 WeakPolarHBondContact O-CG2 3.5Å; S816-V818 PolarHBondContact O-N 3.31Å; S816-V818 PolarHBondContact OG-N 3.35Å
819	L	92.8	Very high	92.4	Very high	28 Å²	28	47.9 Å²	47.9	15%	0.147	25%	0.253	C	S	.	.	S	Bend	trans	-76.7	138	-175.4	-65.1	176.8	0	0	0	111.6	L785 F789 L813 T823 M824 I859	L785-L819 HydrophobicContact CD2-CD1 4.18Å; L785-L819 HydrophobicContact CD2-CD2 3.64Å; L785-L819 HydrophobicContact CD2-CG 3.72Å; F789-L819 HydrophobicContact CE2-CD2 4.38Å; L813-L819 HydrophobicContact CB-CD1 4.25Å; L813-L819 HydrophobicContact CD2-CD1 4.08Å; L819-T823 HydrophobicContact CD2-CG2 4.21Å; L819-M824 HydrophobicContact CD1-CB 4.34Å; L819-M824 HydrophobicContact CD1-SD 4.23Å; L819-I859 HydrophobicContact CD1-CD1 3.82Å; L819-I859 HydrophobicContact CD2-CD1 3.86Å
820	Q	89.5	Confident	91.2	Very high	137 Å²	137	52.2 Å²	52.2	64%	0.64	28%	0.28	S	S	*	.	P	Polyproline II helix	trans	-71.3	153.8	174	-62.6	-60.1	-35.8	0	0	110.8	T823	Q820-T823 WeakPolarHBondContact O-CB 3.34Å; Q820-T823 PolarHBondContact O-N 3.34Å; Q820-T823 PolarHBondContact O-OG1 3.38Å; Q820-T823 VanDerWaalsContact O-OG1 3.11Å
821	P	84.1	Confident	90	Very high	112 Å²	112	55.5 Å²	55.5	73%	0.727	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.7	144.8	168.4	-24	34.1	0	0	0	110.9	T823	P821-T823 VanDerWaalsContact C-N 3.27Å; P821-T823 PolarHBondContact O-N 2.92Å
822	A	87	Confident	89.1	Confident	77 Å²	77	56.2 Å²	56.2	64%	0.636	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	66	11.5	-177.3	0	0	0	0	0	117	F857	A822-F857 HydrophobicContact CB-CE1 4.31Å; A822-F857 WeakPolarHBondContact O-CD1 3.31Å; A822-F857 WeakPolarHBondContact O-CE1 3.44Å
823	T	93.8	Very high	87.9	Confident	24 Å²	24	55.1 Å²	55.1	15%	0.147	30%	0.301	C	S	.	.	S	Bend	trans	-82.5	-32.2	170.8	-56.2	0	0	0	0	113.3	H788 L819 Q820 P821 R858 I859	H788-T823 WeakPolarHBondContact CE1-CG2 3.47Å; H788-T823 WeakPolarHBondContact NE2-CG2 3.34Å; L819-T823 HydrophobicContact CD2-CG2 4.21Å; Q820-T823 WeakPolarHBondContact O-CB 3.34Å; Q820-T823 PolarHBondContact O-N 3.34Å; Q820-T823 PolarHBondContact O-OG1 3.38Å; Q820-T823 VanDerWaalsContact O-OG1 3.11Å; P821-T823 VanDerWaalsContact C-N 3.27Å; P821-T823 PolarHBondContact O-N 2.92Å; T823-R858 PolarHBondContact O-N 3.29Å; T823-I859 HydrophobicContact CG2-CD1 4.28Å; T823-I859 PolarHBondContact O-N 2.75Å
824	M	96.1	Very high	86.7	Confident	7 Å²	7	59.5 Å²	59.5	3%	0.034	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	145.3	-173	-178.9	-178.5	73.5	0	0	111.6	L813 L819 Y844 I859 I861	L813-M824 HydrophobicContact CB-CE 4.26Å; L813-M824 HydrophobicContact CB-SD 3.64Å; L813-M824 HydrophobicContact CD1-SD 3.75Å; L813-M824 HydrophobicContact CG-SD 4.31Å; L819-M824 HydrophobicContact CD1-CB 4.34Å; L819-M824 HydrophobicContact CD1-SD 4.23Å; M824-Y844 HydrophobicContact CE-CD1 3.57Å; M824-Y844 HydrophobicContact CE-CD2 4.14Å; M824-Y844 HydrophobicContact CE-CE1 3.46Å; M824-Y844 VanDerWaalsContact CE-CE1 3.46Å; M824-Y844 HydrophobicContact CE-CE2 4.05Å; M824-Y844 HydrophobicContact CE-CG 3.91Å; M824-I859 CarbonylContact C-O 3.51Å; M824-I859 VanDerWaalsContact CA-O 3.3Å; M824-I859 WeakPolarHBondContact CA-O 3.26Å; M824-I859 HydrophobicContact CB-CB 4.19Å; M824-I859 HydrophobicContact CB-CG2 4.45Å; M824-I859 HydrophobicContact CG-CB 4.22Å; M824-I859 HydrophobicContact CG-CG2 3.97Å; M824-I861 HydrophobicContact CG-CD1 3.96Å; M824-I861 HydrophobicContact CG-CG1 4.44Å; M824-I861 HydrophobicContact SD-CD1 3.46Å; M824-I861 WeakPolarHBondContact SD-CD1 3.46Å; M824-I861 HydrophobicContact SD-CG1 4.48Å
825	V	96.6	Very high	85.4	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	145.4	176.9	67.3	0	0	0	0	111.9	D847 G848 A854 F857 I859 I860 I861	V825-D847 HydrophobicContact CG2-CB 4.07Å; V825-G848 VanDerWaalsContact CG2-CA 3.46Å; V825-A854 HydrophobicContact CG1-CB 4.19Å; V825-A854 HydrophobicContact CG2-CB 4.32Å; V825-F857 HydrophobicContact CB-CB 4.26Å; V825-F857 HydrophobicContact CB-CD1 3.74Å; V825-F857 HydrophobicContact CB-CD2 3.97Å; V825-F857 HydrophobicContact CB-CE1 3.98Å; V825-F857 HydrophobicContact CB-CE2 4.23Å; V825-F857 HydrophobicContact CB-CG 3.73Å; V825-F857 HydrophobicContact CB-CZ 4.24Å; V825-F857 HydrophobicContact CG1-CB 3.66Å; V825-F857 HydrophobicContact CG1-CD1 4.12Å; V825-F857 HydrophobicContact CG1-CD2 3.9Å; V825-F857 HydrophobicContact CG1-CG 3.63Å; V825-F857 HydrophobicContact CG2-CD2 4.45Å; V825-F857 HydrophobicContact CG2-CE2 4.36Å; V825-F857 HydrophobicContact CG2-CZ 4.47Å; V825-I859 PolarHBondContact N-O 2.95Å; V825-I860 HydrophobicContact CG1-CB 4.28Å; V825-I860 HydrophobicContact CG1-CG1 3.92Å; V825-I860 HydrophobicContact CG1-CG2 4.24Å; V825-I861 PolarHBondContact O-N 3.38Å
826	R	95.5	Very high	84.6	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	111.2	176.5	178.5	70.6	-173.7	83.1	3.8	110.3	N803 D807 N828 V841 Y844 C845 I861	N803-R826 PolarHBondContact OD1-NH2 3.11Å; D807-R826 IonicContact OD1-CZ 3.28Å; D807-R826 IonicContact OD1-NE 3.8Å; D807-R826 PolarHBondContact OD1-NE 2.85Å; D807-R826 IonicContact OD1-NH2 4Å; D807-R826 PolarHBondContact OD1-NH2 3.5Å; R826-N828 PolarHBondContact NH1-OD1 3.48Å; R826-N828 PolarHBondContact NH2-OD1 3.38Å; R826-V841 HydrophobicContact CG-CG1 4.09Å; R826-Y844 PolarHBondContact N-O 3.48Å; R826-C845 WeakPolarHBondContact O-CA 3.42Å; R826-I861 CarbonylContact C-O 3.56Å; R826-I861 WeakPolarHBondContact CA-O 3.37Å; R826-I861 PolarHBondContact NH1-O 3.07Å
827	V	94.7	Very high	84	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	106.9	-179.7	177.7	0	0	0	0	111	I851 A854 I860 I861 T862 L869 F870	V827-I851 HydrophobicContact CG1-CD1 3.67Å; V827-A854 HydrophobicContact CG2-CB 3.76Å; V827-I860 HydrophobicContact CG2-CG2 3.93Å; V827-I861 PolarHBondContact N-O 2.95Å; V827-T862 PolarHBondContact O-OG1 3.46Å; V827-L869 HydrophobicContact CG1-CD1 4.08Å; V827-F870 HydrophobicContact CG2-CZ 4.26Å
828	N	90.1	Very high	83.7	Confident	7 Å²	7	57.2 Å²	57.2	4%	0.037	32%	0.315	C	S	.	.			trans	-86.7	158.4	178.5	-70.1	-47.2	0	0	0	112.9	R489 R826 R832 C845	R489-N828 PolarHBondContact NH1-O 3.06Å; R489-N828 PolarHBondContact NH2-O 3.24Å; R489-N828 VanDerWaalsContact NH2-O 3.14Å; R826-N828 PolarHBondContact NH1-OD1 3.48Å; R826-N828 PolarHBondContact NH2-OD1 3.38Å; N828-R832 HydrophobicContact CB-CB 4.23Å; N828-R832 WeakPolarHBondContact OD1-CD 3.3Å; N828-R832 PolarHBondContact OD1-NH1 3.13Å; N828-C845 PolarHBondContact ND2-SG 3.26Å
829	A	81.6	Confident	83.6	Confident	23 Å²	23	61 Å²	61	19%	0.19	33%	0.333	C	S	.	.			trans	-63.1	151.1	165	0	0	0	0	0	110.6	C831 R832 S866	A829-C831 PolarHBondContact O-N 2.96Å; A829-R832 WeakPolarHBondContact O-CB 3.34Å; A829-R832 PolarHBondContact O-N 3.45Å; A829-R832 VanDerWaalsContact O-N 3.13Å; A829-S866 WeakPolarHBondContact CB-OG 3.2Å
830	T	70.9	Confident	83.4	Confident	92 Å²	92	61.2 Å²	61.2	56%	0.564	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-23.2	-174.8	47.5	0	0	0	0	114.5
831	C	70.3	Confident	83.5	Confident	69 Å²	69	54.7 Å²	54.7	47%	0.466	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	1.1	178.3	54.8	0	0	0	0	113.5	A829 F833	A829-C831 PolarHBondContact O-N 2.96Å; C831-F833 PolarHBondContact O-N 3.44Å
832	R	75.3	Confident	83.8	Confident	46 Å²	46	52.1 Å²	52.1	17%	0.174	29%	0.286	C	S	.	.			trans	-81	121.9	-176.6	-168.7	-179.1	-175.9	-177.8	2.8	110.8	D807 N828 A829	D807-R832 VanDerWaalsContact CG-NH1 3.34Å; D807-R832 IonicContact OD1-CZ 2.81Å; D807-R832 IonicContact OD1-NH1 2.64Å; D807-R832 PolarHBondContact OD1-NH1 2.9Å; D807-R832 IonicContact OD1-NH2 3.25Å; D807-R832 IonicContact OD2-CZ 3.81Å; D807-R832 VanDerWaalsContact OD2-CZ 3.29Å; D807-R832 IonicContact OD2-NH1 3.32Å; D807-R832 PolarHBondContact OD2-NH1 3.18Å; D807-R832 VanDerWaalsContact OD2-NH1 3.16Å; D807-R832 IonicContact OD2-NH2 2.91Å; D807-R832 PolarHBondContact OD2-NH2 3.23Å; N828-R832 HydrophobicContact CB-CB 4.23Å; N828-R832 WeakPolarHBondContact OD1-CD 3.3Å; N828-R832 PolarHBondContact OD1-NH1 3.13Å; A829-R832 WeakPolarHBondContact O-CB 3.34Å; A829-R832 PolarHBondContact O-N 3.45Å; A829-R832 VanDerWaalsContact O-N 3.13Å
833	F	69.3	Low	84	Confident	90 Å²	90	51.8 Å²	51.8	40%	0.395	28%	0.278	S	S	.	.			trans	-68.4	142	174.7	-72.8	-74.7	0	0	0	113.1	A582 C831 E835 I836	A582-F833 HydrophobicContact CB-CE1 4.45Å; A582-F833 HydrophobicContact CB-CE2 3.47Å; A582-F833 VanDerWaalsContact CB-CE2 3.47Å; A582-F833 HydrophobicContact CB-CZ 3.25Å; C831-F833 PolarHBondContact O-N 3.44Å; F833-E835 VanDerWaalsContact C-N 3.31Å; F833-E835 WeakPolarHBondContact CB-OE2 3.41Å; F833-I836 HydrophobicContact CB-CD1 3.92Å; F833-I836 HydrophobicContact CB-CG1 4.06Å; F833-I836 HydrophobicContact CD2-CD1 4.21Å
834	E	70.6	Confident	84	Confident	92 Å²	92	53.1 Å²	53.1	43%	0.43	28%	0.28	S	S	.	.	S	Bend	trans	-72.3	-28.5	180	-171	167.1	175.5	0	0	111.2	R488 I836 V837 K842	R488-E834 IonicContact NH1-OE2 3.97Å; E834-I836 VanDerWaalsContact C-N 3.32Å; E834-I836 PolarHBondContact O-N 2.88Å; E834-V837 WeakPolarHBondContact O-CB 3.15Å; E834-V837 PolarHBondContact O-N 3.06Å; E834-K842 VanDerWaalsContact O-CE 3.25Å; E834-K842 WeakPolarHBondContact O-CE 3.32Å
835	E	66.7	Low	83.7	Confident	147 Å²	147	53.3 Å²	53.3	69%	0.687	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-30	-178.8	-60.6	73.6	-158	0	0	112.8	F833 V837	F833-E835 VanDerWaalsContact C-N 3.31Å; F833-E835 WeakPolarHBondContact CB-OE2 3.41Å; E835-V837 VanDerWaalsContact C-N 3.29Å
836	I	75.8	Confident	83.3	Confident	118 Å²	118	61.7 Å²	61.7	61%	0.605	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-14	-179.9	-53.1	173.6	0	0	0	110.9	F833 E834	F833-I836 HydrophobicContact CB-CD1 3.92Å; F833-I836 HydrophobicContact CB-CG1 4.06Å; F833-I836 HydrophobicContact CD2-CD1 4.21Å; E834-I836 VanDerWaalsContact C-N 3.32Å; E834-I836 PolarHBondContact O-N 2.88Å
837	V	81.6	Confident	83	Confident	8 Å²	8	64.1 Å²	64.1	5%	0.048	33%	0.327	C	S	.	.	S	Bend	trans	-79	133.5	-179.9	-176.3	0	0	0	0	109.5	E834 E835 D839 V841 K842	E834-V837 WeakPolarHBondContact O-CB 3.15Å; E834-V837 PolarHBondContact O-N 3.06Å; E835-V837 VanDerWaalsContact C-N 3.29Å; V837-D839 PolarHBondContact O-N 3.29Å; V837-V841 HydrophobicContact CG1-CB 3.91Å; V837-V841 HydrophobicContact CG1-CG1 3.93Å; V837-K842 HydrophobicContact CB-CG 4.13Å; V837-K842 HydrophobicContact CG1-CG 3.98Å; V837-K842 WeakPolarHBondContact O-CE 3.18Å
838	I	84.4	Confident	82.7	Confident	84 Å²	84	64.1 Å²	64.1	43%	0.431	33%	0.327	S	S	.	.			trans	-58.3	135	175.1	-56.7	169.2	0	0	0	109.4	A840 V841 K842	I838-A840 HydrophobicContact CG2-CB 4.44Å; I838-A840 PolarHBondContact O-N 2.94Å; I838-A840 VanDerWaalsContact O-N 3.13Å; I838-V841 HydrophobicContact CB-CG2 4.31Å; I838-V841 WeakPolarHBondContact O-CA 3.37Å; I838-V841 WeakPolarHBondContact O-CB 3.35Å; I838-V841 PolarHBondContact O-N 3.03Å; I838-K842 PolarHBondContact O-N 3.42Å
839	D	88.1	Confident	82.5	Confident	118 Å²	118	65.9 Å²	65.9	63%	0.631	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	-37.9	-174.5	-72.1	-35.8	0	0	0	113.9	V837 V841 K842 P843	V837-D839 PolarHBondContact O-N 3.29Å; D839-V841 PolarHBondContact O-N 3.15Å; D839-K842 PolarHBondContact O-N 3.34Å; D839-K842 VanDerWaalsContact OD1-CE 3.29Å; D839-K842 WeakPolarHBondContact OD1-CE 3.39Å; D839-K842 IonicContact OD1-NZ 3.26Å; D839-K842 PolarHBondContact OD1-NZ 2.92Å; D839-P843 WeakPolarHBondContact O-CD 3.49Å
840	A	89.6	Confident	82.8	Confident	34 Å²	34	68.2 Å²	68.2	28%	0.281	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-24.2	176.5	0	0	0	0	0	113.7	L811 I838	L811-A840 HydrophobicContact CD1-CB 3.76Å; I838-A840 HydrophobicContact CG2-CB 4.44Å; I838-A840 PolarHBondContact O-N 2.94Å; I838-A840 VanDerWaalsContact O-N 3.13Å
841	V	91.1	Very high	83.7	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-28.5	-178.8	177.9	0	0	0	0	111.8	C810 L811 R826 V837 I838 D839 P843 Y844	C810-V841 HydrophobicContact CB-CG1 4.27Å; C810-V841 HydrophobicContact CB-CG2 4.39Å; L811-V841 HydrophobicContact CB-CG2 4.27Å; R826-V841 HydrophobicContact CG-CG1 4.09Å; V837-V841 HydrophobicContact CG1-CB 3.91Å; V837-V841 HydrophobicContact CG1-CG1 3.93Å; I838-V841 HydrophobicContact CB-CG2 4.31Å; I838-V841 WeakPolarHBondContact O-CA 3.37Å; I838-V841 WeakPolarHBondContact O-CB 3.35Å; I838-V841 PolarHBondContact O-N 3.03Å; D839-V841 PolarHBondContact O-N 3.15Å; V841-P843 VanDerWaalsContact C-N 3.32Å; V841-P843 VanDerWaalsContact O-N 3.14Å; V841-Y844 WeakPolarHBondContact O-CB 3.36Å; V841-Y844 PolarHBondContact O-N 3.37Å
842	K	91.1	Very high	84.7	Confident	58 Å²	58	66.6 Å²	66.6	25%	0.252	32%	0.318	S	S	.	.	H	α-helix	trans	-47.1	-42.7	-179	-69.4	-179.3	-179.6	166.8	0	114.5	E834 V837 I838 D839 Y844 C845	E834-K842 VanDerWaalsContact O-CE 3.25Å; E834-K842 WeakPolarHBondContact O-CE 3.32Å; V837-K842 HydrophobicContact CB-CG 4.13Å; V837-K842 HydrophobicContact CG1-CG 3.98Å; V837-K842 WeakPolarHBondContact O-CE 3.18Å; I838-K842 PolarHBondContact O-N 3.42Å; D839-K842 PolarHBondContact O-N 3.34Å; D839-K842 VanDerWaalsContact OD1-CE 3.29Å; D839-K842 WeakPolarHBondContact OD1-CE 3.39Å; D839-K842 IonicContact OD1-NZ 3.26Å; D839-K842 PolarHBondContact OD1-NZ 2.92Å; K842-Y844 PolarHBondContact O-N 3.07Å; K842-C845 WeakPolarHBondContact O-CB 3.49Å; K842-C845 PolarHBondContact O-N 3.04Å; K842-C845 VanDerWaalsContact O-N 3.08Å
843	P	91	Very high	85.5	Confident	69 Å²	69	68.4 Å²	68.4	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-58.7	-31.6	179.1	-25.8	35.6	0	0	0	114	D839 V841	D839-P843 WeakPolarHBondContact O-CD 3.49Å; V841-P843 VanDerWaalsContact C-N 3.32Å; V841-P843 VanDerWaalsContact O-N 3.14Å
844	Y	93.2	Very high	86.6	Confident	52 Å²	52	64.1 Å²	64.1	20%	0.204	31%	0.308	C	S	.	.	H	α-helix	trans	-82.2	-15.6	-179.4	-59.1	-76.8	0	0	0	113.2	H814 M824 R826 V841 K842	H814-Y844 HydrophobicContact CB-CE2 3.91Å; H814-Y844 AromaticContact CG-CE2 3.94Å; H814-Y844 AromaticContact ND1-CE2 3.61Å; H814-Y844 AromaticContact ND1-CZ 3.63Å; H814-Y844 PolarHBondContact ND1-OH 3.21Å; M824-Y844 HydrophobicContact CE-CD1 3.57Å; M824-Y844 HydrophobicContact CE-CD2 4.14Å; M824-Y844 HydrophobicContact CE-CE1 3.46Å; M824-Y844 VanDerWaalsContact CE-CE1 3.46Å; M824-Y844 HydrophobicContact CE-CE2 4.05Å; M824-Y844 HydrophobicContact CE-CG 3.91Å; R826-Y844 PolarHBondContact N-O 3.48Å; V841-Y844 WeakPolarHBondContact O-CB 3.36Å; V841-Y844 PolarHBondContact O-N 3.37Å; K842-Y844 PolarHBondContact O-N 3.07Å
845	C	91.1	Very high	87.7	Confident	12 Å²	12	60.4 Å²	60.4	8%	0.081	29%	0.293	C	S	.	.	H	α-helix	trans	-80.5	-30.1	-179.9	-62.7	0	0	0	0	113.1	R826 N828 K842 D847 G848 E849	R826-C845 WeakPolarHBondContact O-CA 3.42Å; N828-C845 PolarHBondContact ND2-SG 3.26Å; K842-C845 WeakPolarHBondContact O-CB 3.49Å; K842-C845 PolarHBondContact O-N 3.04Å; K842-C845 VanDerWaalsContact O-N 3.08Å; C845-D847 PolarHBondContact O-N 3.17Å; C845-G848 CarbonylContact O-C 3.59Å; C845-G848 WeakPolarHBondContact O-CA 3.46Å; C845-G848 PolarHBondContact O-N 3.31Å; C845-E849 PolarHBondContact O-N 3.37Å
846	R	87.6	Confident	89	Confident	177 Å²	177	62.4 Å²	62.4	67%	0.668	29%	0.294	S	S	*	.	H	α-helix	trans	-56.4	-48	-174.5	-69.4	-170	-70.4	-151.4	-1.6	113.1	G848 E849	R846-G848 VanDerWaalsContact C-N 3.27Å; R846-G848 PolarHBondContact O-N 2.96Å; R846-E849 WeakPolarHBondContact O-CB 3.36Å; R846-E849 PolarHBondContact O-N 2.78Å
847	D	88.8	Confident	90	Very high	50 Å²	50	57.8 Å²	57.8	27%	0.267	27%	0.269	S	S	.	.	H	α-helix	trans	-78.5	-14.9	178.4	-73.3	-6.3	0	0	0	112.9	V825 C845 E849 K853 F857	V825-D847 HydrophobicContact CG2-CB 4.07Å; C845-D847 PolarHBondContact O-N 3.17Å; D847-E849 VanDerWaalsContact C-N 3.25Å; D847-K853 HydrophobicContact CB-CD 4.13Å; D847-K853 WeakPolarHBondContact OD1-CE 3.44Å; D847-K853 IonicContact OD1-NZ 3.9Å; D847-K853 PolarHBondContact OD1-NZ 3.06Å; D847-K853 VanDerWaalsContact OD2-CE 3.31Å; D847-K853 WeakPolarHBondContact OD2-CE 3.34Å; D847-K853 IonicContact OD2-NZ 2.91Å; D847-K853 PolarHBondContact OD2-NZ 3.11Å; D847-F857 HydrophobicContact CB-CE2 3.93Å; D847-F857 HydrophobicContact CB-CZ 3.7Å; D847-F857 WeakPolarHBondContact OD2-CZ 3.33Å
848	G	88.9	Confident	90.7	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-78.1	-9.9	172.8	0	0	0	0	0	113.6	R489 V825 C845 R846	R489-G848 PolarHBondContact NH2-O 3.09Å; V825-G848 VanDerWaalsContact CG2-CA 3.46Å; C845-G848 CarbonylContact O-C 3.59Å; C845-G848 WeakPolarHBondContact O-CA 3.46Å; C845-G848 PolarHBondContact O-N 3.31Å; R846-G848 VanDerWaalsContact C-N 3.27Å; R846-G848 PolarHBondContact O-N 2.96Å
849	E	85.9	Confident	91.3	Very high	44 Å²	44	56.5 Å²	56.5	21%	0.206	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-48	171.3	-67.9	-56.2	130.5	0	0	111.2	R489 C845 R846 D847 I851	R489-E849 WeakPolarHBondContact CD-O 3.47Å; R489-E849 WeakPolarHBondContact CG-O 3.32Å; R489-E849 IonicContact CZ-OE1 3.67Å; R489-E849 IonicContact CZ-OE2 2.8Å; R489-E849 VanDerWaalsContact CZ-OE2 3.25Å; R489-E849 PolarHBondContact NE-O 3.43Å; R489-E849 IonicContact NE-OE2 2.78Å; R489-E849 PolarHBondContact NE-OE2 3.45Å; R489-E849 IonicContact NH2-OE1 2.77Å; R489-E849 PolarHBondContact NH2-OE1 3.12Å; R489-E849 IonicContact NH2-OE2 3.11Å; R489-E849 PolarHBondContact NH2-OE2 2.91Å; C845-E849 PolarHBondContact O-N 3.37Å; R846-E849 WeakPolarHBondContact O-CB 3.36Å; R846-E849 PolarHBondContact O-N 2.78Å; D847-E849 VanDerWaalsContact C-N 3.25Å; E849-I851 PolarHBondContact O-N 3.05Å
850	D	88.3	Confident	91.8	Very high	72 Å²	72	50.9 Å²	50.9	39%	0.385	23%	0.228	S	C	.	.	S	Bend	trans	-83.7	108.5	174.1	-179.8	-6.1	0	0	0	110.3	W852 K853 A854	D850-W852 VanDerWaalsContact C-N 3.28Å; D850-W852 PolarHBondContact O-N 3.24Å; D850-W852 WeakPolarHBondContact OD1-CB 3.45Å; D850-W852 PolarHBondContact OD1-N 2.98Å; D850-K853 HydrophobicContact CB-CB 3.74Å; D850-K853 CarbonylContact O-C 3.56Å; D850-K853 WeakPolarHBondContact O-CB 3.35Å; D850-K853 PolarHBondContact O-N 3.45Å; D850-K853 VanDerWaalsContact O-N 3.09Å; D850-K853 PolarHBondContact OD1-N 3.45Å; D850-A854 WeakPolarHBondContact O-CB 3.2Å; D850-A854 PolarHBondContact O-N 3.4Å
851	I	90.2	Very high	92.2	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-65.6	-30.1	-178.2	-52.3	-53.6	0	0	0	112.4	L491 V827 E849 K853 A854 S855 L869 F870 I873	L491-I851 HydrophobicContact CD1-CG1 3.88Å; L491-I851 HydrophobicContact CD2-CB 4.1Å; L491-I851 HydrophobicContact CD2-CG1 4.14Å; V827-I851 HydrophobicContact CG1-CD1 3.67Å; E849-I851 PolarHBondContact O-N 3.05Å; I851-K853 VanDerWaalsContact C-N 3.35Å; I851-A854 PolarHBondContact O-N 3Å; I851-S855 WeakPolarHBondContact O-CB 3.07Å; I851-S855 PolarHBondContact O-N 3.24Å; I851-L869 HydrophobicContact CD1-CB 4.33Å; I851-L869 HydrophobicContact CD1-CD1 3.89Å; I851-L869 HydrophobicContact CG1-CB 4.31Å; I851-L869 HydrophobicContact CG1-CD1 4.44Å; I851-L869 HydrophobicContact CG2-CB 4.38Å; I851-F870 HydrophobicContact CG2-CD1 3.84Å; I851-F870 HydrophobicContact CG2-CE1 3.81Å; I851-I873 HydrophobicContact CB-CG2 4.09Å; I851-I873 HydrophobicContact CG2-CD1 3.87Å; I851-I873 HydrophobicContact CG2-CG1 4.09Å; I851-I873 HydrophobicContact CG2-CG2 3.88Å
852	W	90.2	Very high	92.5	Very high	125 Å²	125	49.3 Å²	49.3	47%	0.473	22%	0.215	S	C	.	.	H	α-helix	trans	-70.5	-34.5	174.1	-65.5	105.2	0	0	0	111.8	D850 S855 I873	D850-W852 VanDerWaalsContact C-N 3.28Å; D850-W852 PolarHBondContact O-N 3.24Å; D850-W852 WeakPolarHBondContact OD1-CB 3.45Å; D850-W852 PolarHBondContact OD1-N 2.98Å; W852-S855 PolarHBondContact O-OG 3.45Å; W852-I873 HydrophobicContact CD2-CB 4.03Å; W852-I873 HydrophobicContact CD2-CD1 4.31Å; W852-I873 HydrophobicContact CD2-CG2 4.04Å; W852-I873 HydrophobicContact CE3-CB 4.09Å; W852-I873 HydrophobicContact CE3-CD1 3.97Å; W852-I873 HydrophobicContact CG-CG2 4.43Å; W852-I873 HydrophobicContact CH2-CB 3.74Å; W852-I873 WeakPolarHBondContact CH2-O 3.43Å; W852-I873 HydrophobicContact CZ2-CB 3.65Å; W852-I873 HydrophobicContact CZ2-CG2 3.95Å; W852-I873 HydrophobicContact CZ3-CB 3.95Å; W852-I873 HydrophobicContact CZ3-CD1 4.29Å; W852-I873 WeakPolarHBondContact CZ3-O 3.44Å
853	K	91.8	Very high	92.7	Very high	85 Å²	85	47 Å²	47	37%	0.37	21%	0.206	S	C	.	.	H	α-helix	trans	-71	-46.9	172.4	-166	179.5	-179.1	-177.8	0	110.4	D847 D850 I851 S855 R856 F857	D847-K853 HydrophobicContact CB-CD 4.13Å; D847-K853 WeakPolarHBondContact OD1-CE 3.44Å; D847-K853 IonicContact OD1-NZ 3.9Å; D847-K853 PolarHBondContact OD1-NZ 3.06Å; D847-K853 VanDerWaalsContact OD2-CE 3.31Å; D847-K853 WeakPolarHBondContact OD2-CE 3.34Å; D847-K853 IonicContact OD2-NZ 2.91Å; D847-K853 PolarHBondContact OD2-NZ 3.11Å; D850-K853 HydrophobicContact CB-CB 3.74Å; D850-K853 CarbonylContact O-C 3.56Å; D850-K853 WeakPolarHBondContact O-CB 3.35Å; D850-K853 PolarHBondContact O-N 3.45Å; D850-K853 VanDerWaalsContact O-N 3.09Å; D850-K853 PolarHBondContact OD1-N 3.45Å; I851-K853 VanDerWaalsContact C-N 3.35Å; K853-S855 VanDerWaalsContact C-N 3.31Å; K853-S855 PolarHBondContact O-N 3.43Å; K853-R856 WeakPolarHBondContact O-CB 3.18Å; K853-R856 PolarHBondContact O-N 2.81Å; K853-R856 VanDerWaalsContact O-N 3.17Å; K853-F857 HydrophobicContact CG-CE2 4.34Å; K853-F857 VanDerWaalsContact O-CD2 3.31Å; K853-F857 WeakPolarHBondContact O-CD2 3.25Å
854	A	93.3	Very high	93	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	18%	0.184	C	C	.	.	H	α-helix	trans	-58.7	-39.5	179.9	0	0	0	0	0	112.4	V825 V827 D850 I851 R856 F857 I860	V825-A854 HydrophobicContact CG1-CB 4.19Å; V825-A854 HydrophobicContact CG2-CB 4.32Å; V827-A854 HydrophobicContact CG2-CB 3.76Å; D850-A854 WeakPolarHBondContact O-CB 3.2Å; D850-A854 PolarHBondContact O-N 3.4Å; I851-A854 PolarHBondContact O-N 3Å; A854-R856 PolarHBondContact O-N 2.85Å; A854-R856 VanDerWaalsContact O-N 3.11Å; A854-F857 WeakPolarHBondContact O-CB 3.39Å; A854-F857 WeakPolarHBondContact O-CD2 3.3Å; A854-F857 PolarHBondContact O-N 3.19Å; A854-F857 VanDerWaalsContact O-N 3.09Å; A854-I860 WeakPolarHBondContact O-CD1 3.24Å
855	S	93	Very high	93	Very high	14 Å²	14	41.8 Å²	41.8	10%	0.098	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.1	-179.6	70.8	0	0	0	0	114.3	R795 I851 W852 K853 H879	R795-S855 PolarHBondContact NH1-O 2.95Å; I851-S855 WeakPolarHBondContact O-CB 3.07Å; I851-S855 PolarHBondContact O-N 3.24Å; W852-S855 PolarHBondContact O-OG 3.45Å; K853-S855 VanDerWaalsContact C-N 3.31Å; K853-S855 PolarHBondContact O-N 3.43Å; S855-H879 PolarHBondContact O-CE1 3.1Å; S855-H879 PolarHBondContact O-NE2 3.08Å
856	R	93.8	Very high	93.1	Very high	189 Å²	189	41.3 Å²	41.3	71%	0.713	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.8	177.4	-61	177.3	-175	-178.7	0	112.7	R795 K853 A854	R795-R856 PolarHBondContact NH1-O 3.45Å; K853-R856 WeakPolarHBondContact O-CB 3.18Å; K853-R856 PolarHBondContact O-N 2.81Å; K853-R856 VanDerWaalsContact O-N 3.17Å; A854-R856 PolarHBondContact O-N 2.85Å; A854-R856 VanDerWaalsContact O-N 3.11Å
857	F	96.5	Very high	93.5	Very high	21 Å²	21	32.9 Å²	32.9	9%	0.092	14%	0.143	C	C	.	.	S	Bend	trans	-66.4	154.9	179.2	-72.4	-106.7	0	0	0	111.4	R795 A822 V825 D847 K853 A854 I860	R795-F857 PolarHBondContact NH1-O 2.97Å; A822-F857 HydrophobicContact CB-CE1 4.31Å; A822-F857 WeakPolarHBondContact O-CD1 3.31Å; A822-F857 WeakPolarHBondContact O-CE1 3.44Å; V825-F857 HydrophobicContact CB-CB 4.26Å; V825-F857 HydrophobicContact CB-CD1 3.74Å; V825-F857 HydrophobicContact CB-CD2 3.97Å; V825-F857 HydrophobicContact CB-CE1 3.98Å; V825-F857 HydrophobicContact CB-CE2 4.23Å; V825-F857 HydrophobicContact CB-CG 3.73Å; V825-F857 HydrophobicContact CB-CZ 4.24Å; V825-F857 HydrophobicContact CG1-CB 3.66Å; V825-F857 HydrophobicContact CG1-CD1 4.12Å; V825-F857 HydrophobicContact CG1-CD2 3.9Å; V825-F857 HydrophobicContact CG1-CG 3.63Å; V825-F857 HydrophobicContact CG2-CD2 4.45Å; V825-F857 HydrophobicContact CG2-CE2 4.36Å; V825-F857 HydrophobicContact CG2-CZ 4.47Å; D847-F857 HydrophobicContact CB-CE2 3.93Å; D847-F857 HydrophobicContact CB-CZ 3.7Å; D847-F857 WeakPolarHBondContact OD2-CZ 3.33Å; K853-F857 HydrophobicContact CG-CE2 4.34Å; K853-F857 VanDerWaalsContact O-CD2 3.31Å; K853-F857 WeakPolarHBondContact O-CD2 3.25Å; A854-F857 WeakPolarHBondContact O-CB 3.39Å; A854-F857 WeakPolarHBondContact O-CD2 3.3Å; A854-F857 PolarHBondContact O-N 3.19Å; A854-F857 VanDerWaalsContact O-N 3.09Å; F857-I860 HydrophobicContact CB-CG1 4.35Å
858	R	96.1	Very high	93.6	Very high	64 Å²	64	30.6 Å²	30.6	24%	0.242	13%	0.132	C	C	.	.	S	Bend	trans	-88.7	-27	178.6	-71.2	-168.4	62.7	-153.4	-9.3	112.8	H788 L791 P792 S794 I796 T823	H788-R858 PolarHBondContact CE1-NH1 3.19Å; H788-R858 PolarHBondContact O-NH2 3.48Å; H788-R858 VanDerWaalsContact O-NH2 3.12Å; L791-R858 PolarHBondContact O-NH2 2.82Å; P792-R858 PolarHBondContact O-NE 3.44Å; P792-R858 PolarHBondContact O-NH1 3.31Å; P792-R858 PolarHBondContact O-NH2 2.92Å; P792-R858 VanDerWaalsContact O-NH2 3.09Å; S794-R858 PolarHBondContact O-NE 3.11Å; S794-R858 PolarHBondContact O-NH2 3.17Å; S794-R858 VanDerWaalsContact O-NH2 3.08Å; S794-R858 PolarHBondContact OG-NH2 2.86Å; I796-R858 PolarHBondContact N-O 2.98Å; T823-R858 PolarHBondContact O-N 3.29Å
859	I	98.1	Very high	93.8	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	116	175.3	-55.7	175.5	0	0	0	108.2	V784 H788 I796 L819 T823 M824 V825 I861	V784-I859 HydrophobicContact CG1-CD1 4.03Å; V784-I859 HydrophobicContact CG1-CG2 4.28Å; H788-I859 HydrophobicContact CB-CD1 4.24Å; I796-I859 HydrophobicContact CD1-CG1 4.38Å; I796-I859 WeakPolarHBondContact O-CA 3.38Å; L819-I859 HydrophobicContact CD1-CD1 3.82Å; L819-I859 HydrophobicContact CD2-CD1 3.86Å; T823-I859 HydrophobicContact CG2-CD1 4.28Å; T823-I859 PolarHBondContact O-N 2.75Å; M824-I859 CarbonylContact C-O 3.51Å; M824-I859 VanDerWaalsContact CA-O 3.3Å; M824-I859 WeakPolarHBondContact CA-O 3.26Å; M824-I859 HydrophobicContact CB-CB 4.19Å; M824-I859 HydrophobicContact CB-CG2 4.45Å; M824-I859 HydrophobicContact CG-CB 4.22Å; M824-I859 HydrophobicContact CG-CG2 3.97Å; V825-I859 PolarHBondContact N-O 2.95Å; I859-I861 HydrophobicContact CG2-CG1 4.42Å
860	I	98.2	Very high	94.1	Very high	1 Å²	1	28.6 Å²	28.6	1%	0.005	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	125.6	178.5	-55.6	-169.1	0	0	0	108.7	I796 L797 V798 V825 V827 A854 F857 F870 F880	I796-I860 PolarHBondContact O-N 3.2Å; L797-I860 HydrophobicContact CD1-CB 3.99Å; L797-I860 HydrophobicContact CD1-CG2 3.89Å; V798-I860 PolarHBondContact N-O 2.88Å; V825-I860 HydrophobicContact CG1-CB 4.28Å; V825-I860 HydrophobicContact CG1-CG1 3.92Å; V825-I860 HydrophobicContact CG1-CG2 4.24Å; V827-I860 HydrophobicContact CG2-CG2 3.93Å; A854-I860 WeakPolarHBondContact O-CD1 3.24Å; F857-I860 HydrophobicContact CB-CG1 4.35Å; I860-F870 HydrophobicContact CD1-CE1 4.02Å; I860-F870 HydrophobicContact CD1-CE2 4.49Å; I860-F870 HydrophobicContact CD1-CZ 3.69Å; I860-F870 HydrophobicContact CG2-CE2 3.97Å; I860-F870 HydrophobicContact CG2-CZ 3.7Å; I860-F880 HydrophobicContact CD1-CE1 3.66Å; I860-F880 HydrophobicContact CD1-CZ 3.91Å; I860-F880 HydrophobicContact CG1-CE1 4.3Å
861	I	98.1	Very high	94.1	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	122.6	177	-55.7	173.4	0	0	0	109.4	V798 A806 V809 C810 L813 M824 V825 R826 V827 I859	V798-I861 HydrophobicContact CB-CG1 4.33Å; V798-I861 WeakPolarHBondContact O-CA 3.23Å; A806-I861 HydrophobicContact CB-CG2 4.11Å; A806-I861 VanDerWaalsContact O-CG2 3.27Å; A806-I861 WeakPolarHBondContact O-CG2 3.46Å; V809-I861 HydrophobicContact CG1-CD1 4.04Å; V809-I861 HydrophobicContact CG1-CG1 4.49Å; C810-I861 VanDerWaalsContact CA-CD1 3.49Å; C810-I861 HydrophobicContact CB-CD1 3.71Å; L813-I861 HydrophobicContact CD1-CD1 3.77Å; M824-I861 HydrophobicContact CG-CD1 3.96Å; M824-I861 HydrophobicContact CG-CG1 4.44Å; M824-I861 HydrophobicContact SD-CD1 3.46Å; M824-I861 WeakPolarHBondContact SD-CD1 3.46Å; M824-I861 HydrophobicContact SD-CG1 4.48Å; V825-I861 PolarHBondContact O-N 3.38Å; R826-I861 CarbonylContact C-O 3.56Å; R826-I861 WeakPolarHBondContact CA-O 3.37Å; R826-I861 PolarHBondContact NH1-O 3.07Å; V827-I861 PolarHBondContact N-O 2.95Å; I859-I861 HydrophobicContact CG2-CG1 4.42Å
862	T	96.8	Very high	93.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	170.3	-175.6	-173.7	0	0	0	0	111.6	L797 V798 C799 A800 V827 S866	L797-T862 HydrophobicContact CD1-CG2 3.7Å; V798-T862 PolarHBondContact O-N 2.73Å; C799-T862 VanDerWaalsContact CA-O 3.26Å; C799-T862 WeakPolarHBondContact CA-O 3.45Å; C799-T862 VanDerWaalsContact SG-CG2 3.51Å; A800-T862 PolarHBondContact N-O 2.94Å; V827-T862 PolarHBondContact O-OG1 3.46Å; T862-S866 WeakPolarHBondContact OG1-CB 3.46Å
863	T	95.7	Very high	93.7	Very high	8 Å²	8	22.3 Å²	22.3	5%	0.049	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	153.7	164.8	57.2	0	0	0	0	110.5	A800 N803 S865 S866 S867	A800-T863 CarbonylContact O-C 3.48Å; A800-T863 WeakPolarHBondContact O-CA 3.48Å; N803-T863 VanDerWaalsContact OD1-CG2 3.24Å; N803-T863 WeakPolarHBondContact OD1-CG2 3.32Å; T863-S865 VanDerWaalsContact C-N 3.32Å; T863-S865 PolarHBondContact O-N 2.71Å; T863-S866 PolarHBondContact O-N 3.14Å; T863-S866 WeakPolarHBondContact OG1-CB 3.41Å; T863-S866 PolarHBondContact OG1-N 2.98Å; T863-S866 VanDerWaalsContact OG1-N 3.11Å; T863-S866 PolarHBondContact OG1-OG 3.46Å; T863-S867 PolarHBondContact O-N 3.24Å
864	C	96.7	Very high	93.4	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-51.7	-47.8	175.2	-65.4	0	0	0	0	112.2	A800 S867 E895 I898	A800-C864 VanDerWaalsContact C-SG 3.55Å; A800-C864 PolarHBondContact O-N 3.23Å; C864-S867 PolarHBondContact O-N 2.82Å; C864-S867 PolarHBondContact O-OG 2.97Å; C864-E895 HydrophobicContact CB-CG 3.63Å; C864-I898 WeakPolarHBondContact O-CG2 3.19Å
865	S	94	Very high	93.1	Very high	12 Å²	12	22.1 Å²	22.1	8%	0.084	11%	0.112	C	C	.	.	H	α-helix	trans	-61.8	-45.3	174.9	176.3	0	0	0	0	113.1	T639 R642 T863 S867 G868	T639-S865 PolarHBondContact OG1-OG 3.44Å; T639-S865 VanDerWaalsContact OG1-OG 3.1Å; R642-S865 WeakPolarHBondContact CD-O 3.3Å; R642-S865 PolarHBondContact NH1-O 2.68Å; R642-S865 PolarHBondContact NH1-OG 2.83Å; T863-S865 VanDerWaalsContact C-N 3.32Å; T863-S865 PolarHBondContact O-N 2.71Å; S865-S867 VanDerWaalsContact C-N 3.3Å; S865-S867 PolarHBondContact O-N 3.09Å; S865-G868 PolarHBondContact O-N 2.86Å
866	S	93.2	Very high	92.9	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.014	15%	0.147	C	C	.	.	H	α-helix	trans	-71.6	-18.7	-177.4	-56.5	0	0	0	0	114.3	A829 T862 T863 G868 L869	A829-S866 WeakPolarHBondContact CB-OG 3.2Å; T862-S866 WeakPolarHBondContact OG1-CB 3.46Å; T863-S866 PolarHBondContact O-N 3.14Å; T863-S866 WeakPolarHBondContact OG1-CB 3.41Å; T863-S866 PolarHBondContact OG1-N 2.98Å; T863-S866 VanDerWaalsContact OG1-N 3.11Å; T863-S866 PolarHBondContact OG1-OG 3.46Å; S866-G868 PolarHBondContact O-N 3.43Å; S866-L869 VanDerWaalsContact O-CB 3.28Å; S866-L869 WeakPolarHBondContact O-CB 3.36Å; S866-L869 WeakPolarHBondContact O-CD1 3.45Å; S866-L869 WeakPolarHBondContact O-CG 3.44Å; S866-L869 PolarHBondContact O-N 3.09Å
867	S	95.4	Very high	92.7	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.1	-24.3	171.2	75.5	0	0	0	0	111.9	T863 C864 S865 L869 F870 I898	T863-S867 PolarHBondContact O-N 3.24Å; C864-S867 PolarHBondContact O-N 2.82Å; C864-S867 PolarHBondContact O-OG 2.97Å; S865-S867 VanDerWaalsContact C-N 3.3Å; S865-S867 PolarHBondContact O-N 3.09Å; S867-L869 PolarHBondContact O-N 3.01Å; S867-F870 WeakPolarHBondContact O-CB 3.5Å; S867-F870 VanDerWaalsContact O-CD2 3.24Å; S867-F870 WeakPolarHBondContact O-CD2 3.32Å; S867-F870 PolarHBondContact O-N 2.68Å; S867-I898 VanDerWaalsContact OG-CG2 3.29Å; S867-I898 WeakPolarHBondContact OG-CG2 3.21Å
868	G	92.8	Very high	92.4	Very high	2 Å²	2	26.5 Å²	26.5	2%	0.021	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-11.1	174.2	0	0	0	0	0	114.7	S865 S866 F870 Y871	S865-G868 PolarHBondContact O-N 2.86Å; S866-G868 PolarHBondContact O-N 3.43Å; G868-F870 PolarHBondContact O-N 3.41Å; G868-Y871 PolarHBondContact O-N 3.38Å
869	L	91.1	Very high	92.4	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.016	14%	0.142	C	C	.	.	H	α-helix	trans	-63	-28.1	169.1	-67.2	169.7	0	0	0	112.4	L491 V827 I851 S866 S867 Y871 Q872	L491-L869 HydrophobicContact CD1-CD2 3.85Å; V827-L869 HydrophobicContact CG1-CD1 4.08Å; I851-L869 HydrophobicContact CD1-CB 4.33Å; I851-L869 HydrophobicContact CD1-CD1 3.89Å; I851-L869 HydrophobicContact CG1-CB 4.31Å; I851-L869 HydrophobicContact CG1-CD1 4.44Å; I851-L869 HydrophobicContact CG2-CB 4.38Å; S866-L869 VanDerWaalsContact O-CB 3.28Å; S866-L869 WeakPolarHBondContact O-CB 3.36Å; S866-L869 WeakPolarHBondContact O-CD1 3.45Å; S866-L869 WeakPolarHBondContact O-CG 3.44Å; S866-L869 PolarHBondContact O-N 3.09Å; S867-L869 PolarHBondContact O-N 3.01Å; L869-Y871 VanDerWaalsContact C-N 3.32Å; L869-Y871 PolarHBondContact O-N 3.05Å; L869-Q872 WeakPolarHBondContact O-CB 3.45Å; L869-Q872 PolarHBondContact O-N 3.45Å; L869-Q872 VanDerWaalsContact O-N 3.13Å
870	F	92.7	Very high	92.3	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-70.2	-28.1	179.3	-67.3	-65.1	0	0	0	113	L797 V827 I851 I860 S867 G868 Q872 I873 G874 V875 F880 L902	L797-F870 HydrophobicContact CD1-CE2 4.24Å; V827-F870 HydrophobicContact CG2-CZ 4.26Å; I851-F870 HydrophobicContact CG2-CD1 3.84Å; I851-F870 HydrophobicContact CG2-CE1 3.81Å; I860-F870 HydrophobicContact CD1-CE1 4.02Å; I860-F870 HydrophobicContact CD1-CE2 4.49Å; I860-F870 HydrophobicContact CD1-CZ 3.69Å; I860-F870 HydrophobicContact CG2-CE2 3.97Å; I860-F870 HydrophobicContact CG2-CZ 3.7Å; S867-F870 WeakPolarHBondContact O-CB 3.5Å; S867-F870 VanDerWaalsContact O-CD2 3.24Å; S867-F870 WeakPolarHBondContact O-CD2 3.32Å; S867-F870 PolarHBondContact O-N 2.68Å; G868-F870 PolarHBondContact O-N 3.41Å; F870-Q872 VanDerWaalsContact C-N 3.28Å; F870-Q872 PolarHBondContact O-N 2.92Å; F870-I873 HydrophobicContact CD1-CD1 4.26Å; F870-I873 WeakPolarHBondContact O-CG1 3.34Å; F870-G874 PolarHBondContact O-N 3.32Å; F870-V875 HydrophobicContact CB-CB 4.34Å; F870-V875 HydrophobicContact CB-CG2 4.03Å; F870-V875 HydrophobicContact CD1-CG2 4.07Å; F870-V875 PolarHBondContact O-N 2.89Å; F870-F880 HydrophobicContact CB-CE2 4.47Å; F870-F880 HydrophobicContact CD1-CZ 4.29Å; F870-F880 HydrophobicContact CD2-CE2 4.24Å; F870-F880 HydrophobicContact CD2-CZ 4.1Å; F870-F880 HydrophobicContact CE1-CZ 4.39Å; F870-F880 HydrophobicContact CE2-CZ 4.21Å; F870-F880 HydrophobicContact CG-CE2 4.2Å; F870-F880 HydrophobicContact CG-CZ 4.17Å; F870-F880 HydrophobicContact CZ-CZ 4.37Å; F870-L902 HydrophobicContact CB-CD1 4Å; F870-L902 HydrophobicContact CB-CD2 4.1Å; F870-L902 HydrophobicContact CD2-CD1 4.28Å
871	Y	89.2	Confident	92.2	Very high	29 Å²	29	27.4 Å²	27.4	11%	0.114	15%	0.152	C	C	.	.	H	α-helix	trans	-63.1	-36.7	169.6	-65.4	-62.7	0	0	0	111.9	F645 H649 G868 L869 I873 G874 I898 G901 L902	F645-Y871 HydrophobicContact CD1-CD1 4.29Å; F645-Y871 AromaticContact CD1-CD2 3.81Å; F645-Y871 HydrophobicContact CD1-CD2 3.81Å; F645-Y871 HydrophobicContact CD1-CE2 4.27Å; F645-Y871 AromaticContact CD1-CG 3.86Å; F645-Y871 HydrophobicContact CD1-CG 3.86Å; F645-Y871 AromaticContact CE1-CD1 3.6Å; F645-Y871 HydrophobicContact CE1-CD1 3.6Å; F645-Y871 AromaticContact CE1-CD2 3.87Å; F645-Y871 HydrophobicContact CE1-CD2 3.87Å; F645-Y871 HydrophobicContact CE1-CE1 4.22Å; F645-Y871 AromaticContact CE1-CG 3.4Å; F645-Y871 HydrophobicContact CE1-CG 3.4Å; F645-Y871 VanDerWaalsContact CE1-CG 3.4Å; H649-Y871 HydrophobicContact CB-CE1 4.47Å; G868-Y871 PolarHBondContact O-N 3.38Å; L869-Y871 VanDerWaalsContact C-N 3.32Å; L869-Y871 PolarHBondContact O-N 3.05Å; Y871-I873 VanDerWaalsContact C-N 3.33Å; Y871-I873 PolarHBondContact O-N 3.05Å; Y871-G874 PolarHBondContact O-N 3.07Å; Y871-I898 HydrophobicContact CE2-CG2 4.01Å; Y871-I898 WeakPolarHBondContact CE2-O 2.88Å; Y871-I898 PolarHBondContact OH-O 2.99Å; Y871-G901 WeakPolarHBondContact OH-CA 3.47Å; Y871-L902 HydrophobicContact CD1-CD2 3.57Å; Y871-L902 HydrophobicContact CD2-CD2 4.39Å; Y871-L902 HydrophobicContact CE1-CD2 3.35Å; Y871-L902 HydrophobicContact CE1-CG 3.97Å; Y871-L902 HydrophobicContact CE2-CD2 4.16Å; Y871-L902 HydrophobicContact CE2-CG 4.28Å; Y871-L902 HydrophobicContact CG-CD2 4.09Å; Y871-L902 PolarHBondContact OH-N 2.84Å
872	Q	84.5	Confident	92.2	Very high	27 Å²	27	27.5 Å²	27.5	13%	0.126	15%	0.152	C	C	.	.	H	α-helix	trans	-70.4	-28	-176	-61.8	-179	-31.2	0	0	113.3	L869 F870 G874	L869-Q872 WeakPolarHBondContact O-CB 3.45Å; L869-Q872 PolarHBondContact O-N 3.45Å; L869-Q872 VanDerWaalsContact O-N 3.13Å; F870-Q872 VanDerWaalsContact C-N 3.28Å; F870-Q872 PolarHBondContact O-N 2.92Å; Q872-G874 VanDerWaalsContact C-N 3.29Å
873	I	86.2	Confident	92.3	Very high	11 Å²	11	27.5 Å²	27.5	6%	0.056	15%	0.152	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.1	4.2	171.8	66.3	156	0	0	0	112.7	L491 I851 W852 F870 Y871 V875	L491-I873 HydrophobicContact CD2-CG2 3.32Å; I851-I873 HydrophobicContact CB-CG2 4.09Å; I851-I873 HydrophobicContact CG2-CD1 3.87Å; I851-I873 HydrophobicContact CG2-CG1 4.09Å; I851-I873 HydrophobicContact CG2-CG2 3.88Å; W852-I873 HydrophobicContact CD2-CB 4.03Å; W852-I873 HydrophobicContact CD2-CD1 4.31Å; W852-I873 HydrophobicContact CD2-CG2 4.04Å; W852-I873 HydrophobicContact CE3-CB 4.09Å; W852-I873 HydrophobicContact CE3-CD1 3.97Å; W852-I873 HydrophobicContact CG-CG2 4.43Å; W852-I873 HydrophobicContact CH2-CB 3.74Å; W852-I873 WeakPolarHBondContact CH2-O 3.43Å; W852-I873 HydrophobicContact CZ2-CB 3.65Å; W852-I873 HydrophobicContact CZ2-CG2 3.95Å; W852-I873 HydrophobicContact CZ3-CB 3.95Å; W852-I873 HydrophobicContact CZ3-CD1 4.29Å; W852-I873 WeakPolarHBondContact CZ3-O 3.44Å; F870-I873 HydrophobicContact CD1-CD1 4.26Å; F870-I873 WeakPolarHBondContact O-CG1 3.34Å; Y871-I873 VanDerWaalsContact C-N 3.33Å; Y871-I873 PolarHBondContact O-N 3.05Å; I873-V875 HydrophobicContact CD1-CG2 3.45Å; I873-V875 VanDerWaalsContact CD1-CG2 3.45Å; I873-V875 HydrophobicContact CG1-CG2 3.59Å; I873-V875 PolarHBondContact O-N 2.56Å
874	G	85.8	Confident	92.4	Very high	57 Å²	57	27.2 Å²	27.2	59%	0.588	15%	0.15	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.7	34.1	178.3	0	0	0	0	0	114.1	F870 Y871 Q872 R876	F870-G874 PolarHBondContact O-N 3.32Å; Y871-G874 PolarHBondContact O-N 3.07Å; Q872-G874 VanDerWaalsContact C-N 3.29Å; G874-R876 PolarHBondContact O-N 2.85Å
875	V	88.5	Confident	92.5	Very high	23 Å²	23	27.3 Å²	27.3	14%	0.139	15%	0.15	C	C	.	.	P	Polyproline II helix	trans	-57.7	128.6	170.2	176.5	0	0	0	0	108.9	F870 I873 H879 F880	F870-V875 HydrophobicContact CB-CB 4.34Å; F870-V875 HydrophobicContact CB-CG2 4.03Å; F870-V875 HydrophobicContact CD1-CG2 4.07Å; F870-V875 PolarHBondContact O-N 2.89Å; I873-V875 HydrophobicContact CD1-CG2 3.45Å; I873-V875 VanDerWaalsContact CD1-CG2 3.45Å; I873-V875 HydrophobicContact CG1-CG2 3.59Å; I873-V875 PolarHBondContact O-N 2.56Å; V875-H879 HydrophobicContact CG1-CB 3.16Å; V875-F880 HydrophobicContact CG1-CE2 4.42Å
876	R	87.8	Confident	92.7	Very high	217 Å²	217	26.8 Å²	26.8	82%	0.819	15%	0.147	S	C	*	.	P	Polyproline II helix	trans	-68.2	144.6	178.1	-63.5	-178.4	-177.5	179.9	-0.3	110.6	G874 G878 H879	G874-R876 PolarHBondContact O-N 2.85Å; R876-G878 PolarHBondContact O-N 2.96Å; R876-H879 VanDerWaalsContact O-CB 3.25Å; R876-H879 WeakPolarHBondContact O-CB 3.31Å; R876-H879 PolarHBondContact O-N 2.94Å
877	V	89.7	Confident	92.8	Very high	74 Å²	74	28 Å²	28	45%	0.448	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	132.9	168.1	177.2	0	0	0	0	109.2	H652 M903	H652-V877 WeakPolarHBondContact NE2-CG1 3.38Å; V877-M903 WeakPolarHBondContact CG1-O 3.38Å
878	G	90.8	Very high	92.9	Very high	26 Å²	26	28 Å²	28	27%	0.268	15%	0.152	S	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	0.6	-175.9	0	0	0	0	0	115	R876 F880 L902	R876-G878 PolarHBondContact O-N 2.96Å; G878-F880 CarbonylContact C-O 3.58Å; G878-F880 PolarHBondContact O-N 3.39Å; G878-L902 PolarHBondContact N-O 2.92Å
879	H	94.4	Very high	93	Very high	50 Å²	50	28.1 Å²	28.1	23%	0.231	15%	0.153	C	C	.	.	S	Bend	trans	-58.7	-38.5	167.2	178.4	85.3	0	0	0	111.7	R795 S855 V875 R876	R795-H879 WeakPolarHBondContact CB-O 3.44Å; R795-H879 WeakPolarHBondContact CD-O 3.44Å; S855-H879 PolarHBondContact O-CE1 3.1Å; S855-H879 PolarHBondContact O-NE2 3.08Å; V875-H879 HydrophobicContact CG1-CB 3.16Å; R876-H879 VanDerWaalsContact O-CB 3.25Å; R876-H879 WeakPolarHBondContact O-CB 3.31Å; R876-H879 PolarHBondContact O-N 2.94Å
880	F	96.9	Very high	93.1	Very high	2 Å²	2	30 Å²	30	1%	0.009	16%	0.162	C	C	.	.	B	Isolated β-bridge	trans	-90.4	134.3	169.5	-59.8	-71.2	0	0	0	109.1	R795 L797 I860 F870 V875 G878 L902 M903	R795-F880 HydrophobicContact CB-CD1 4.47Å; L797-F880 HydrophobicContact CB-CB 4.4Å; L797-F880 HydrophobicContact CB-CD1 3.64Å; L797-F880 HydrophobicContact CB-CD2 4.5Å; L797-F880 HydrophobicContact CB-CE1 3.97Å; L797-F880 HydrophobicContact CB-CG 3.92Å; L797-F880 HydrophobicContact CD1-CE1 4.4Å; L797-F880 HydrophobicContact CD1-CZ 4.41Å; L797-F880 HydrophobicContact CD2-CD2 4.03Å; L797-F880 HydrophobicContact CD2-CE2 4.06Å; L797-F880 HydrophobicContact CD2-CG 4.28Å; L797-F880 HydrophobicContact CD2-CZ 4.33Å; I860-F880 HydrophobicContact CD1-CE1 3.66Å; I860-F880 HydrophobicContact CD1-CZ 3.91Å; I860-F880 HydrophobicContact CG1-CE1 4.3Å; F870-F880 HydrophobicContact CB-CE2 4.47Å; F870-F880 HydrophobicContact CD1-CZ 4.29Å; F870-F880 HydrophobicContact CD2-CE2 4.24Å; F870-F880 HydrophobicContact CD2-CZ 4.1Å; F870-F880 HydrophobicContact CE1-CZ 4.39Å; F870-F880 HydrophobicContact CE2-CZ 4.21Å; F870-F880 HydrophobicContact CG-CE2 4.2Å; F870-F880 HydrophobicContact CG-CZ 4.17Å; F870-F880 HydrophobicContact CZ-CZ 4.37Å; V875-F880 HydrophobicContact CG1-CE2 4.42Å; G878-F880 CarbonylContact C-O 3.58Å; G878-F880 PolarHBondContact O-N 3.39Å; F880-L902 HydrophobicContact CD2-CB 3.82Å; F880-L902 HydrophobicContact CD2-CD1 4.26Å; F880-L902 HydrophobicContact CE2-CB 4.3Å; F880-L902 HydrophobicContact CE2-CD1 3.99Å; F880-M903 HydrophobicContact CB-SD 3.5Å; F880-M903 VanDerWaalsContact CB-SD 3.5Å
881	T	96.7	Very high	93.3	Very high	32 Å²	32	30 Å²	30	20%	0.196	16%	0.162	C	C	.	.	S	Bend	trans	-101.9	-22.3	177.8	57	0	0	0	0	112.2	S794 R795 M903 Q909	S794-T881 WeakPolarHBondContact CA-OG1 3.24Å; R795-T881 PolarHBondContact N-OG1 3.32Å; R795-T881 PolarHBondContact O-N 3.36Å; R795-T881 PolarHBondContact O-OG1 3.45Å; T881-M903 WeakPolarHBondContact O-CE 3.44Å; T881-Q909 PolarHBondContact O-N 3.48Å
882	H	98	Very high	93.6	Very high	3 Å²	3	29.2 Å²	29.2	1%	0.014	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	128.5	176.9	-55.2	70.5	0	0	0	109.6	Q669 V787 R795 I796 L797 F884 Q909	Q669-H882 PolarHBondContact NE2-NE2 2.74Å; V787-H882 HydrophobicContact CG1-CB 4.48Å; R795-H882 PolarHBondContact O-N 2.81Å; I796-H882 WeakPolarHBondContact CA-O 3.45Å; I796-H882 HydrophobicContact CG1-CB 4.38Å; I796-H882 HydrophobicContact CG2-CB 4.46Å; L797-H882 PolarHBondContact N-O 3.38Å; H882-F884 HydrophobicContact CB-CE2 4Å; H882-Q909 WeakPolarHBondContact CA-O 3.27Å; H882-Q909 PolarHBondContact CD2-OE1 2.86Å; H882-Q909 PolarHBondContact NE2-OE1 3.23Å
883	V	98.1	Very high	94.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	124.2	170.2	164.1	0	0	0	0	109.9	L797 V885 P899 L900 M903 Q909 V911	L797-V883 HydrophobicContact CB-CG2 3.88Å; L797-V883 HydrophobicContact CD2-CG2 4Å; L797-V883 HydrophobicContact CG-CG2 4.26Å; L797-V883 CarbonylContact O-C 3.58Å; L797-V883 VanDerWaalsContact O-CA 3.31Å; L797-V883 WeakPolarHBondContact O-CA 3.44Å; V883-V885 HydrophobicContact CG1-CG2 3.97Å; V883-P899 HydrophobicContact CG1-CB 4.15Å; V883-L900 HydrophobicContact CG1-CD1 3.76Å; V883-M903 HydrophobicContact CB-CG 3.9Å; V883-M903 HydrophobicContact CB-SD 4.01Å; V883-M903 HydrophobicContact CG2-CG 3.36Å; V883-M903 HydrophobicContact CG2-SD 3.34Å; V883-M903 WeakPolarHBondContact CG2-SD 3.24Å; V883-Q909 PolarHBondContact N-O 3.24Å; V883-V911 PolarHBondContact O-N 3.41Å
884	F	98.6	Very high	94.8	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	130.4	171.1	-69	-102.3	0	0	0	108.5	I756 I780 A783 V784 V787 I796 L797 V798 C799 H882 V911	I756-F884 HydrophobicContact CD1-CE1 4.4Å; I756-F884 HydrophobicContact CG2-CE1 4.13Å; I756-F884 HydrophobicContact CG2-CZ 3.89Å; I780-F884 HydrophobicContact CG2-CD1 4.21Å; A783-F884 HydrophobicContact CB-CE1 3.95Å; A783-F884 HydrophobicContact CB-CZ 4.3Å; V784-F884 HydrophobicContact CG2-CD1 4.39Å; V784-F884 HydrophobicContact CG2-CD2 4.14Å; V784-F884 HydrophobicContact CG2-CE1 4.36Å; V784-F884 HydrophobicContact CG2-CE2 4.1Å; V784-F884 HydrophobicContact CG2-CG 4.29Å; V784-F884 HydrophobicContact CG2-CZ 4.22Å; V787-F884 HydrophobicContact CG2-CZ 4.5Å; I796-F884 HydrophobicContact CG2-CD2 3.69Å; I796-F884 HydrophobicContact CG2-CE2 3.79Å; L797-F884 PolarHBondContact O-N 3.09Å; V798-F884 CarbonylContact C-O 3.59Å; V798-F884 WeakPolarHBondContact CA-O 3.32Å; V798-F884 HydrophobicContact CB-CB 4.42Å; V798-F884 HydrophobicContact CG1-CB 4.03Å; V798-F884 HydrophobicContact CG2-CB 4.25Å; C799-F884 PolarHBondContact N-O 3.17Å; H882-F884 HydrophobicContact CB-CE2 4Å; F884-V911 CarbonylContact C-O 3.58Å; F884-V911 WeakPolarHBondContact CA-O 3.44Å; F884-V911 HydrophobicContact CD1-CB 3.58Å; F884-V911 HydrophobicContact CD1-CG1 3.68Å; F884-V911 HydrophobicContact CD1-CG2 4.07Å; F884-V911 HydrophobicContact CE1-CB 3.79Å; F884-V911 HydrophobicContact CE1-CG1 3.86Å; F884-V911 HydrophobicContact CE1-CG2 3.76Å; F884-V911 HydrophobicContact CG-CB 4.16Å; F884-V911 HydrophobicContact CZ-CG2 4.11Å
885	V	98.3	Very high	95.4	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.006	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	106.2	170.8	-173.9	0	0	0	0	108	C799 V883 A888 P899 L900 V911 L912 A913	C799-V885 HydrophobicContact CB-CG2 4.49Å; C799-V885 CarbonylContact O-C 3.44Å; C799-V885 WeakPolarHBondContact O-CA 3.47Å; V883-V885 HydrophobicContact CG1-CG2 3.97Å; V885-A888 HydrophobicContact CB-CB 4.25Å; V885-A888 HydrophobicContact CG1-CB 3.87Å; V885-P899 HydrophobicContact CG2-CG 4.25Å; V885-L900 HydrophobicContact CG2-CD1 3.82Å; V885-V911 PolarHBondContact N-O 3.35Å; V885-L912 HydrophobicContact CB-CD2 3.82Å; V885-L912 HydrophobicContact CG2-CD2 3.88Å; V885-A913 PolarHBondContact O-N 3.05Å
886	D	97.3	Very high	95.8	Very high	2 Å²	2	25.3 Å²	25.3	1%	0.011	13%	0.126	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.6	151.9	170.9	-162.8	12.3	0	0	0	110.3	I780 C799 A800 P801 A888 A913	I780-D886 HydrophobicContact CD1-CB 3.8Å; I780-D886 WeakPolarHBondContact CD1-OD1 3.46Å; C799-D886 PolarHBondContact O-N 3.06Å; A800-D886 HydrophobicContact CB-CB 4.45Å; P801-D886 WeakPolarHBondContact CD-O 3.14Å; D886-A888 PolarHBondContact O-N 2.94Å; D886-A913 CarbonylContact C-O 3.09Å
887	E	95.7	Very high	96.3	Very high	27 Å²	27	15 Å²	15	13%	0.126	9%	0.087	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	38.5	-172.7	-61.8	-63.8	153.2	0	0	112.8	K776 P801 A805 G889 Q890 A913	K776-E887 WeakPolarHBondContact CE-OE1 3.4Å; K776-E887 IonicContact NZ-OE1 3.29Å; P801-E887 HydrophobicContact CG-CB 4.14Å; A805-E887 HydrophobicContact CB-CG 4.35Å; E887-G889 PolarHBondContact O-N 3Å; E887-G889 VanDerWaalsContact O-N 3.08Å; E887-Q890 WeakPolarHBondContact O-CB 3.14Å; E887-Q890 PolarHBondContact O-N 3.34Å; E887-A913 PolarHBondContact N-O 2.89Å
888	A	97.3	Very high	96.6	Very high	0 Å²	0	11.4 Å²	11.4	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-22.9	-177.4	0	0	0	0	0	113.7	V885 D886 Q890 L912 A913 L938	V885-A888 HydrophobicContact CB-CB 4.25Å; V885-A888 HydrophobicContact CG1-CB 3.87Å; D886-A888 PolarHBondContact O-N 2.94Å; A888-Q890 VanDerWaalsContact C-N 3.25Å; A888-Q890 PolarHBondContact O-N 2.96Å; A888-L912 HydrophobicContact CB-CB 4.1Å; A888-L912 HydrophobicContact CB-CD2 4.43Å; A888-A913 WeakPolarHBondContact CB-O 3.49Å; A888-A913 PolarHBondContact N-O 3.43Å; A888-L938 HydrophobicContact CB-CB 4.24Å
889	G	95.2	Very high	96.9	Very high	4 Å²	4	10.2 Å²	10.2	4%	0.041	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-23	173.8	0	0	0	0	0	113.7	E887 G920 S936	E887-G889 PolarHBondContact O-N 3Å; E887-G889 VanDerWaalsContact O-N 3.08Å; G889-G920 WeakPolarHBondContact O-CA 3.34Å; G889-S936 VanDerWaalsContact O-CB 3.25Å; G889-S936 WeakPolarHBondContact O-CB 3.2Å; G889-S936 PolarHBondContact O-OG 3.45Å
890	Q	93.8	Very high	97	Very high	42 Å²	42	7.8 Å²	7.8	20%	0.196	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-24.5	179.8	-174.1	-177.9	22.6	0	0	112.5	P801 E887 A888 P921	P801-Q890 HydrophobicContact CG-CB 3.97Å; P801-Q890 HydrophobicContact CG-CG 4.27Å; E887-Q890 WeakPolarHBondContact O-CB 3.14Å; E887-Q890 PolarHBondContact O-N 3.34Å; A888-Q890 VanDerWaalsContact C-N 3.25Å; A888-Q890 PolarHBondContact O-N 2.96Å; Q890-P921 VanDerWaalsContact O-CA 3.26Å; Q890-P921 WeakPolarHBondContact O-CA 3.17Å
891	A	95.8	Very high	96.8	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.041	C	C	.	.	S	Bend	trans	-73.3	134.3	178.2	0	0	0	0	0	110.8	P801 C896 P921 S936	P801-A891 HydrophobicContact CB-CB 4.07Å; P801-A891 HydrophobicContact CG-CB 4.32Å; A891-C896 HydrophobicContact CB-CB 4.13Å; A891-P921 WeakPolarHBondContact O-CG 3.04Å; A891-S936 WeakPolarHBondContact O-CB 3.46Å
892	S	97.2	Very high	96.7	Very high	14 Å²	14	6.2 Å²	6.2	10%	0.098	3%	0.032	C	C	.	.	B	Isolated β-bridge	trans	-59.8	151.5	168.3	68.7	0	0	0	0	109.6	E895 C896 P921	S892-E895 PolarHBondContact O-N 3.47Å; S892-E895 VanDerWaalsContact O-N 3.12Å; S892-E895 WeakPolarHBondContact OG-CB 3.44Å; S892-E895 PolarHBondContact OG-N 3.03Å; S892-C896 PolarHBondContact O-N 3.41Å; S892-P921 VanDerWaalsContact CA-CG 3.46Å
893	E	97.8	Very high	96.5	Very high	3 Å²	3	6.1 Å²	6.1	1%	0.014	3%	0.031	C	C	.	.	H	α-helix	trans	-53.4	-53.9	179.8	173.7	160.7	-178.7	0	0	111.7	Y530 F534 E895 C896 L897 F937 R940	Y530-E893 VanDerWaalsContact CE2-OE1 3.25Å; Y530-E893 WeakPolarHBondContact CE2-OE1 3.03Å; Y530-E893 PolarHBondContact OH-OE1 2.86Å; F534-E893 HydrophobicContact CE1-CB 4.08Å; F534-E893 HydrophobicContact CE1-CG 4.27Å; F534-E893 HydrophobicContact CE2-CG 4.23Å; F534-E893 HydrophobicContact CZ-CB 4.09Å; F534-E893 HydrophobicContact CZ-CG 3.85Å; F534-E893 WeakPolarHBondContact CZ-OE2 3.26Å; E893-E895 VanDerWaalsContact C-N 3.26Å; E893-E895 PolarHBondContact O-N 3.21Å; E893-E895 VanDerWaalsContact O-N 3.17Å; E893-C896 WeakPolarHBondContact O-CB 3.43Å; E893-C896 PolarHBondContact O-N 2.83Å; E893-L897 HydrophobicContact CG-CD1 4.41Å; E893-L897 VanDerWaalsContact O-CG 3.3Å; E893-L897 WeakPolarHBondContact O-CG 3.32Å; E893-L897 PolarHBondContact O-N 2.87Å; E893-L897 VanDerWaalsContact O-N 3.11Å; E893-F937 HydrophobicContact CB-CB 4.13Å; E893-F937 HydrophobicContact CG-CB 4.01Å; E893-F937 HydrophobicContact CG-CD2 3.93Å; E893-F937 HydrophobicContact CG-CG 4.38Å; E893-F937 WeakPolarHBondContact OE1-CD2 3.35Å; E893-R940 IonicContact OE1-CZ 3.79Å; E893-R940 VanDerWaalsContact OE1-CZ 3.23Å; E893-R940 IonicContact OE1-NE 3.11Å; E893-R940 PolarHBondContact OE1-NE 3.33Å; E893-R940 IonicContact OE1-NH2 3.13Å; E893-R940 PolarHBondContact OE1-NH2 3.47Å; E893-R940 VanDerWaalsContact OE2-CD 3.26Å; E893-R940 WeakPolarHBondContact OE2-CD 3.4Å; E893-R940 IonicContact OE2-CZ 3.21Å; E893-R940 IonicContact OE2-NE 2.76Å; E893-R940 PolarHBondContact OE2-NE 2.84Å
894	P	98	Very high	96.2	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-58	-33.5	177.9	-26	36.4	0	0	0	114.8	F534 L538 C643 L647 L897 L933	F534-P894 HydrophobicContact CB-CG 4.05Å; F534-P894 HydrophobicContact CD1-CG 3.69Å; F534-P894 HydrophobicContact CE1-CG 4.42Å; F534-P894 HydrophobicContact CG-CG 4.04Å; L538-P894 HydrophobicContact CD1-CB 4.11Å; L538-P894 HydrophobicContact CD1-CG 4.37Å; L538-P894 HydrophobicContact CD2-CB 4.24Å; L538-P894 HydrophobicContact CD2-CG 4.28Å; L538-P894 HydrophobicContact CG-CB 4.49Å; L538-P894 HydrophobicContact CG-CG 4.37Å; C643-P894 HydrophobicContact CB-CB 3.76Å; L647-P894 HydrophobicContact CD1-CB 4.37Å; L647-P894 HydrophobicContact CD1-CG 4.49Å; L647-P894 HydrophobicContact CD2-CB 4.43Å; L647-P894 HydrophobicContact CD2-CG 4.47Å; L647-P894 HydrophobicContact CG-CB 4.37Å; P894-L897 PolarHBondContact O-N 2.86Å; P894-L933 HydrophobicContact CG-CD1 4.15Å
895	E	97.5	Very high	95.6	Very high	32 Å²	32	10 Å²	10	15%	0.15	5%	0.054	C	C	.	.	H	α-helix	trans	-70.2	-41.1	176.3	177.9	177.4	-150.2	0	0	112	C864 S892 E893 L897 I898	C864-E895 HydrophobicContact CB-CG 3.63Å; S892-E895 PolarHBondContact O-N 3.47Å; S892-E895 VanDerWaalsContact O-N 3.12Å; S892-E895 WeakPolarHBondContact OG-CB 3.44Å; S892-E895 PolarHBondContact OG-N 3.03Å; E893-E895 VanDerWaalsContact C-N 3.26Å; E893-E895 PolarHBondContact O-N 3.21Å; E893-E895 VanDerWaalsContact O-N 3.17Å; E895-L897 PolarHBondContact O-N 3.44Å; E895-I898 HydrophobicContact CG-CD1 4.48Å; E895-I898 WeakPolarHBondContact O-CG1 3.4Å; E895-I898 PolarHBondContact O-N 2.77Å
896	C	97.6	Very high	95	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.4	-28.7	174.8	-169	0	0	0	0	111.6	A891 S892 E893 I898 P899 L900 F937	A891-C896 HydrophobicContact CB-CB 4.13Å; S892-C896 PolarHBondContact O-N 3.41Å; E893-C896 WeakPolarHBondContact O-CB 3.43Å; E893-C896 PolarHBondContact O-N 2.83Å; C896-I898 VanDerWaalsContact C-N 3.34Å; C896-P899 WeakPolarHBondContact O-CD 3.39Å; C896-P899 WeakPolarHBondContact O-CG 3.17Å; C896-L900 WeakPolarHBondContact O-CD1 3.27Å; C896-F937 HydrophobicContact CB-CB 4.05Å
897	L	97	Very high	94.5	Very high	0 Å²	0	19.1 Å²	19.1	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-74.2	-21.5	179.4	-57.8	173.9	0	0	0	113.8	Y530 A646 L647 V650 L658 E893 P894 E895 L900 G901 F937	Y530-L897 HydrophobicContact CE1-CD1 3.75Å; Y530-L897 WeakPolarHBondContact OH-CD1 3.48Å; A646-L897 HydrophobicContact CB-CB 4.36Å; L647-L897 HydrophobicContact CD2-CD1 3.76Å; V650-L897 HydrophobicContact CG1-CD1 4.04Å; V650-L897 HydrophobicContact CG2-CB 4.26Å; V650-L897 HydrophobicContact CG2-CD2 4.12Å; V650-L897 HydrophobicContact CG2-CG 4.48Å; L658-L897 HydrophobicContact CD2-CD2 3.89Å; E893-L897 HydrophobicContact CG-CD1 4.41Å; E893-L897 VanDerWaalsContact O-CG 3.3Å; E893-L897 WeakPolarHBondContact O-CG 3.32Å; E893-L897 PolarHBondContact O-N 2.87Å; E893-L897 VanDerWaalsContact O-N 3.11Å; P894-L897 PolarHBondContact O-N 2.86Å; E895-L897 PolarHBondContact O-N 3.44Å; L897-L900 HydrophobicContact CD2-CD2 4.33Å; L897-L900 PolarHBondContact O-N 2.84Å; L897-L900 VanDerWaalsContact O-N 3.17Å; L897-G901 PolarHBondContact O-N 3.49Å; L897-F937 HydrophobicContact CD2-CD2 4.37Å; L897-F937 HydrophobicContact CD2-CE2 4.25Å; L897-F937 HydrophobicContact CD2-CZ 4.44Å
898	I	96.7	Very high	94.3	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-54.4	-54.5	-178.3	-55.4	170.8	0	0	0	111.3	R642 A646 C864 S867 Y871 E895 C896	R642-I898 HydrophobicContact CB-CD1 3.99Å; A646-I898 HydrophobicContact CB-CB 4.24Å; A646-I898 HydrophobicContact CB-CG1 3.77Å; C864-I898 WeakPolarHBondContact O-CG2 3.19Å; S867-I898 VanDerWaalsContact OG-CG2 3.29Å; S867-I898 WeakPolarHBondContact OG-CG2 3.21Å; Y871-I898 HydrophobicContact CE2-CG2 4.01Å; Y871-I898 WeakPolarHBondContact CE2-O 2.88Å; Y871-I898 PolarHBondContact OH-O 2.99Å; E895-I898 HydrophobicContact CG-CD1 4.48Å; E895-I898 WeakPolarHBondContact O-CG1 3.4Å; E895-I898 PolarHBondContact O-N 2.77Å; C896-I898 VanDerWaalsContact C-N 3.34Å
899	P	97	Very high	94.3	Very high	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-70.9	-32.2	175.6	28.3	-36	0	0	0	113.8	L797 C799 V883 V885 C896 G901 L902	L797-P899 HydrophobicContact CD2-CB 3.94Å; C799-P899 HydrophobicContact CB-CB 4.25Å; C799-P899 HydrophobicContact CB-CG 4.09Å; C799-P899 WeakPolarHBondContact SG-CB 3.36Å; V883-P899 HydrophobicContact CG1-CB 4.15Å; V885-P899 HydrophobicContact CG2-CG 4.25Å; C896-P899 WeakPolarHBondContact O-CD 3.39Å; C896-P899 WeakPolarHBondContact O-CG 3.17Å; P899-G901 VanDerWaalsContact C-N 3.34Å; P899-G901 PolarHBondContact O-N 3.48Å; P899-L902 PolarHBondContact O-N 2.85Å
900	L	96	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-64.5	-38.2	180	-91.9	57	0	0	0	111.7	L653 V883 V885 C896 L897 L902 M903 I910 L912 F937	L653-L900 HydrophobicContact CD1-CB 4.11Å; V883-L900 HydrophobicContact CG1-CD1 3.76Å; V885-L900 HydrophobicContact CG2-CD1 3.82Å; C896-L900 WeakPolarHBondContact O-CD1 3.27Å; L897-L900 HydrophobicContact CD2-CD2 4.33Å; L897-L900 PolarHBondContact O-N 2.84Å; L897-L900 VanDerWaalsContact O-N 3.17Å; L900-L902 PolarHBondContact O-N 2.93Å; L900-L902 VanDerWaalsContact O-N 3.08Å; L900-M903 WeakPolarHBondContact O-CB 3.43Å; L900-M903 PolarHBondContact O-N 2.92Å; L900-M903 VanDerWaalsContact O-N 3.08Å; L900-I910 HydrophobicContact CD1-CG2 4.13Å; L900-I910 HydrophobicContact CD2-CD1 4.27Å; L900-I910 HydrophobicContact CD2-CG2 4.19Å; L900-I910 HydrophobicContact CG-CD1 4.01Å; L900-I910 HydrophobicContact CG-CG1 4.3Å; L900-I910 HydrophobicContact CG-CG2 4.1Å; L900-L912 HydrophobicContact CD1-CD2 4.47Å; L900-F937 HydrophobicContact CD2-CD1 4.12Å; L900-F937 HydrophobicContact CD2-CE1 3.52Å; L900-F937 HydrophobicContact CD2-CZ 4.19Å
901	G	94.1	Very high	94.6	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-5.8	178.5	0	0	0	0	0	115.2	H652 Y871 L897 P899	H652-G901 PolarHBondContact CE1-O 3.11Å; Y871-G901 WeakPolarHBondContact OH-CA 3.47Å; L897-G901 PolarHBondContact O-N 3.49Å; P899-G901 VanDerWaalsContact C-N 3.34Å; P899-G901 PolarHBondContact O-N 3.48Å
902	L	94	Very high	94.7	Very high	1 Å²	1	16.1 Å²	16.1	1%	0.005	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-8.3	173.6	-61.9	165.1	0	0	0	112.9	L797 F870 Y871 G878 F880 P899 L900	L797-L902 HydrophobicContact CD2-CD1 3.92Å; F870-L902 HydrophobicContact CB-CD1 4Å; F870-L902 HydrophobicContact CB-CD2 4.1Å; F870-L902 HydrophobicContact CD2-CD1 4.28Å; Y871-L902 HydrophobicContact CD1-CD2 3.57Å; Y871-L902 HydrophobicContact CD2-CD2 4.39Å; Y871-L902 HydrophobicContact CE1-CD2 3.35Å; Y871-L902 HydrophobicContact CE1-CG 3.97Å; Y871-L902 HydrophobicContact CE2-CD2 4.16Å; Y871-L902 HydrophobicContact CE2-CG 4.28Å; Y871-L902 HydrophobicContact CG-CD2 4.09Å; Y871-L902 PolarHBondContact OH-N 2.84Å; G878-L902 PolarHBondContact N-O 2.92Å; F880-L902 HydrophobicContact CD2-CB 3.82Å; F880-L902 HydrophobicContact CD2-CD1 4.26Å; F880-L902 HydrophobicContact CE2-CB 4.3Å; F880-L902 HydrophobicContact CE2-CD1 3.99Å; P899-L902 PolarHBondContact O-N 2.85Å; L900-L902 PolarHBondContact O-N 2.93Å; L900-L902 VanDerWaalsContact O-N 3.08Å
903	M	93.3	Very high	94.8	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.087	C	C	.	.	B	Isolated β-bridge	trans	-92.4	152.8	-176	-68.2	-67.2	-64.6	0	0	112.6	H652 V877 F880 T881 V883 L900 Q909	H652-M903 PolarHBondContact NE2-O 2.9Å; V877-M903 WeakPolarHBondContact CG1-O 3.38Å; F880-M903 HydrophobicContact CB-SD 3.5Å; F880-M903 VanDerWaalsContact CB-SD 3.5Å; T881-M903 WeakPolarHBondContact O-CE 3.44Å; V883-M903 HydrophobicContact CB-CG 3.9Å; V883-M903 HydrophobicContact CB-SD 4.01Å; V883-M903 HydrophobicContact CG2-CG 3.36Å; V883-M903 HydrophobicContact CG2-SD 3.34Å; V883-M903 WeakPolarHBondContact CG2-SD 3.24Å; L900-M903 WeakPolarHBondContact O-CB 3.43Å; L900-M903 PolarHBondContact O-N 2.92Å; L900-M903 VanDerWaalsContact O-N 3.08Å; M903-Q909 VanDerWaalsContact CE-N 3.31Å; M903-Q909 WeakPolarHBondContact CE-O 3.3Å
904	S	91.4	Very high	94.7	Very high	22 Å²	22	15.3 Å²	15.3	15%	0.154	9%	0.086	C	C	.	.			trans	-79.3	141	167.8	175.1	0	0	0	0	111.3	I906 G908	S904-I906 VanDerWaalsContact C-N 3.27Å; S904-I906 PolarHBondContact O-N 2.94Å; S904-I906 PolarHBondContact OG-N 3.31Å; S904-I906 VanDerWaalsContact OG-N 3.17Å; S904-G908 VanDerWaalsContact O-CA 3.25Å; S904-G908 WeakPolarHBondContact O-CA 3.46Å; S904-G908 PolarHBondContact O-N 3.24Å; S904-G908 VanDerWaalsContact O-N 3.08Å
905	D	86	Confident	94.6	Very high	63 Å²	63	15.5 Å²	15.5	34%	0.337	9%	0.087	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-14.9	171.8	67.1	-50.9	0	0	0	113.9	L653 P763	L653-D905 HydrophobicContact CD2-CB 4.18Å; P763-D905 WeakPolarHBondContact CB-O 3.39Å; P763-D905 WeakPolarHBondContact CD-O 3.48Å; P763-D905 WeakPolarHBondContact CG-O 3.47Å
906	I	85.9	Confident	94.5	Very high	135 Å²	135	14.2 Å²	14.2	69%	0.692	8%	0.082	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97	-51.6	-177.6	-59.5	171.3	0	0	0	111.2	S904	S904-I906 VanDerWaalsContact C-N 3.27Å; S904-I906 PolarHBondContact O-N 2.94Å; S904-I906 PolarHBondContact OG-N 3.31Å; S904-I906 VanDerWaalsContact OG-N 3.17Å
907	S	86.3	Confident	94.3	Very high	59 Å²	59	17.6 Å²	17.6	41%	0.413	10%	0.098	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-13.3	-172.5	60.3	0	0	0	0	114.1	R762	R762-S907 PolarHBondContact NH1-O 3.28Å
908	G	93.4	Very high	94.2	Very high	1 Å²	1	18 Å²	18	1%	0.01	10%	0.1	C	C	.	.			trans	-74.5	146.4	-173.2	0	0	0	0	0	113.4	S904	S904-G908 VanDerWaalsContact O-CA 3.25Å; S904-G908 WeakPolarHBondContact O-CA 3.46Å; S904-G908 PolarHBondContact O-N 3.24Å; S904-G908 VanDerWaalsContact O-N 3.08Å
909	Q	96.7	Very high	93.9	Very high	5 Å²	5	18.6 Å²	18.6	2%	0.023	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	131.3	172	-169.1	172.1	14.7	0	0	111.5	I756 R762 T881 H882 V883 M903 V911	I756-Q909 PolarHBondContact O-NE2 3.2Å; I756-Q909 PolarHBondContact O-OE1 3.19Å; R762-Q909 HydrophobicContact CG-CB 3.85Å; R762-Q909 HydrophobicContact CG-CG 3.8Å; T881-Q909 PolarHBondContact O-N 3.48Å; H882-Q909 WeakPolarHBondContact CA-O 3.27Å; H882-Q909 PolarHBondContact CD2-OE1 2.86Å; H882-Q909 PolarHBondContact NE2-OE1 3.23Å; V883-Q909 PolarHBondContact N-O 3.24Å; M903-Q909 VanDerWaalsContact CE-N 3.31Å; M903-Q909 WeakPolarHBondContact CE-O 3.3Å; Q909-V911 HydrophobicContact CG-CG2 4.46Å
910	I	97.3	Very high	93.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.005	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	126.9	178	-60.9	165.3	0	0	0	108.3	V657 P765 Y766 L900 L912	V657-I910 HydrophobicContact CG1-CD1 3.58Å; V657-I910 HydrophobicContact CG2-CD1 4.42Å; P765-I910 HydrophobicContact CB-CB 4.36Å; P765-I910 HydrophobicContact CB-CG2 3.94Å; P765-I910 HydrophobicContact CG-CB 4.44Å; P765-I910 HydrophobicContact CG-CD1 4.46Å; P765-I910 HydrophobicContact CG-CG2 4.16Å; Y766-I910 PolarHBondContact N-O 3.26Å; L900-I910 HydrophobicContact CD1-CG2 4.13Å; L900-I910 HydrophobicContact CD2-CD1 4.27Å; L900-I910 HydrophobicContact CD2-CG2 4.19Å; L900-I910 HydrophobicContact CG-CD1 4.01Å; L900-I910 HydrophobicContact CG-CG1 4.3Å; L900-I910 HydrophobicContact CG-CG2 4.1Å; I910-L912 HydrophobicContact CG2-CD2 3.92Å; I910-L912 HydrophobicContact CG2-CG 4.11Å
911	V	98.2	Very high	93.6	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.012	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	116.2	173.6	-179.7	0	0	0	0	108.7	I756 Y766 V883 F884 V885 Q909	I756-V911 HydrophobicContact CD1-CG1 3.95Å; I756-V911 HydrophobicContact CD1-CG2 4.35Å; I756-V911 HydrophobicContact CG1-CG1 4.37Å; I756-V911 HydrophobicContact CG1-CG2 4.01Å; I756-V911 HydrophobicContact CG2-CG2 3.98Å; Y766-V911 HydrophobicContact CD1-CG1 4.37Å; Y766-V911 CarbonylContact O-C 3.53Å; Y766-V911 WeakPolarHBondContact O-CA 3.47Å; V883-V911 PolarHBondContact O-N 3.41Å; F884-V911 CarbonylContact C-O 3.58Å; F884-V911 WeakPolarHBondContact CA-O 3.44Å; F884-V911 HydrophobicContact CD1-CB 3.58Å; F884-V911 HydrophobicContact CD1-CG1 3.68Å; F884-V911 HydrophobicContact CD1-CG2 4.07Å; F884-V911 HydrophobicContact CE1-CB 3.79Å; F884-V911 HydrophobicContact CE1-CG1 3.86Å; F884-V911 HydrophobicContact CE1-CG2 3.76Å; F884-V911 HydrophobicContact CG-CB 4.16Å; F884-V911 HydrophobicContact CZ-CG2 4.11Å; V885-V911 PolarHBondContact N-O 3.35Å; Q909-V911 HydrophobicContact CG-CG2 4.46Å
912	L	98.4	Very high	93.2	Very high	0 Å²	0	25 Å²	25	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	117.7	175.2	-55.3	179.4	0	0	0	108.5	P765 Y766 I767 L768 V885 A888 L900 I910 F937 L938 L941	P765-L912 HydrophobicContact CB-CD1 3.89Å; P765-L912 HydrophobicContact CB-CG 4.18Å; Y766-L912 PolarHBondContact O-N 2.91Å; I767-L912 CarbonylContact C-O 3.44Å; I767-L912 WeakPolarHBondContact CA-O 3.43Å; L768-L912 PolarHBondContact N-O 2.94Å; V885-L912 HydrophobicContact CB-CD2 3.82Å; V885-L912 HydrophobicContact CG2-CD2 3.88Å; A888-L912 HydrophobicContact CB-CB 4.1Å; A888-L912 HydrophobicContact CB-CD2 4.43Å; L900-L912 HydrophobicContact CD1-CD2 4.47Å; I910-L912 HydrophobicContact CG2-CD2 3.92Å; I910-L912 HydrophobicContact CG2-CG 4.11Å; L912-F937 HydrophobicContact CD1-CD1 3.61Å; L912-F937 HydrophobicContact CD1-CE1 3.76Å; L912-L938 HydrophobicContact CB-CD1 3.96Å; L912-L941 HydrophobicContact CD1-CD1 3.69Å
913	A	98.2	Very high	93.1	Very high	1 Å²	1	26 Å²	26	1%	0.008	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	133.5	175.3	0	0	0	0	0	109.9	L768 I780 V885 D886 E887 A888	L768-A913 HydrophobicContact CB-CB 3.99Å; L768-A913 HydrophobicContact CD2-CB 4.1Å; L768-A913 HydrophobicContact CG-CB 4.42Å; L768-A913 WeakPolarHBondContact O-CA 3.35Å; I780-A913 HydrophobicContact CD1-CB 3.39Å; I780-A913 HydrophobicContact CG1-CB 3.93Å; V885-A913 PolarHBondContact O-N 3.05Å; D886-A913 CarbonylContact C-O 3.09Å; E887-A913 PolarHBondContact N-O 2.89Å; A888-A913 WeakPolarHBondContact CB-O 3.49Å; A888-A913 PolarHBondContact N-O 3.43Å
914	G	96.5	Very high	92.8	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	167.7	-170.3	-178.4	0	0	0	0	0	113	L768 G770	L768-G914 PolarHBondContact O-N 3.01Å; L768-G914 VanDerWaalsContact O-N 3.16Å; G770-G914 PolarHBondContact N-O 3.27Å
915	D	96.1	Very high	92.8	Very high	3 Å²	3	29.4 Å²	29.4	2%	0.016	16%	0.163	C	C	.	.			trans	-138.2	110.8	179.1	-177.5	-7.4	0	0	0	109.3	F769 P771 M917 Q918 Y987	F769-D915 HydrophobicContact CE2-CB 4.35Å; F769-D915 WeakPolarHBondContact CE2-OD1 3.48Å; P771-D915 WeakPolarHBondContact CA-OD2 3.34Å; D915-M917 PolarHBondContact O-N 3.35Å; D915-M917 WeakPolarHBondContact OD1-CA 3.48Å; D915-M917 WeakPolarHBondContact OD1-CB 3.45Å; D915-M917 PolarHBondContact OD1-N 2.92Å; D915-Q918 HydrophobicContact CB-CB 4.24Å; D915-Q918 HydrophobicContact CB-CG 4.12Å; D915-Q918 PolarHBondContact O-N 3.11Å; D915-Q918 WeakPolarHBondContact OD2-CG 3.46Å; D915-Q918 PolarHBondContact OD2-NE2 3.1Å; D915-Y987 PolarHBondContact OD2-OH 3.04Å
916	P	94.8	Very high	92.8	Very high	6 Å²	6	34.4 Å²	34.4	4%	0.039	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-16.2	178.7	33.7	-41.1	0	0	0	113	F769 Q918 E939 M942 K1130	F769-P916 HydrophobicContact CE2-CG 4.4Å; F769-P916 HydrophobicContact CZ-CG 4.42Å; P916-Q918 VanDerWaalsContact C-N 3.34Å; P916-E939 HydrophobicContact CB-CB 4.18Å; P916-E939 HydrophobicContact CB-CG 4.4Å; P916-M942 HydrophobicContact CB-SD 4.23Å; P916-M942 HydrophobicContact CG-CE 3.93Å; P916-M942 HydrophobicContact CG-SD 3.55Å; P916-M942 VanDerWaalsContact CG-SD 3.55Å; P916-K1130 WeakPolarHBondContact O-CE 3.12Å; P916-K1130 PolarHBondContact O-NZ 3.11Å; P916-K1130 VanDerWaalsContact O-NZ 3.1Å
917	M	93.9	Very high	93.1	Very high	71 Å²	71	30.2 Å²	30.2	35%	0.35	16%	0.156	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.9	2.8	179.3	-56.4	-59.1	169.5	0	0	112.9	D915 F986 Y987 N1133	D915-M917 PolarHBondContact O-N 3.35Å; D915-M917 WeakPolarHBondContact OD1-CA 3.48Å; D915-M917 WeakPolarHBondContact OD1-CB 3.45Å; D915-M917 PolarHBondContact OD1-N 2.92Å; M917-F986 HydrophobicContact CB-CB 4.22Å; M917-F986 HydrophobicContact CB-CD1 4.32Å; M917-F986 HydrophobicContact CG-CB 4.42Å; M917-Y987 HydrophobicContact CB-CE1 4.12Å; M917-Y987 HydrophobicContact CG-CE1 4.36Å; M917-N1133 PolarHBondContact O-ND2 3.43Å
918	Q	93.2	Very high	93.5	Very high	7 Å²	7	27.4 Å²	27.4	3%	0.033	14%	0.136	C	C	.	.	S	Bend	trans	-103.3	-174	170.2	-74.6	-177.4	47.3	0	0	111.2	P772 D915 P916 G920 K1130 V1134	P772-Q918 VanDerWaalsContact CD-NE2 3.28Å; D915-Q918 HydrophobicContact CB-CB 4.24Å; D915-Q918 HydrophobicContact CB-CG 4.12Å; D915-Q918 PolarHBondContact O-N 3.11Å; D915-Q918 WeakPolarHBondContact OD2-CG 3.46Å; D915-Q918 PolarHBondContact OD2-NE2 3.1Å; P916-Q918 VanDerWaalsContact C-N 3.34Å; Q918-G920 PolarHBondContact O-N 2.78Å; Q918-K1130 WeakPolarHBondContact O-CB 3.3Å; Q918-K1130 VanDerWaalsContact O-CD 3.22Å; Q918-K1130 WeakPolarHBondContact O-CD 3.42Å; Q918-K1130 WeakPolarHBondContact O-CG 3.44Å; Q918-V1134 HydrophobicContact CB-CG2 3.85Å; Q918-V1134 HydrophobicContact CG-CG2 3.79Å
919	L	91.2	Very high	93.3	Very high	13 Å²	13	30.6 Å²	30.6	7%	0.068	15%	0.152	C	C	.	.			trans	-53.4	126.4	-177.2	-75.4	173.8	0	0	0	112.2	V1093 E1094 Q1097 R1131 V1134	L919-V1093 HydrophobicContact CD1-CG1 4.3Å; L919-E1094 HydrophobicContact CD1-CG 4.21Å; L919-Q1097 HydrophobicContact CD1-CB 4.38Å; L919-R1131 HydrophobicContact CD2-CG 3.55Å; L919-V1134 HydrophobicContact CG-CG2 4.02Å
920	G	92.5	Very high	92.9	Very high	14 Å²	14	31.6 Å²	31.6	14%	0.144	16%	0.161	C	C	.	.			trans	-81	-171.4	171.7	0	0	0	0	0	113.1	G889 Q918	G889-G920 WeakPolarHBondContact O-CA 3.34Å; Q918-G920 PolarHBondContact O-N 2.78Å
921	P	93.5	Very high	92.6	Very high	13 Å²	13	32.4 Å²	32.4	8%	0.084	16%	0.164	C	C	.	.			trans	-56	138.1	172.6	-20.7	31.4	0	0	0	112.5	Q890 A891 S892 I923 N934	Q890-P921 VanDerWaalsContact O-CA 3.26Å; Q890-P921 WeakPolarHBondContact O-CA 3.17Å; A891-P921 WeakPolarHBondContact O-CG 3.04Å; S892-P921 VanDerWaalsContact CA-CG 3.46Å; P921-I923 HydrophobicContact CB-CD1 4.01Å; P921-I923 HydrophobicContact CB-CG1 4.21Å; P921-I923 PolarHBondContact O-N 3.23Å; P921-N934 WeakPolarHBondContact CD-O 3.29Å
922	V	87.3	Confident	92.3	Very high	109 Å²	109	33.4 Å²	33.4	66%	0.661	18%	0.175	S	C	*	.			trans	-83.8	97.3	176.6	-177.1	0	0	0	0	109
923	I	90.7	Very high	92.2	Very high	22 Å²	22	33.6 Å²	33.6	11%	0.113	18%	0.176	C	C	.	.			trans	-108.2	131.7	178.4	-51.5	-52.8	0	0	0	109.1	E541 P921 A928 M929 L933 N934	E541-I923 VanDerWaalsContact OE2-CG2 3.31Å; E541-I923 WeakPolarHBondContact OE2-CG2 3.45Å; P921-I923 HydrophobicContact CB-CD1 4.01Å; P921-I923 HydrophobicContact CB-CG1 4.21Å; P921-I923 PolarHBondContact O-N 3.23Å; I923-A928 HydrophobicContact CG2-CB 3.88Å; I923-M929 HydrophobicContact CB-CG 3.65Å; I923-M929 HydrophobicContact CB-SD 4.43Å; I923-M929 HydrophobicContact CG2-CG 3.56Å; I923-M929 VanDerWaalsContact O-SD 3.37Å; I923-L933 HydrophobicContact CD1-CB 4.42Å; I923-L933 HydrophobicContact CD1-CD2 3.88Å; I923-L933 HydrophobicContact CD1-CG 3.75Å; I923-L933 HydrophobicContact CG1-CB 4.3Å; I923-L933 HydrophobicContact CG1-CD2 4.49Å; I923-L933 HydrophobicContact CG1-CG 4.18Å; I923-L933 HydrophobicContact CG2-CB 4.38Å; I923-L933 HydrophobicContact CG2-CD2 4.19Å; I923-N934 HydrophobicContact CB-CB 4.4Å; I923-N934 HydrophobicContact CG1-CB 3.95Å
924	K	87.4	Confident	91.9	Very high	87 Å²	87	36.5 Å²	36.5	38%	0.378	19%	0.191	S	C	.	.			trans	-99	-35.6	-178.4	-60.9	-179.7	174.2	-177.5	0	112.5	E541 Y544 E548 R926	E541-K924 WeakPolarHBondContact OE1-CB 3.45Å; E541-K924 PolarHBondContact OE1-N 3.23Å; E541-K924 PolarHBondContact OE2-N 3.47Å; E541-K924 VanDerWaalsContact OE2-N 3.17Å; Y544-K924 HydrophobicContact CD1-CB 3.61Å; Y544-K924 HydrophobicContact CE1-CB 3.48Å; Y544-K924 VanDerWaalsContact CE1-CB 3.48Å; Y544-K924 HydrophobicContact CE1-CD 4.24Å; Y544-K924 HydrophobicContact CE1-CG 4.5Å; E548-K924 IonicContact OE1-NZ 3.86Å; E548-K924 WeakPolarHBondContact OE2-CD 3.28Å; E548-K924 IonicContact OE2-NZ 2.88Å; E548-K924 PolarHBondContact OE2-NZ 3.22Å; K924-R926 PolarHBondContact O-N 3.48Å
925	S	90.7	Very high	91.8	Very high	5 Å²	5	38.7 Å²	38.7	4%	0.035	21%	0.205	C	C	.	.			trans	-66.6	118.6	179.1	179.3	0	0	0	0	110.5	L540 E541 L927 A928 M929	L540-S925 WeakPolarHBondContact O-CB 3.48Å; L540-S925 PolarHBondContact O-OG 3.41Å; E541-S925 WeakPolarHBondContact OE2-CB 3.1Å; E541-S925 PolarHBondContact OE2-N 2.98Å; S925-L927 VanDerWaalsContact C-N 3.27Å; S925-L927 PolarHBondContact O-N 3.24Å; S925-A928 PolarHBondContact O-N 3.05Å; S925-A928 PolarHBondContact OG-N 2.95Å; S925-M929 WeakPolarHBondContact O-CG 3.43Å; S925-M929 PolarHBondContact O-N 2.8Å
926	R	87.5	Confident	91.9	Very high	169 Å²	169	38.6 Å²	38.6	64%	0.638	20%	0.204	S	C	*	.	H	α-helix	trans	-60.4	-38.6	176.6	-66.5	-175.1	-176.9	177.1	0.3	112.2	K924 M929 A930	K924-R926 PolarHBondContact O-N 3.48Å; R926-M929 HydrophobicContact CG-CE 4.27Å; R926-M929 PolarHBondContact O-N 2.68Å; R926-A930 VanDerWaalsContact O-CB 3.25Å; R926-A930 WeakPolarHBondContact O-CB 3.33Å; R926-A930 PolarHBondContact O-N 3.19Å
927	L	91.5	Very high	92.1	Very high	46 Å²	46	38.3 Å²	38.3	24%	0.241	20%	0.202	C	C	.	.	H	α-helix	trans	-65.3	-45.8	176	-64.8	174.2	0	0	0	110.6	T137 V508 I514 L540 S925 M929 A930 Y931	T137-L927 HydrophobicContact CG2-CD2 3.76Å; V508-L927 HydrophobicContact CG2-CD1 4.32Å; I514-L927 HydrophobicContact CG2-CD2 4.23Å; L540-L927 HydrophobicContact CD1-CB 4.08Å; L540-L927 HydrophobicContact CD2-CB 4.48Å; L540-L927 HydrophobicContact CD2-CD1 4.1Å; S925-L927 VanDerWaalsContact C-N 3.27Å; S925-L927 PolarHBondContact O-N 3.24Å; L927-M929 VanDerWaalsContact C-N 3.33Å; L927-M929 PolarHBondContact O-N 2.91Å; L927-A930 PolarHBondContact O-N 2.91Å; L927-Y931 WeakPolarHBondContact O-CD2 3.28Å; L927-Y931 PolarHBondContact O-N 3.19Å
928	A	94.1	Very high	92.2	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-63.8	-38.9	178.5	0	0	0	0	0	112.4	L540 I923 S925 G932 L933	L540-A928 HydrophobicContact CB-CB 4.26Å; I923-A928 HydrophobicContact CG2-CB 3.88Å; S925-A928 PolarHBondContact O-N 3.05Å; S925-A928 PolarHBondContact OG-N 2.95Å; A928-G932 PolarHBondContact O-N 3.38Å; A928-L933 HydrophobicContact CB-CB 4.03Å; A928-L933 HydrophobicContact CB-CD2 3.8Å; A928-L933 VanDerWaalsContact O-CB 3.3Å; A928-L933 WeakPolarHBondContact O-CB 3.27Å; A928-L933 PolarHBondContact O-N 2.85Å
929	M	90.5	Very high	92.4	Very high	69 Å²	69	37.1 Å²	37.1	34%	0.34	20%	0.196	S	C	.	.	H	α-helix	trans	-63	-46.5	172	-72.7	-170.6	-81.5	0	0	112.2	I923 S925 R926 L927 Y931 G932 N934	I923-M929 HydrophobicContact CB-CG 3.65Å; I923-M929 HydrophobicContact CB-SD 4.43Å; I923-M929 HydrophobicContact CG2-CG 3.56Å; I923-M929 VanDerWaalsContact O-SD 3.37Å; S925-M929 WeakPolarHBondContact O-CG 3.43Å; S925-M929 PolarHBondContact O-N 2.8Å; R926-M929 HydrophobicContact CG-CE 4.27Å; R926-M929 PolarHBondContact O-N 2.68Å; L927-M929 VanDerWaalsContact C-N 3.33Å; L927-M929 PolarHBondContact O-N 2.91Å; M929-Y931 PolarHBondContact O-N 3.29Å; M929-G932 PolarHBondContact O-N 2.83Å; M929-N934 HydrophobicContact CG-CB 4.16Å; M929-N934 PolarHBondContact O-OD1 3.12Å
930	A	87.6	Confident	92.6	Very high	26 Å²	26	37.4 Å²	37.4	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-58.7	-30.9	-177.4	0	0	0	0	0	113.3	S135 R926 L927	S135-A930 VanDerWaalsContact O-CB 3.23Å; S135-A930 WeakPolarHBondContact O-CB 3.44Å; R926-A930 VanDerWaalsContact O-CB 3.25Å; R926-A930 WeakPolarHBondContact O-CB 3.33Å; R926-A930 PolarHBondContact O-N 3.19Å; L927-A930 PolarHBondContact O-N 2.91Å
931	Y	91.5	Very high	92.8	Very high	17 Å²	17	36.8 Å²	36.8	7%	0.067	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	13.4	178.4	-63.7	-70.1	0	0	0	114.1	T137 I514 L515 L521 L927 M929	T137-Y931 HydrophobicContact CG2-CE2 4.24Å; T137-Y931 PolarHBondContact OG1-OH 3.33Å; I514-Y931 HydrophobicContact CG2-CE2 3.53Å; L515-Y931 HydrophobicContact CD2-CE1 3.94Å; L515-Y931 WeakPolarHBondContact CD2-OH 3.09Å; L515-Y931 VanDerWaalsContact CG-OH 3.28Å; L515-Y931 WeakPolarHBondContact CG-OH 3.2Å; L521-Y931 HydrophobicContact CB-CD1 3.77Å; L521-Y931 HydrophobicContact CB-CD2 4.26Å; L521-Y931 HydrophobicContact CB-CE1 3.99Å; L521-Y931 HydrophobicContact CB-CE2 4.49Å; L521-Y931 HydrophobicContact CB-CG 3.91Å; L521-Y931 HydrophobicContact CD1-CD2 3.9Å; L521-Y931 HydrophobicContact CD1-CE2 4.13Å; L521-Y931 HydrophobicContact CD1-CG 4.3Å; L521-Y931 WeakPolarHBondContact O-CD1 3.2Å; L927-Y931 WeakPolarHBondContact O-CD2 3.28Å; L927-Y931 PolarHBondContact O-N 3.19Å; M929-Y931 PolarHBondContact O-N 3.29Å
932	G	91.5	Very high	92.9	Very high	24 Å²	24	37.5 Å²	37.5	25%	0.247	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	101.9	12.1	161.1	0	0	0	0	0	117.6	A928 M929 N934 V935	A928-G932 PolarHBondContact O-N 3.38Å; M929-G932 PolarHBondContact O-N 2.83Å; G932-N934 PolarHBondContact O-N 3.46Å; G932-V935 PolarHBondContact O-N 3.01Å; G932-V935 VanDerWaalsContact O-N 3.11Å
933	L	95.4	Very high	93.1	Very high	3 Å²	3	35.7 Å²	35.7	2%	0.016	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-20.5	177.1	-168	62.5	0	0	0	113	F534 L537 E541 P894 I923 A928 V935	F534-L933 HydrophobicContact CD1-CD1 4.2Å; L537-L933 HydrophobicContact CB-CB 4.17Å; L537-L933 HydrophobicContact CB-CD1 4.02Å; L537-L933 HydrophobicContact CB-CD2 4.14Å; L537-L933 HydrophobicContact CB-CG 4.33Å; L537-L933 HydrophobicContact CD1-CB 4.19Å; L537-L933 HydrophobicContact CD1-CD1 4.44Å; E541-L933 HydrophobicContact CB-CD2 4.14Å; P894-L933 HydrophobicContact CG-CD1 4.15Å; I923-L933 HydrophobicContact CD1-CB 4.42Å; I923-L933 HydrophobicContact CD1-CD2 3.88Å; I923-L933 HydrophobicContact CD1-CG 3.75Å; I923-L933 HydrophobicContact CG1-CB 4.3Å; I923-L933 HydrophobicContact CG1-CD2 4.49Å; I923-L933 HydrophobicContact CG1-CG 4.18Å; I923-L933 HydrophobicContact CG2-CB 4.38Å; I923-L933 HydrophobicContact CG2-CD2 4.19Å; A928-L933 HydrophobicContact CB-CB 4.03Å; A928-L933 HydrophobicContact CB-CD2 3.8Å; A928-L933 VanDerWaalsContact O-CB 3.3Å; A928-L933 WeakPolarHBondContact O-CB 3.27Å; A928-L933 PolarHBondContact O-N 2.85Å; L933-V935 VanDerWaalsContact C-N 3.27Å; L933-V935 PolarHBondContact O-N 3.12Å
934	N	93	Very high	93.2	Very high	62 Å²	62	36.9 Å²	36.9	33%	0.332	19%	0.187	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.5	1.2	176.2	68	-57.3	0	0	0	113.8	P921 I923 M929 G932	P921-N934 WeakPolarHBondContact CD-O 3.29Å; I923-N934 HydrophobicContact CB-CB 4.4Å; I923-N934 HydrophobicContact CG1-CB 3.95Å; M929-N934 HydrophobicContact CG-CB 4.16Å; M929-N934 PolarHBondContact O-OD1 3.12Å; G932-N934 PolarHBondContact O-N 3.46Å
935	V	94.9	Very high	93.3	Very high	47 Å²	47	37.4 Å²	37.4	29%	0.285	20%	0.199	S	C	.	.	S	Bend	trans	-93.3	125	171.5	-178	0	0	0	0	107.7	G932 L933 E939 R940	G932-V935 PolarHBondContact O-N 3.01Å; G932-V935 VanDerWaalsContact O-N 3.11Å; L933-V935 VanDerWaalsContact C-N 3.27Å; L933-V935 PolarHBondContact O-N 3.12Å; V935-E939 HydrophobicContact CG1-CB 4.07Å; V935-E939 HydrophobicContact CG1-CG 3.95Å; V935-R940 HydrophobicContact CG1-CB 4.18Å
936	S	97.5	Very high	93.4	Very high	0 Å²	0	38 Å²	38	0%	0	20%	0.204	C	C	.	.	B	Isolated β-bridge	trans	-75	159.9	178	65.1	0	0	0	0	111.6	G889 A891 L938 E939 R940	G889-S936 VanDerWaalsContact O-CB 3.25Å; G889-S936 WeakPolarHBondContact O-CB 3.2Å; G889-S936 PolarHBondContact O-OG 3.45Å; A891-S936 WeakPolarHBondContact O-CB 3.46Å; S936-L938 VanDerWaalsContact C-N 3.26Å; S936-L938 PolarHBondContact O-N 3.27Å; S936-E939 PolarHBondContact O-N 3.45Å; S936-E939 VanDerWaalsContact OG-CB 3.29Å; S936-E939 WeakPolarHBondContact OG-CB 3.32Å; S936-E939 PolarHBondContact OG-N 2.87Å; S936-E939 VanDerWaalsContact OG-N 3.12Å; S936-R940 PolarHBondContact O-N 2.8Å
937	F	97.8	Very high	93.7	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-58.2	-40.9	173.2	-175.8	-123.6	0	0	0	111.5	L658 P765 E893 C896 L897 L900 L912 E939 R940 L941	L658-F937 HydrophobicContact CD2-CE2 4.18Å; L658-F937 HydrophobicContact CD2-CZ 4.36Å; P765-F937 HydrophobicContact CG-CE1 4.3Å; P765-F937 HydrophobicContact CG-CZ 4.46Å; E893-F937 HydrophobicContact CB-CB 4.13Å; E893-F937 HydrophobicContact CG-CB 4.01Å; E893-F937 HydrophobicContact CG-CD2 3.93Å; E893-F937 HydrophobicContact CG-CG 4.38Å; E893-F937 WeakPolarHBondContact OE1-CD2 3.35Å; C896-F937 HydrophobicContact CB-CB 4.05Å; L897-F937 HydrophobicContact CD2-CD2 4.37Å; L897-F937 HydrophobicContact CD2-CE2 4.25Å; L897-F937 HydrophobicContact CD2-CZ 4.44Å; L900-F937 HydrophobicContact CD2-CD1 4.12Å; L900-F937 HydrophobicContact CD2-CE1 3.52Å; L900-F937 HydrophobicContact CD2-CZ 4.19Å; L912-F937 HydrophobicContact CD1-CD1 3.61Å; L912-F937 HydrophobicContact CD1-CE1 3.76Å; F937-E939 PolarHBondContact O-N 3.01Å; F937-R940 PolarHBondContact O-N 3.17Å; F937-L941 HydrophobicContact CD1-CD1 3.93Å; F937-L941 HydrophobicContact CD2-CG 4.33Å; F937-L941 HydrophobicContact CE1-CD1 3.53Å; F937-L941 HydrophobicContact CE1-CG 4.32Å; F937-L941 HydrophobicContact CE2-CD1 4.17Å; F937-L941 HydrophobicContact CE2-CD2 4.18Å; F937-L941 HydrophobicContact CE2-CG 4.1Å; F937-L941 HydrophobicContact CG-CD1 4.41Å; F937-L941 HydrophobicContact CZ-CD1 3.67Å; F937-L941 HydrophobicContact CZ-CD2 4.2Å; F937-L941 HydrophobicContact CZ-CG 4.08Å; F937-L941 WeakPolarHBondContact O-CB 3.49Å; F937-L941 VanDerWaalsContact O-CG 3.31Å; F937-L941 WeakPolarHBondContact O-CG 3.46Å; F937-L941 PolarHBondContact O-N 3.04Å
938	L	97.9	Very high	93.7	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-56.8	-51.3	175.5	-179.2	78	0	0	0	111.5	I767 A888 L912 S936 L941 M942	I767-L938 HydrophobicContact CB-CD1 4.44Å; I767-L938 HydrophobicContact CD1-CD1 3.98Å; I767-L938 HydrophobicContact CG1-CD1 4.05Å; I767-L938 HydrophobicContact CG2-CD1 3.67Å; A888-L938 HydrophobicContact CB-CB 4.24Å; L912-L938 HydrophobicContact CB-CD1 3.96Å; S936-L938 VanDerWaalsContact C-N 3.26Å; S936-L938 PolarHBondContact O-N 3.27Å; L938-L941 PolarHBondContact O-N 2.79Å; L938-M942 HydrophobicContact CG-SD 4.3Å; L938-M942 WeakPolarHBondContact O-CG 3.41Å; L938-M942 PolarHBondContact O-N 3.42Å
939	E	96.4	Very high	93.5	Very high	53 Å²	53	34.8 Å²	34.8	25%	0.248	19%	0.193	C	C	.	.	H	α-helix	trans	-64.2	-42.9	-178.8	-178.5	172.5	-163.8	0	0	111.9	P916 V935 S936 F937 L941 M942 S943 K1130	P916-E939 HydrophobicContact CB-CB 4.18Å; P916-E939 HydrophobicContact CB-CG 4.4Å; V935-E939 HydrophobicContact CG1-CB 4.07Å; V935-E939 HydrophobicContact CG1-CG 3.95Å; S936-E939 PolarHBondContact O-N 3.45Å; S936-E939 VanDerWaalsContact OG-CB 3.29Å; S936-E939 WeakPolarHBondContact OG-CB 3.32Å; S936-E939 PolarHBondContact OG-N 2.87Å; S936-E939 VanDerWaalsContact OG-N 3.12Å; F937-E939 PolarHBondContact O-N 3.01Å; E939-L941 VanDerWaalsContact C-N 3.34Å; E939-L941 PolarHBondContact O-N 3.37Å; E939-M942 PolarHBondContact O-N 2.94Å; E939-S943 PolarHBondContact O-N 3.48Å; E939-S943 VanDerWaalsContact O-N 3.12Å; E939-K1130 IonicContact OE1-NZ 3.74Å; E939-K1130 PolarHBondContact OE1-NZ 2.93Å; E939-K1130 IonicContact OE2-NZ 2.7Å; E939-K1130 PolarHBondContact OE2-NZ 2.93Å
940	R	96.2	Very high	93.5	Very high	20 Å²	20	34.6 Å²	34.6	8%	0.075	19%	0.193	C	C	.	.	H	α-helix	trans	-64.5	-36.8	176.2	-170.3	-173.6	62.9	77.1	-13.6	112.6	L658 E893 V935 S936 F937 S943	L658-R940 VanDerWaalsContact O-CZ 3.28Å; L658-R940 PolarHBondContact O-NH1 3.15Å; L658-R940 PolarHBondContact O-NH2 3.02Å; E893-R940 IonicContact OE1-CZ 3.79Å; E893-R940 VanDerWaalsContact OE1-CZ 3.23Å; E893-R940 IonicContact OE1-NE 3.11Å; E893-R940 PolarHBondContact OE1-NE 3.33Å; E893-R940 IonicContact OE1-NH2 3.13Å; E893-R940 PolarHBondContact OE1-NH2 3.47Å; E893-R940 VanDerWaalsContact OE2-CD 3.26Å; E893-R940 WeakPolarHBondContact OE2-CD 3.4Å; E893-R940 IonicContact OE2-CZ 3.21Å; E893-R940 IonicContact OE2-NE 2.76Å; E893-R940 PolarHBondContact OE2-NE 2.84Å; V935-R940 HydrophobicContact CG1-CB 4.18Å; S936-R940 PolarHBondContact O-N 2.8Å; F937-R940 PolarHBondContact O-N 3.17Å; R940-S943 PolarHBondContact O-N 2.75Å; R940-S943 PolarHBondContact O-OG 3.22Å
941	L	96.3	Very high	93.4	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-67.3	-43.5	174.3	-74	179.6	0	0	0	111	P660 P765 I767 L912 F937 L938 E939 S943 R944 Y947	P660-L941 HydrophobicContact CG-CD2 3.74Å; P765-L941 HydrophobicContact CB-CD1 3.87Å; P765-L941 HydrophobicContact CG-CD1 3.86Å; I767-L941 HydrophobicContact CD1-CB 4.24Å; L912-L941 HydrophobicContact CD1-CD1 3.69Å; F937-L941 HydrophobicContact CD1-CD1 3.93Å; F937-L941 HydrophobicContact CD2-CG 4.33Å; F937-L941 HydrophobicContact CE1-CD1 3.53Å; F937-L941 HydrophobicContact CE1-CG 4.32Å; F937-L941 HydrophobicContact CE2-CD1 4.17Å; F937-L941 HydrophobicContact CE2-CD2 4.18Å; F937-L941 HydrophobicContact CE2-CG 4.1Å; F937-L941 HydrophobicContact CG-CD1 4.41Å; F937-L941 HydrophobicContact CZ-CD1 3.67Å; F937-L941 HydrophobicContact CZ-CD2 4.2Å; F937-L941 HydrophobicContact CZ-CG 4.08Å; F937-L941 WeakPolarHBondContact O-CB 3.49Å; F937-L941 VanDerWaalsContact O-CG 3.31Å; F937-L941 WeakPolarHBondContact O-CG 3.46Å; F937-L941 PolarHBondContact O-N 3.04Å; L938-L941 PolarHBondContact O-N 2.79Å; E939-L941 VanDerWaalsContact C-N 3.34Å; E939-L941 PolarHBondContact O-N 3.37Å; L941-S943 PolarHBondContact O-N 2.68Å; L941-R944 VanDerWaalsContact O-CB 3.27Å; L941-R944 WeakPolarHBondContact O-CB 3.42Å; L941-R944 PolarHBondContact O-N 3.23Å; L941-Y947 WeakPolarHBondContact O-CB 3.42Å
942	M	94.9	Very high	93.3	Very high	28 Å²	28	46.3 Å²	46.3	14%	0.138	25%	0.249	C	C	.	.	H	α-helix	trans	-64.7	-19	178.7	-71	-174.5	68.5	0	0	113.7	I767 F769 P916 L938 E939	I767-M942 HydrophobicContact CD1-CG 3.67Å; I767-M942 HydrophobicContact CD1-SD 4.47Å; I767-M942 HydrophobicContact CG2-SD 4.3Å; F769-M942 HydrophobicContact CD1-CE 3.78Å; F769-M942 HydrophobicContact CE1-CE 4.01Å; F769-M942 HydrophobicContact CG-CE 4.3Å; P916-M942 HydrophobicContact CB-SD 4.23Å; P916-M942 HydrophobicContact CG-CE 3.93Å; P916-M942 HydrophobicContact CG-SD 3.55Å; P916-M942 VanDerWaalsContact CG-SD 3.55Å; L938-M942 HydrophobicContact CG-SD 4.3Å; L938-M942 WeakPolarHBondContact O-CG 3.41Å; L938-M942 PolarHBondContact O-N 3.42Å; E939-M942 PolarHBondContact O-N 2.94Å
943	S	91.6	Very high	93.2	Very high	71 Å²	71	48 Å²	48	50%	0.497	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-6.2	171.6	77.1	0	0	0	0	114	E939 R940 L941 Q948	E939-S943 PolarHBondContact O-N 3.48Å; E939-S943 VanDerWaalsContact O-N 3.12Å; R940-S943 PolarHBondContact O-N 2.75Å; R940-S943 PolarHBondContact O-OG 3.22Å; L941-S943 PolarHBondContact O-N 2.68Å; S943-Q948 PolarHBondContact O-NE2 2.63Å
944	R	92.6	Very high	92.9	Very high	48 Å²	48	50.7 Å²	50.7	18%	0.181	27%	0.272	C	S	.	.	S	Bend	trans	-79.6	144.7	177.6	-69.8	-86.6	164.9	-176.4	-10.3	111	F659 E661 L941 A946 Y947 Q948	F659-R944 VanDerWaalsContact CE1-NH2 3.35Å; E661-R944 IonicContact OE1-NH1 2.99Å; L941-R944 VanDerWaalsContact O-CB 3.27Å; L941-R944 WeakPolarHBondContact O-CB 3.42Å; L941-R944 PolarHBondContact O-N 3.23Å; R944-A946 PolarHBondContact O-N 2.76Å; R944-A946 VanDerWaalsContact O-N 3.09Å; R944-Y947 HydrophobicContact CB-CD2 4.41Å; R944-Y947 PolarHBondContact O-N 3.29Å; R944-Q948 WeakPolarHBondContact O-CG 3.45Å; R944-Q948 PolarHBondContact O-N 2.83Å
945	P	90.5	Very high	92.5	Very high	97 Å²	97	49.9 Å²	49.9	63%	0.63	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-39.3	-178.3	-29.7	35.9	0	0	0	114.7	Y947 Q948	P945-Y947 PolarHBondContact O-N 2.94Å; P945-Q948 PolarHBondContact O-N 3.24Å
946	A	91.6	Very high	91.8	Very high	17 Å²	17	52.8 Å²	52.8	14%	0.14	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.3	179.2	0	0	0	0	0	114.3	R944 L964	R944-A946 PolarHBondContact O-N 2.76Å; R944-A946 VanDerWaalsContact O-N 3.09Å; A946-L964 HydrophobicContact CB-CD1 4.11Å; A946-L964 WeakPolarHBondContact O-CD1 3.21Å
947	Y	94.9	Very high	91	Very high	0 Å²	0	56 Å²	56	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	-11.4	-178.3	-68.3	-96.7	0	0	0	113.2	P660 P765 I767 L941 R944 P945 H960 L964 V965	P660-Y947 HydrophobicContact CB-CE2 3.91Å; P660-Y947 HydrophobicContact CG-CD2 4.19Å; P660-Y947 HydrophobicContact CG-CE2 3.43Å; P660-Y947 VanDerWaalsContact CG-CE2 3.43Å; P765-Y947 WeakPolarHBondContact O-CE1 3.11Å; P765-Y947 PolarHBondContact O-OH 2.84Å; I767-Y947 HydrophobicContact CD1-CD1 3.49Å; I767-Y947 VanDerWaalsContact CD1-CD1 3.49Å; I767-Y947 HydrophobicContact CD1-CE1 3.64Å; I767-Y947 HydrophobicContact CD1-CG 4.43Å; I767-Y947 HydrophobicContact CG1-CD1 4.18Å; I767-Y947 HydrophobicContact CG1-CE1 3.91Å; L941-Y947 WeakPolarHBondContact O-CB 3.42Å; R944-Y947 HydrophobicContact CB-CD2 4.41Å; R944-Y947 PolarHBondContact O-N 3.29Å; P945-Y947 PolarHBondContact O-N 2.94Å; Y947-H960 PolarHBondContact O-ND1 2.87Å; Y947-L964 HydrophobicContact CD1-CB 4.1Å; Y947-L964 HydrophobicContact CD1-CD1 4.46Å; Y947-L964 HydrophobicContact CD2-CD1 4.36Å; Y947-L964 HydrophobicContact CE1-CB 3.8Å; Y947-L964 HydrophobicContact CE1-CD1 4.23Å; Y947-L964 HydrophobicContact CE1-CG 4.43Å; Y947-L964 HydrophobicContact CE2-CD1 4.07Å; Y947-V965 HydrophobicContact CD1-CG2 3.68Å; Y947-V965 HydrophobicContact CE1-CG2 4.41Å
948	Q	91.5	Very high	90.2	Very high	90 Å²	90	56.9 Å²	56.9	42%	0.421	34%	0.339	S	S	.	.	S	Bend	trans	-59	153.3	179.6	-84.4	179.5	17.1	0	0	111	S943 R944 P945	S943-Q948 PolarHBondContact O-NE2 2.63Å; R944-Q948 WeakPolarHBondContact O-CG 3.45Å; R944-Q948 PolarHBondContact O-N 2.83Å; P945-Q948 PolarHBondContact O-N 3.24Å
949	R	90.1	Very high	89.8	Confident	59 Å²	59	57 Å²	57	22%	0.223	34%	0.34	C	S	.	.			trans	-73.5	131.1	179.3	-148.9	-176.9	-172.1	71	16.2	109.1	G958 A959 H960 E990	R949-G958 PolarHBondContact NH2-O 2.92Å; R949-A959 CarbonylContact C-O 3.42Å; R949-A959 WeakPolarHBondContact CA-O 3.33Å; R949-A959 HydrophobicContact CG-CB 3.63Å; R949-A959 WeakPolarHBondContact CG-O 3.33Å; R949-H960 PolarHBondContact NH1-CD2 2.66Å; R949-H960 PolarHBondContact NH1-NE2 2.62Å; R949-E990 IonicContact CZ-OE1 3.83Å; R949-E990 IonicContact CZ-OE2 2.92Å; R949-E990 IonicContact NH2-OE1 3.23Å; R949-E990 PolarHBondContact NH2-OE1 2.78Å; R949-E990 IonicContact NH2-OE2 3.55Å; R949-E990 PolarHBondContact NH2-OE2 3.12Å
950	D	90.2	Very high	89.6	Confident	64 Å²	64	54.9 Å²	54.9	34%	0.342	33%	0.33	S	S	.	.			trans	-137.7	101.6	174.3	-173.3	-18.6	0	0	0	109.1	N952 A953 F954 A959	D950-N952 VanDerWaalsContact C-N 3.31Å; D950-N952 WeakPolarHBondContact OD1-CB 3.33Å; D950-N952 PolarHBondContact OD1-N 2.79Å; D950-A953 HydrophobicContact CB-CB 4.09Å; D950-A953 VanDerWaalsContact CG-CB 3.45Å; D950-A953 PolarHBondContact OD1-N 3.49Å; D950-A953 WeakPolarHBondContact OD2-CB 3.34Å; D950-F954 HydrophobicContact CB-CD2 3.99Å; D950-F954 HydrophobicContact CB-CE2 4.35Å; D950-F954 WeakPolarHBondContact O-CA 3.42Å; D950-F954 PolarHBondContact O-N 3.27Å; D950-A959 PolarHBondContact N-O 3.06Å
951	E	85.9	Confident	89.5	Confident	127 Å²	127	54.8 Å²	54.8	59%	0.593	33%	0.331	S	S	*	.	H	α-helix	trans	-68.1	-31.7	178.9	-69.6	-174.6	174.8	0	0	112.3	G955 A959	E951-G955 VanDerWaalsContact O-CA 3.24Å; E951-G955 WeakPolarHBondContact O-CA 3.48Å; E951-G955 PolarHBondContact O-N 3.34Å; E951-A959 HydrophobicContact CB-CB 4.42Å; E951-A959 HydrophobicContact CG-CB 3.72Å
952	N	88.3	Confident	89.4	Confident	163 Å²	163	55.8 Å²	55.8	87%	0.872	34%	0.338	S	S	*	.	H	α-helix	trans	-72.1	-42.5	-178.8	-64.1	-38.3	0	0	0	110.7	D950	D950-N952 VanDerWaalsContact C-N 3.31Å; D950-N952 WeakPolarHBondContact OD1-CB 3.33Å; D950-N952 PolarHBondContact OD1-N 2.79Å
953	A	88.7	Confident	89.4	Confident	59 Å²	59	56.6 Å²	56.6	49%	0.488	34%	0.342	S	S	.	.	H	α-helix	trans	-81.2	-37.6	-180	0	0	0	0	0	113	D950	D950-A953 HydrophobicContact CB-CB 4.09Å; D950-A953 VanDerWaalsContact CG-CB 3.45Å; D950-A953 PolarHBondContact OD1-N 3.49Å; D950-A953 WeakPolarHBondContact OD2-CB 3.34Å
954	F	90.2	Very high	89.6	Confident	59 Å²	59	53.3 Å²	53.3	26%	0.259	32%	0.319	S	S	.	.	H	α-helix	trans	-130	18.4	-167.2	-50.6	-63.1	0	0	0	114.7	D950 A956 C957 A959 H960 N961	D950-F954 HydrophobicContact CB-CD2 3.99Å; D950-F954 HydrophobicContact CB-CE2 4.35Å; D950-F954 WeakPolarHBondContact O-CA 3.42Å; D950-F954 PolarHBondContact O-N 3.27Å; F954-A956 PolarHBondContact O-N 3.34Å; F954-A956 VanDerWaalsContact O-N 3.1Å; F954-C957 CarbonylContact O-C 3.52Å; F954-C957 WeakPolarHBondContact O-CA 3.33Å; F954-C957 PolarHBondContact O-N 3.03Å; F954-A959 VanDerWaalsContact O-CA 3.27Å; F954-A959 WeakPolarHBondContact O-CA 3.39Å; F954-A959 PolarHBondContact O-N 3.43Å; F954-H960 WeakPolarHBondContact CB-O 3.21Å; F954-N961 HydrophobicContact CD2-CB 4.23Å; F954-N961 HydrophobicContact CE1-CB 4.15Å; F954-N961 HydrophobicContact CE2-CB 3.76Å; F954-N961 HydrophobicContact CZ-CB 3.72Å
955	G	84.2	Confident	89.7	Confident	46 Å²	46	51.1 Å²	51.1	47%	0.474	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-50.2	-38.7	-178.6	0	0	0	0	0	114	E951 C957 G958	E951-G955 VanDerWaalsContact O-CA 3.24Å; E951-G955 WeakPolarHBondContact O-CA 3.48Å; E951-G955 PolarHBondContact O-N 3.34Å; G955-C957 PolarHBondContact O-N 2.95Å; G955-G958 PolarHBondContact O-N 3.37Å
956	A	79.9	Confident	90	Very high	108 Å²	108	46.9 Å²	46.9	89%	0.893	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-65.8	-15.3	176.9	0	0	0	0	0	114.9	F954	F954-A956 PolarHBondContact O-N 3.34Å; F954-A956 VanDerWaalsContact O-N 3.1Å
957	C	80.7	Confident	90.3	Very high	66 Å²	66	46.5 Å²	46.5	45%	0.446	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-117.6	27.2	-176.4	-64.2	0	0	0	0	112.6	F954 G955 A959 P962	F954-C957 CarbonylContact O-C 3.52Å; F954-C957 WeakPolarHBondContact O-CA 3.33Å; F954-C957 PolarHBondContact O-N 3.03Å; G955-C957 PolarHBondContact O-N 2.95Å; C957-A959 VanDerWaalsContact C-N 3.35Å; C957-P962 HydrophobicContact CB-CB 4.15Å; C957-P962 HydrophobicContact CB-CG 4.21Å
958	G	81	Confident	90.3	Very high	19 Å²	19	46.5 Å²	46.5	20%	0.196	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	73	29.6	-176.7	0	0	0	0	0	113.1	R949 G955 H960	R949-G958 PolarHBondContact NH2-O 2.92Å; G955-G958 PolarHBondContact O-N 3.37Å; G958-H960 PolarHBondContact O-CD2 2.77Å; G958-H960 PolarHBondContact O-N 3.06Å; G958-H960 VanDerWaalsContact O-N 3.12Å
959	A	89.8	Confident	90.5	Very high	2 Å²	2	43 Å²	43	2%	0.017	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	60.2	18.3	174	0	0	0	0	0	115.7	R949 D950 E951 F954 C957	R949-A959 CarbonylContact C-O 3.42Å; R949-A959 WeakPolarHBondContact CA-O 3.33Å; R949-A959 HydrophobicContact CG-CB 3.63Å; R949-A959 WeakPolarHBondContact CG-O 3.33Å; D950-A959 PolarHBondContact N-O 3.06Å; E951-A959 HydrophobicContact CB-CB 4.42Å; E951-A959 HydrophobicContact CG-CB 3.72Å; F954-A959 VanDerWaalsContact O-CA 3.27Å; F954-A959 WeakPolarHBondContact O-CA 3.39Å; F954-A959 PolarHBondContact O-N 3.43Å; C957-A959 VanDerWaalsContact C-N 3.35Å
960	H	93.1	Very high	90.8	Very high	9 Å²	9	43.4 Å²	43.4	4%	0.042	27%	0.267	C	S	.	.	S	Bend	trans	-120.1	154.5	169	-66.2	-80.2	0	0	0	110.8	Y947 R949 F954 G958 P962 V965	Y947-H960 PolarHBondContact O-ND1 2.87Å; R949-H960 PolarHBondContact NH1-CD2 2.66Å; R949-H960 PolarHBondContact NH1-NE2 2.62Å; F954-H960 WeakPolarHBondContact CB-O 3.21Å; G958-H960 PolarHBondContact O-CD2 2.77Å; G958-H960 PolarHBondContact O-N 3.06Å; G958-H960 VanDerWaalsContact O-N 3.12Å; H960-P962 WeakPolarHBondContact O-CD 3.37Å; H960-P962 VanDerWaalsContact O-N 3.07Å; H960-V965 HydrophobicContact CB-CB 3.75Å; H960-V965 HydrophobicContact CB-CG1 4.07Å; H960-V965 HydrophobicContact CB-CG2 4.31Å
961	N	94.4	Very high	91.1	Very high	19 Å²	19	40.5 Å²	40.5	10%	0.102	25%	0.251	C	S	.	.			trans	-60.3	112.4	172.6	-172.9	-21.3	0	0	0	110	I663 F954 L963 L964 V965	I663-N961 WeakPolarHBondContact CD1-ND2 3.49Å; F954-N961 HydrophobicContact CD2-CB 4.23Å; F954-N961 HydrophobicContact CE1-CB 4.15Å; F954-N961 HydrophobicContact CE2-CB 3.76Å; F954-N961 HydrophobicContact CZ-CB 3.72Å; N961-L963 PolarHBondContact O-N 2.85Å; N961-L963 VanDerWaalsContact O-N 3.08Å; N961-L963 WeakPolarHBondContact OD1-CB 3.34Å; N961-L963 PolarHBondContact OD1-N 3.12Å; N961-L963 VanDerWaalsContact OD1-N 3.1Å; N961-L964 PolarHBondContact O-N 2.79Å; N961-V965 PolarHBondContact O-N 2.95Å
962	P	93.5	Very high	91.6	Very high	21 Å²	21	38.7 Å²	38.7	14%	0.136	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-11.3	-173.3	29	-36.7	0	0	0	113.7	C957 H960 L964 V965	C957-P962 HydrophobicContact CB-CB 4.15Å; C957-P962 HydrophobicContact CB-CG 4.21Å; H960-P962 WeakPolarHBondContact O-CD 3.37Å; H960-P962 VanDerWaalsContact O-N 3.07Å; P962-L964 VanDerWaalsContact C-N 3.34Å; P962-V965 WeakPolarHBondContact CA-O 3.46Å
963	L	94	Very high	91.9	Very high	45 Å²	45	32 Å²	32	24%	0.236	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.8	-25.2	173	-65.1	171.2	0	0	0	112.6	L665 Y766 N961	L665-L963 HydrophobicContact CD2-CD1 4.11Å; L665-L963 HydrophobicContact CD2-CD2 4.5Å; Y766-L963 WeakPolarHBondContact CD2-O 3.45Å; N961-L963 PolarHBondContact O-N 2.85Å; N961-L963 VanDerWaalsContact O-N 3.08Å; N961-L963 WeakPolarHBondContact OD1-CB 3.34Å; N961-L963 PolarHBondContact OD1-N 3.12Å; N961-L963 VanDerWaalsContact OD1-N 3.1Å
964	L	95.6	Very high	92.2	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-32.3	-174.6	-64.8	-178.8	0	0	0	113.1	I663 C761 L764 I767 A946 Y947 N961 P962	I663-L964 HydrophobicContact CD1-CD1 3.51Å; I663-L964 HydrophobicContact CD1-CG 4Å; I663-L964 HydrophobicContact CG1-CD1 3.92Å; I663-L964 HydrophobicContact CG1-CG 4.5Å; C761-L964 HydrophobicContact CB-CD2 3.84Å; L764-L964 HydrophobicContact CB-CD2 4.21Å; L764-L964 HydrophobicContact CD2-CD2 3.95Å; I767-L964 PolarHBondContact N-O 3.33Å; A946-L964 HydrophobicContact CB-CD1 4.11Å; A946-L964 WeakPolarHBondContact O-CD1 3.21Å; Y947-L964 HydrophobicContact CD1-CB 4.1Å; Y947-L964 HydrophobicContact CD1-CD1 4.46Å; Y947-L964 HydrophobicContact CD2-CD1 4.36Å; Y947-L964 HydrophobicContact CE1-CB 3.8Å; Y947-L964 HydrophobicContact CE1-CD1 4.23Å; Y947-L964 HydrophobicContact CE1-CG 4.43Å; Y947-L964 HydrophobicContact CE2-CD1 4.07Å; N961-L964 PolarHBondContact O-N 2.79Å; P962-L964 VanDerWaalsContact C-N 3.34Å
965	V	96.7	Very high	92.5	Very high	3 Å²	3	28 Å²	28	2%	0.018	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	135.6	-174.9	-172	0	0	0	0	109.9	I767 F769 Y947 H960 N961 P962	I767-V965 HydrophobicContact CB-CG1 4.37Å; I767-V965 HydrophobicContact CB-CG2 4.22Å; I767-V965 HydrophobicContact CG2-CG1 4.24Å; I767-V965 VanDerWaalsContact O-CA 3.32Å; I767-V965 WeakPolarHBondContact O-CA 3.42Å; F769-V965 HydrophobicContact CB-CG1 4.09Å; Y947-V965 HydrophobicContact CD1-CG2 3.68Å; Y947-V965 HydrophobicContact CE1-CG2 4.41Å; H960-V965 HydrophobicContact CB-CB 3.75Å; H960-V965 HydrophobicContact CB-CG1 4.07Å; H960-V965 HydrophobicContact CB-CG2 4.31Å; N961-V965 PolarHBondContact O-N 2.95Å; P962-V965 WeakPolarHBondContact CA-O 3.46Å
966	T	96.7	Very high	93.1	Very high	7 Å²	7	31.9 Å²	31.9	4%	0.043	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	120.5	163.1	-69	0	0	0	0	109.9	N748 A752 Y766 I767 F769	N748-T966 HydrophobicContact CB-CG2 4.44Å; N748-T966 WeakPolarHBondContact O-CG2 3.27Å; A752-T966 HydrophobicContact CB-CG2 3.89Å; Y766-T966 WeakPolarHBondContact OH-CB 3.26Å; Y766-T966 PolarHBondContact OH-OG1 3.1Å; I767-T966 PolarHBondContact O-N 2.83Å; F769-T966 PolarHBondContact N-O 3.42Å
967	K	96.1	Very high	93.9	Very high	10 Å²	10	27.1 Å²	27.1	4%	0.043	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	123.6	177.1	-173.2	-179.5	175	-170.3	0	110.1	N748 F769 V969 Y987 E990	N748-K967 PolarHBondContact ND2-O 3.05Å; F769-K967 HydrophobicContact CB-CB 4.39Å; F769-K967 HydrophobicContact CD1-CB 4.22Å; F769-K967 HydrophobicContact CD1-CD 4.04Å; F769-K967 HydrophobicContact CD1-CG 3.87Å; F769-K967 HydrophobicContact CE1-CD 4.07Å; F769-K967 HydrophobicContact CE1-CG 4.31Å; F769-K967 HydrophobicContact CG-CG 4.2Å; F769-K967 CarbonylContact O-C 3.53Å; F769-K967 VanDerWaalsContact O-CA 3.3Å; F769-K967 WeakPolarHBondContact O-CA 3.49Å; K967-V969 HydrophobicContact CG-CG1 4.44Å; K967-Y987 PolarHBondContact NZ-O 3.32Å; K967-E990 WeakPolarHBondContact CD-OE2 3.3Å; K967-E990 WeakPolarHBondContact CE-OE2 3.5Å; K967-E990 IonicContact NZ-OE2 3.96Å; K967-E990 PolarHBondContact NZ-OE2 3.15Å
968	L	96.5	Very high	94.7	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.122	C	C	.	.			trans	-80.4	122.3	171.6	-55.1	-176.8	0	0	0	108.9	N748 Q749 L768 F769 P771 T774 K776	N748-L968 HydrophobicContact CB-CD2 4.19Å; Q749-L968 HydrophobicContact CG-CD2 3.82Å; L768-L968 HydrophobicContact CD1-CD1 4.05Å; L768-L968 HydrophobicContact CD1-CD2 3.9Å; L768-L968 HydrophobicContact CD1-CG 3.88Å; L768-L968 HydrophobicContact CG-CD1 4.42Å; F769-L968 PolarHBondContact O-N 3.02Å; P771-L968 VanDerWaalsContact CD-O 3.3Å; P771-L968 WeakPolarHBondContact CD-O 3.3Å; T774-L968 HydrophobicContact CG2-CB 4.39Å; T774-L968 WeakPolarHBondContact CG2-O 3.14Å; K776-L968 HydrophobicContact CG-CD1 4.42Å
969	V	95.4	Very high	95.4	Very high	17 Å²	17	23.8 Å²	23.8	10%	0.103	11%	0.114	C	C	.	.			trans	-106.8	-30.9	-172.6	-57.8	0	0	0	0	113.3	N748 K967 N971 L991 E992	N748-V969 VanDerWaalsContact ND2-CG2 3.3Å; N748-V969 WeakPolarHBondContact ND2-CG2 3.48Å; K967-V969 HydrophobicContact CG-CG1 4.44Å; V969-N971 PolarHBondContact O-N 2.88Å; V969-L991 WeakPolarHBondContact O-CA 3.27Å; V969-E992 PolarHBondContact O-N 2.87Å
970	K	96.7	Very high	95.8	Very high	67 Å²	67	28.2 Å²	28.2	29%	0.291	14%	0.135	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75	113.9	-178.9	-64.6	-169.3	177.2	-168.7	0	110.8	N746 T774 Y972 C994	N746-K970 HydrophobicContact CB-CD 3.77Å; T774-K970 VanDerWaalsContact CA-O 3.27Å; T774-K970 WeakPolarHBondContact CA-O 3.49Å; K970-Y972 HydrophobicContact CB-CE2 3.99Å; K970-Y972 WeakPolarHBondContact O-CD2 3.4Å; K970-Y972 WeakPolarHBondContact O-CE2 3.42Å; K970-C994 HydrophobicContact CB-CB 4.26Å
971	N	96.7	Very high	95.9	Very high	2 Å²	2	28 Å²	28	1%	0.011	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	122.6	178.2	-180	-75	0	0	0	110.5	P772 V969 R973 S974 L979 E992 C994 A995	P772-N971 PolarHBondContact O-ND2 2.88Å; V969-N971 PolarHBondContact O-N 2.88Å; N971-R973 PolarHBondContact OD1-N 3.42Å; N971-S974 PolarHBondContact OD1-N 3.23Å; N971-L979 HydrophobicContact CB-CD1 4.07Å; N971-L979 HydrophobicContact CB-CD2 3.6Å; N971-E992 WeakPolarHBondContact CB-O 3.48Å; N971-E992 PolarHBondContact N-O 3.43Å; N971-C994 CarbonylContact O-C 3.41Å; N971-C994 WeakPolarHBondContact O-CA 3.25Å; N971-C994 PolarHBondContact O-N 3.16Å; N971-A995 PolarHBondContact O-N 2.72Å; N971-A995 VanDerWaalsContact O-N 3.14Å
972	Y	95.7	Very high	96	Very high	89 Å²	89	27.1 Å²	27.1	35%	0.349	13%	0.13	S	C	.	.	S	Bend	trans	-102.3	10.3	-178.1	-59.9	-84.3	0	0	0	113.4	N746 G773 K970 C994 A995	N746-Y972 PolarHBondContact ND2-OH 3.12Å; G773-Y972 PolarHBondContact O-N 3.37Å; K970-Y972 HydrophobicContact CB-CE2 3.99Å; K970-Y972 WeakPolarHBondContact O-CD2 3.4Å; K970-Y972 WeakPolarHBondContact O-CE2 3.42Å; Y972-C994 HydrophobicContact CD1-CB 3.77Å; Y972-C994 VanDerWaalsContact CD1-O 3.29Å; Y972-C994 WeakPolarHBondContact CD1-O 3.22Å; Y972-C994 HydrophobicContact CE1-CB 3.65Å; Y972-C994 HydrophobicContact CG-CB 4.48Å; Y972-A995 VanDerWaalsContact C-CB 3.48Å
973	R	94.8	Very high	96.1	Very high	23 Å²	23	26.4 Å²	26.4	9%	0.087	13%	0.125	C	C	.	.	S	Bend	trans	-106.9	-52.6	-169.9	178.5	-174	-68.6	-175.9	-11	113.3	N971 E1100 T1137 R1138 K1140	N971-R973 PolarHBondContact OD1-N 3.42Å; R973-E1100 IonicContact CZ-OE2 2.86Å; R973-E1100 IonicContact NE-OE2 3.89Å; R973-E1100 PolarHBondContact NE-OE2 3.46Å; R973-E1100 IonicContact NH2-OE2 3.34Å; R973-E1100 PolarHBondContact NH2-OE2 3.15Å; R973-T1137 VanDerWaalsContact CD-O 3.24Å; R973-T1137 WeakPolarHBondContact CD-O 3.27Å; R973-T1137 PolarHBondContact NH1-O 2.97Å; R973-R1138 VanDerWaalsContact NH1-NH1 3.11Å; R973-K1140 HydrophobicContact CG-CG 4.06Å; R973-K1140 WeakPolarHBondContact O-CA 3.49Å; R973-K1140 WeakPolarHBondContact O-CB 3.47Å
974	S	95.6	Very high	96.1	Very high	4 Å²	4	26.2 Å²	26.2	3%	0.028	12%	0.122	C	C	.	.	S	Bend	trans	-115.2	150.4	-157.5	-60.5	0	0	0	0	112.4	N971 P1139	N971-S974 PolarHBondContact OD1-N 3.23Å; S974-P1139 PolarHBondContact OG-O 2.86Å
975	H	96.7	Very high	95.9	Very high	29 Å²	29	27 Å²	27	13%	0.134	13%	0.126	C	C	.	.			trans	-58.6	150.3	169.2	-169.3	-88.3	0	0	0	112.2	A977 L978 L979 V1000 P1015 K1140	H975-A977 PolarHBondContact ND1-N 2.95Å; H975-A977 VanDerWaalsContact ND1-N 3.18Å; H975-A977 PolarHBondContact O-N 3.36Å; H975-L978 HydrophobicContact CB-CD1 4.29Å; H975-L978 HydrophobicContact CB-CG 4.34Å; H975-L978 WeakPolarHBondContact O-CA 3.42Å; H975-L978 WeakPolarHBondContact O-CB 3.46Å; H975-L978 PolarHBondContact O-N 3.42Å; H975-L979 PolarHBondContact O-N 3.08Å; H975-V1000 HydrophobicContact CB-CB 4.01Å; H975-V1000 PolarHBondContact CD2-O 3.33Å; H975-P1015 HydrophobicContact CB-CG 3.91Å; H975-P1015 WeakPolarHBondContact ND1-CG 3.07Å; H975-K1140 PolarHBondContact N-O 2.82Å; H975-K1140 VanDerWaalsContact N-O 3.13Å
976	E	96.1	Very high	95.8	Very high	128 Å²	128	27.3 Å²	27.3	60%	0.598	13%	0.127	S	C	*	.	H	α-helix	trans	-52.5	-50.3	-179.1	-173.3	177.3	-176.4	0	0	113.7	L978 L979 M980 V993	E976-L978 PolarHBondContact O-N 3.06Å; E976-L979 PolarHBondContact O-N 3.16Å; E976-L979 VanDerWaalsContact O-N 3.08Å; E976-M980 PolarHBondContact O-N 3.34Å; E976-V993 HydrophobicContact CB-CG2 3.74Å; E976-V993 HydrophobicContact CG-CG2 3.95Å
977	A	96.5	Very high	95.7	Very high	8 Å²	8	27 Å²	27	7%	0.066	13%	0.125	C	C	.	.	H	α-helix	trans	-57.1	-30.1	176.5	0	0	0	0	0	113.9	H975 F1014 P1015 Y1164	H975-A977 PolarHBondContact ND1-N 2.95Å; H975-A977 VanDerWaalsContact ND1-N 3.18Å; H975-A977 PolarHBondContact O-N 3.36Å; A977-F1014 HydrophobicContact CB-CD1 4.34Å; A977-F1014 HydrophobicContact CB-CD2 4.39Å; A977-F1014 HydrophobicContact CB-CE1 3.99Å; A977-F1014 HydrophobicContact CB-CE2 4.03Å; A977-F1014 HydrophobicContact CB-CZ 3.84Å; A977-P1015 HydrophobicContact CB-CG 4.2Å; A977-Y1164 WeakPolarHBondContact O-CE1 3.46Å; A977-Y1164 PolarHBondContact O-OH 3.46Å
978	L	97.1	Very high	95.4	Very high	9 Å²	9	31 Å²	31	5%	0.047	14%	0.143	C	C	.	.	H	α-helix	trans	-82.9	-32.2	177.6	-63	179.1	0	0	0	111.8	H975 E976 P982 P1015 L1016 P1139 L1143	H975-L978 HydrophobicContact CB-CD1 4.29Å; H975-L978 HydrophobicContact CB-CG 4.34Å; H975-L978 WeakPolarHBondContact O-CA 3.42Å; H975-L978 WeakPolarHBondContact O-CB 3.46Å; H975-L978 PolarHBondContact O-N 3.42Å; E976-L978 PolarHBondContact O-N 3.06Å; L978-P982 WeakPolarHBondContact O-CD 3.37Å; L978-P982 WeakPolarHBondContact O-CG 3.45Å; L978-P1015 HydrophobicContact CD1-CG 4.47Å; L978-P1015 WeakPolarHBondContact CD2-O 3.48Å; L978-P1015 HydrophobicContact CG-CG 4.18Å; L978-L1016 HydrophobicContact CD2-CB 4.33Å; L978-L1016 HydrophobicContact CD2-CD1 4.5Å; L978-P1139 HydrophobicContact CD1-CB 4.19Å; L978-P1139 HydrophobicContact CD1-CG 4.13Å; L978-L1143 HydrophobicContact CD2-CB 3.55Å; L978-L1143 HydrophobicContact CD2-CD2 4.31Å
979	L	96.9	Very high	95.2	Very high	6 Å²	6	38.1 Å²	38.1	3%	0.031	17%	0.17	C	C	.	.	H	α-helix	trans	-78.7	-29.2	-179.3	-170.1	64.8	0	0	0	113	N971 H975 E976 L981 P982 S983 L991 V993	N971-L979 HydrophobicContact CB-CD1 4.07Å; N971-L979 HydrophobicContact CB-CD2 3.6Å; H975-L979 PolarHBondContact O-N 3.08Å; E976-L979 PolarHBondContact O-N 3.16Å; E976-L979 VanDerWaalsContact O-N 3.08Å; L979-L981 PolarHBondContact O-N 2.77Å; L979-P982 VanDerWaalsContact O-CD 3.26Å; L979-P982 WeakPolarHBondContact O-CD 3.37Å; L979-P982 WeakPolarHBondContact O-CG 3.29Å; L979-S983 WeakPolarHBondContact O-CB 3.41Å; L979-S983 PolarHBondContact O-N 3Å; L979-L991 HydrophobicContact CD1-CB 4.15Å; L979-L991 HydrophobicContact CD1-CD1 3.68Å; L979-L991 HydrophobicContact CD2-CB 3.91Å; L979-L991 HydrophobicContact CG-CB 4.07Å; L979-L991 HydrophobicContact CG-CD1 4.42Å; L979-V993 HydrophobicContact CB-CG2 4.42Å; L979-V993 HydrophobicContact CD2-CG2 3.63Å
980	M	96.4	Very high	95	Very high	95 Å²	95	39.5 Å²	39.5	47%	0.468	18%	0.176	S	C	.	.	H	α-helix	trans	-55.2	-48.8	-173.1	-171.1	-164.3	-63.5	0	0	113	E976 R984 Y1164	E976-M980 PolarHBondContact O-N 3.34Å; M980-R984 WeakPolarHBondContact O-CB 3.37Å; M980-R984 PolarHBondContact O-N 2.95Å; M980-Y1164 HydrophobicContact CE-CE2 4.31Å; M980-Y1164 HydrophobicContact SD-CD2 4.45Å; M980-Y1164 HydrophobicContact SD-CE2 3.4Å; M980-Y1164 WeakPolarHBondContact SD-CE2 3.43Å
981	L	95.6	Very high	95	Very high	5 Å²	5	37 Å²	37	3%	0.026	17%	0.166	C	C	.	.	H	α-helix	trans	-67.1	-54	-178.3	-177.1	66.8	0	0	0	113.5	L979 S983 R984 L985 F1132 I1136 A1160 L1161 Y1164	L979-L981 PolarHBondContact O-N 2.77Å; L981-S983 VanDerWaalsContact C-N 3.28Å; L981-S983 PolarHBondContact O-N 2.91Å; L981-R984 VanDerWaalsContact CD1-NH2 3.26Å; L981-R984 PolarHBondContact O-N 2.7Å; L981-L985 HydrophobicContact CD1-CD1 3.79Å; L981-L985 HydrophobicContact CD1-CG 3.99Å; L981-L985 HydrophobicContact CD2-CD1 4.45Å; L981-L985 HydrophobicContact CG-CD1 3.86Å; L981-L985 HydrophobicContact CG-CG 4.35Å; L981-L985 WeakPolarHBondContact O-CG 3.2Å; L981-L985 PolarHBondContact O-N 3.03Å; L981-F1132 HydrophobicContact CD2-CZ 4.43Å; L981-I1136 HydrophobicContact CD2-CD1 4.49Å; L981-A1160 HydrophobicContact CD1-CB 4.21Å; L981-L1161 HydrophobicContact CD2-CB 3.76Å; L981-L1161 HydrophobicContact CD2-CD1 3.55Å; L981-L1161 HydrophobicContact CD2-CG 4.25Å; L981-Y1164 HydrophobicContact CB-CD1 4.41Å
982	P	96.3	Very high	94.9	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	19%	0.187	C	C	.	.	H	α-helix	trans	-63	-36.1	177.5	22	-30.5	0	0	0	111.9	L978 L979 R984 L985 F986 Y987 I1136 T1137	L978-P982 WeakPolarHBondContact O-CD 3.37Å; L978-P982 WeakPolarHBondContact O-CG 3.45Å; L979-P982 VanDerWaalsContact O-CD 3.26Å; L979-P982 WeakPolarHBondContact O-CD 3.37Å; L979-P982 WeakPolarHBondContact O-CG 3.29Å; P982-R984 VanDerWaalsContact C-N 3.32Å; P982-R984 PolarHBondContact O-N 3.44Å; P982-L985 PolarHBondContact O-N 3.34Å; P982-F986 HydrophobicContact CB-CD2 4.34Å; P982-F986 PolarHBondContact O-N 3.26Å; P982-Y987 WeakPolarHBondContact O-CD2 3.28Å; P982-I1136 HydrophobicContact CB-CD1 3.87Å; P982-I1136 HydrophobicContact CB-CG1 4.35Å; P982-I1136 HydrophobicContact CG-CD1 4.1Å; P982-T1137 HydrophobicContact CB-CG2 3.7Å; P982-T1137 HydrophobicContact CG-CG2 3.88Å
983	S	96.1	Very high	94.9	Very high	6 Å²	6	40.3 Å²	40.3	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-56.3	-47.5	173.1	-173.1	0	0	0	0	111	L979 L981 Y987 H988 R989 E990 L991	L979-S983 WeakPolarHBondContact O-CB 3.41Å; L979-S983 PolarHBondContact O-N 3Å; L981-S983 VanDerWaalsContact C-N 3.28Å; L981-S983 PolarHBondContact O-N 2.91Å; S983-Y987 CarbonylContact O-C 3.55Å; S983-Y987 WeakPolarHBondContact O-CA 3.44Å; S983-Y987 PolarHBondContact O-N 2.9Å; S983-H988 PolarHBondContact O-N 2.7Å; S983-R989 PolarHBondContact O-N 2.81Å; S983-R989 VanDerWaalsContact OG-C 3.28Å; S983-R989 VanDerWaalsContact OG-CA 3.31Å; S983-R989 WeakPolarHBondContact OG-CA 3.34Å; S983-E990 PolarHBondContact OG-N 2.95Å; S983-L991 WeakPolarHBondContact OG-CB 3.38Å; S983-L991 PolarHBondContact OG-N 3.14Å
984	R	93.2	Very high	95	Very high	41 Å²	41	41.5 Å²	41.5	16%	0.155	20%	0.2	C	C	.	.	H	α-helix	trans	-63.1	-50.2	175.8	179.4	175.6	66.3	152	-0.9	113.2	M980 L981 P982 R989	M980-R984 WeakPolarHBondContact O-CB 3.37Å; M980-R984 PolarHBondContact O-N 2.95Å; L981-R984 VanDerWaalsContact CD1-NH2 3.26Å; L981-R984 PolarHBondContact O-N 2.7Å; P982-R984 VanDerWaalsContact C-N 3.32Å; P982-R984 PolarHBondContact O-N 3.44Å; R984-R989 HydrophobicContact CB-CG 3.95Å; R984-R989 HydrophobicContact CG-CG 4.1Å
985	L	92.3	Very high	94.9	Very high	18 Å²	18	41.7 Å²	41.7	9%	0.094	20%	0.201	C	C	.	.	H	α-helix	trans	-74.8	-35.6	-170.6	-68.3	178.1	0	0	0	114	L981 P982 F1132 A1160	L981-L985 HydrophobicContact CD1-CD1 3.79Å; L981-L985 HydrophobicContact CD1-CG 3.99Å; L981-L985 HydrophobicContact CD2-CD1 4.45Å; L981-L985 HydrophobicContact CG-CD1 3.86Å; L981-L985 HydrophobicContact CG-CG 4.35Å; L981-L985 WeakPolarHBondContact O-CG 3.2Å; L981-L985 PolarHBondContact O-N 3.03Å; P982-L985 PolarHBondContact O-N 3.34Å; L985-F1132 HydrophobicContact CD1-CE1 3.96Å; L985-A1160 HydrophobicContact CD1-CB 4.19Å; L985-A1160 HydrophobicContact CD2-CB 4.01Å
986	F	93.9	Very high	94.8	Very high	8 Å²	8	44.4 Å²	44.4	4%	0.035	22%	0.217	C	C	.	.	H	α-helix	trans	-118.4	-21.1	-169.8	-59.8	-77.1	0	0	0	113.6	C234 M917 P982 S1129 F1132 N1133	C234-F986 HydrophobicContact CB-CD1 4.26Å; C234-F986 HydrophobicContact CB-CE1 3.72Å; C234-F986 HydrophobicContact CB-CZ 4.37Å; M917-F986 HydrophobicContact CB-CB 4.22Å; M917-F986 HydrophobicContact CB-CD1 4.32Å; M917-F986 HydrophobicContact CG-CB 4.42Å; P982-F986 HydrophobicContact CB-CD2 4.34Å; P982-F986 PolarHBondContact O-N 3.26Å; F986-S1129 WeakPolarHBondContact CZ-O 3.47Å; F986-F1132 AromaticContact CE2-CD1 3.86Å; F986-F1132 HydrophobicContact CE2-CD1 3.86Å; F986-F1132 HydrophobicContact CE2-CE1 4.11Å; F986-F1132 AromaticContact CZ-CD1 3.85Å; F986-F1132 HydrophobicContact CZ-CD1 3.85Å; F986-F1132 HydrophobicContact CZ-CE1 4.44Å; F986-N1133 HydrophobicContact CD1-CB 4.18Å; F986-N1133 HydrophobicContact CD2-CB 3.8Å; F986-N1133 VanDerWaalsContact CD2-CG 3.43Å; F986-N1133 WeakPolarHBondContact CD2-OD1 2.87Å; F986-N1133 HydrophobicContact CE1-CB 3.95Å; F986-N1133 HydrophobicContact CE2-CB 3.57Å; F986-N1133 HydrophobicContact CG-CB 4.12Å; F986-N1133 HydrophobicContact CZ-CB 3.66Å
987	Y	94.2	Very high	94.8	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.215	C	C	.	.	S	Bend	trans	-130.4	22.4	-167.8	-51.1	-70	0	0	0	113.8	F769 P771 P772 D915 M917 K967 P982 S983 R989 E990 L991 N1133	F769-Y987 HydrophobicContact CE2-CD1 4.37Å; F769-Y987 HydrophobicContact CE2-CE1 4.06Å; F769-Y987 AromaticContact CZ-CD1 3.94Å; F769-Y987 HydrophobicContact CZ-CD1 3.94Å; F769-Y987 AromaticContact CZ-CE1 4Å; F769-Y987 HydrophobicContact CZ-CE1 4Å; P771-Y987 HydrophobicContact CB-CD1 3.94Å; P771-Y987 HydrophobicContact CB-CE1 3.65Å; P771-Y987 HydrophobicContact CB-CE2 4.31Å; P771-Y987 HydrophobicContact CB-CG 4.37Å; P771-Y987 HydrophobicContact CG-CD1 3.68Å; P771-Y987 HydrophobicContact CG-CE1 3.72Å; P771-Y987 HydrophobicContact CG-CG 4.35Å; P772-Y987 WeakPolarHBondContact CD-OH 3.37Å; D915-Y987 PolarHBondContact OD2-OH 3.04Å; M917-Y987 HydrophobicContact CB-CE1 4.12Å; M917-Y987 HydrophobicContact CG-CE1 4.36Å; K967-Y987 PolarHBondContact NZ-O 3.32Å; P982-Y987 WeakPolarHBondContact O-CD2 3.28Å; S983-Y987 CarbonylContact O-C 3.55Å; S983-Y987 WeakPolarHBondContact O-CA 3.44Å; S983-Y987 PolarHBondContact O-N 2.9Å; Y987-R989 PolarHBondContact O-N 2.84Å; Y987-E990 WeakPolarHBondContact O-CB 3.48Å; Y987-E990 PolarHBondContact O-N 2.78Å; Y987-L991 HydrophobicContact CD2-CD1 3.47Å; Y987-L991 VanDerWaalsContact CD2-CD1 3.47Å; Y987-L991 HydrophobicContact CD2-CG 4.12Å; Y987-L991 HydrophobicContact CE2-CD1 4.05Å; Y987-L991 HydrophobicContact CG-CD1 3.94Å; Y987-L991 HydrophobicContact CG-CD2 4.25Å; Y987-L991 HydrophobicContact CG-CG 4.13Å; Y987-N1133 PolarHBondContact OH-ND2 2.91Å
988	H	91	Very high	94.6	Very high	94 Å²	94	46.7 Å²	46.7	44%	0.435	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.1	28.4	171.4	-50	75.6	0	0	0	113.9	S983 E990	S983-H988 PolarHBondContact O-N 2.7Å; H988-E990 HydrophobicContact CB-CG 4.29Å; H988-E990 PolarHBondContact O-N 2.62Å
989	R	91.3	Very high	94.5	Very high	150 Å²	150	48.9 Å²	48.9	57%	0.566	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	18.1	-177.9	-51.4	172	176.2	-150.8	-0.6	114.7	E200 S983 R984 Y987	E200-R989 VanDerWaalsContact CD-NH2 3.35Å; E200-R989 IonicContact OE1-CZ 2.67Å; E200-R989 IonicContact OE1-NH2 2.9Å; E200-R989 PolarHBondContact OE1-NH2 2.85Å; S983-R989 PolarHBondContact O-N 2.81Å; S983-R989 VanDerWaalsContact OG-C 3.28Å; S983-R989 VanDerWaalsContact OG-CA 3.31Å; S983-R989 WeakPolarHBondContact OG-CA 3.34Å; R984-R989 HydrophobicContact CB-CG 3.95Å; R984-R989 HydrophobicContact CG-CG 4.1Å; Y987-R989 PolarHBondContact O-N 2.84Å
990	E	92.6	Very high	94.4	Very high	46 Å²	46	49 Å²	49	22%	0.215	26%	0.255	C	S	.	.			trans	-89.6	-10.7	-174	-64.9	176.2	-177.9	0	0	114.1	R949 K967 S983 Y987 H988 E992	R949-E990 IonicContact CZ-OE1 3.83Å; R949-E990 IonicContact CZ-OE2 2.92Å; R949-E990 IonicContact NH2-OE1 3.23Å; R949-E990 PolarHBondContact NH2-OE1 2.78Å; R949-E990 IonicContact NH2-OE2 3.55Å; R949-E990 PolarHBondContact NH2-OE2 3.12Å; K967-E990 WeakPolarHBondContact CD-OE2 3.3Å; K967-E990 WeakPolarHBondContact CE-OE2 3.5Å; K967-E990 IonicContact NZ-OE2 3.96Å; K967-E990 PolarHBondContact NZ-OE2 3.15Å; S983-E990 PolarHBondContact OG-N 2.95Å; Y987-E990 WeakPolarHBondContact O-CB 3.48Å; Y987-E990 PolarHBondContact O-N 2.78Å; H988-E990 HydrophobicContact CB-CG 4.29Å; H988-E990 PolarHBondContact O-N 2.62Å; E990-E992 PolarHBondContact O-N 2.86Å
991	L	95.5	Very high	94.3	Very high	16 Å²	16	47.4 Å²	47.4	8%	0.084	25%	0.25	C	S	.	.			trans	-72.3	131	-178.6	-54.1	-174	0	0	0	111.3	P771 V969 L979 S983 Y987	P771-L991 HydrophobicContact CB-CD1 4.22Å; P771-L991 HydrophobicContact CB-CD2 3.83Å; P771-L991 HydrophobicContact CG-CD2 3.81Å; V969-L991 WeakPolarHBondContact O-CA 3.27Å; L979-L991 HydrophobicContact CD1-CB 4.15Å; L979-L991 HydrophobicContact CD1-CD1 3.68Å; L979-L991 HydrophobicContact CD2-CB 3.91Å; L979-L991 HydrophobicContact CG-CB 4.07Å; L979-L991 HydrophobicContact CG-CD1 4.42Å; S983-L991 WeakPolarHBondContact OG-CB 3.38Å; S983-L991 PolarHBondContact OG-N 3.14Å; Y987-L991 HydrophobicContact CD2-CD1 3.47Å; Y987-L991 VanDerWaalsContact CD2-CD1 3.47Å; Y987-L991 HydrophobicContact CD2-CG 4.12Å; Y987-L991 HydrophobicContact CE2-CD1 4.05Å; Y987-L991 HydrophobicContact CG-CD1 3.94Å; Y987-L991 HydrophobicContact CG-CD2 4.25Å; Y987-L991 HydrophobicContact CG-CG 4.13Å
992	E	95.8	Very high	94.2	Very high	98 Å²	98	49.7 Å²	49.7	46%	0.458	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	138.8	-179.9	-66.2	175	-169.1	0	0	110.5	V969 N971 E990 C994	V969-E992 PolarHBondContact O-N 2.87Å; N971-E992 WeakPolarHBondContact CB-O 3.48Å; N971-E992 PolarHBondContact N-O 3.43Å; E990-E992 PolarHBondContact O-N 2.86Å; E992-C994 PolarHBondContact O-N 3.18Å
993	V	95.9	Very high	94	Very high	62 Å²	62	49.9 Å²	49.9	38%	0.376	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	122	179.2	-175.5	0	0	0	0	109.9	E976 L979	E976-V993 HydrophobicContact CB-CG2 3.74Å; E976-V993 HydrophobicContact CG-CG2 3.95Å; L979-V993 HydrophobicContact CB-CG2 4.42Å; L979-V993 HydrophobicContact CD2-CG2 3.63Å
994	C	96	Very high	93.9	Very high	48 Å²	48	51.1 Å²	51.1	32%	0.324	27%	0.274	S	S	.	.			trans	-135.2	15.7	175.4	-69.5	0	0	0	0	111.6	K970 N971 Y972 E992	K970-C994 HydrophobicContact CB-CB 4.26Å; N971-C994 CarbonylContact O-C 3.41Å; N971-C994 WeakPolarHBondContact O-CA 3.25Å; N971-C994 PolarHBondContact O-N 3.16Å; Y972-C994 HydrophobicContact CD1-CB 3.77Å; Y972-C994 VanDerWaalsContact CD1-O 3.29Å; Y972-C994 WeakPolarHBondContact CD1-O 3.22Å; Y972-C994 HydrophobicContact CE1-CB 3.65Å; Y972-C994 HydrophobicContact CG-CB 4.48Å; E992-C994 PolarHBondContact O-N 3.18Å
995	A	94	Very high	93.6	Very high	8 Å²	8	51.9 Å²	51.9	7%	0.066	29%	0.294	C	S	.	.	S	Bend	trans	-67.6	152.1	177.6	0	0	0	0	0	111.1	N971 Y972 P997 V1000	N971-A995 PolarHBondContact O-N 2.72Å; N971-A995 VanDerWaalsContact O-N 3.14Å; Y972-A995 VanDerWaalsContact C-CB 3.48Å; A995-P997 WeakPolarHBondContact O-CD 3.45Å; A995-P997 VanDerWaalsContact O-N 3.15Å; A995-V1000 HydrophobicContact CB-CG1 3.54Å
996	D	95	Very high	93.6	Very high	86 Å²	86	51 Å²	51	46%	0.46	29%	0.29	S	S	.	.			trans	-60.1	115.4	176.7	-174.8	-19.6	0	0	0	110.2	T998 V999 V1000	D996-T998 PolarHBondContact O-N 2.8Å; D996-T998 VanDerWaalsContact O-N 3.17Å; D996-T998 WeakPolarHBondContact OD1-CB 3.49Å; D996-T998 WeakPolarHBondContact OD1-CG2 3.3Å; D996-T998 PolarHBondContact OD1-N 3.48Å; D996-T998 PolarHBondContact OD1-OG1 3.11Å; D996-T998 PolarHBondContact OD2-OG1 3.37Å; D996-T998 VanDerWaalsContact OD2-OG1 3.12Å; D996-V999 HydrophobicContact CB-CB 4.47Å; D996-V999 HydrophobicContact CB-CG2 4.16Å; D996-V999 PolarHBondContact O-N 3.43Å; D996-V999 VanDerWaalsContact O-N 3.1Å; D996-V1000 WeakPolarHBondContact O-CG2 3.36Å; D996-V1000 PolarHBondContact O-N 2.92Å; D996-V1000 VanDerWaalsContact O-N 3.12Å
997	P	94.9	Very high	93.3	Very high	85 Å²	85	56 Å²	56	55%	0.552	31%	0.313	S	S	*	.	H	α-helix	trans	-55.9	-33.5	-179.9	-26.2	36.1	0	0	0	112.7	A995 V999 T1001	A995-P997 WeakPolarHBondContact O-CD 3.45Å; A995-P997 VanDerWaalsContact O-N 3.15Å; P997-V999 VanDerWaalsContact C-N 3.28Å; P997-V999 PolarHBondContact O-N 2.89Å; P997-T1001 VanDerWaalsContact O-CB 3.26Å; P997-T1001 WeakPolarHBondContact O-CB 3.3Å; P997-T1001 VanDerWaalsContact O-CG2 3.28Å; P997-T1001 WeakPolarHBondContact O-CG2 3.39Å; P997-T1001 PolarHBondContact O-N 3.4Å; P997-T1001 PolarHBondContact O-OG1 3.27Å
998	T	93.6	Very high	93	Very high	99 Å²	99	60.1 Å²	60.1	61%	0.607	33%	0.331	S	S	*	.	H	α-helix	trans	-63.8	-35.4	-178.6	66	0	0	0	0	112	D996	D996-T998 PolarHBondContact O-N 2.8Å; D996-T998 VanDerWaalsContact O-N 3.17Å; D996-T998 WeakPolarHBondContact OD1-CB 3.49Å; D996-T998 WeakPolarHBondContact OD1-CG2 3.3Å; D996-T998 PolarHBondContact OD1-N 3.48Å; D996-T998 PolarHBondContact OD1-OG1 3.11Å; D996-T998 PolarHBondContact OD2-OG1 3.37Å; D996-T998 VanDerWaalsContact OD2-OG1 3.12Å
999	V	94.2	Very high	93.1	Very high	54 Å²	54	56 Å²	56	33%	0.327	31%	0.312	S	S	.	.	H	α-helix	trans	-80.5	-52.5	179.1	-179.5	0	0	0	0	110.4	D996 P997 T1001 S1002 L1102 K1140 A1141	D996-V999 HydrophobicContact CB-CB 4.47Å; D996-V999 HydrophobicContact CB-CG2 4.16Å; D996-V999 PolarHBondContact O-N 3.43Å; D996-V999 VanDerWaalsContact O-N 3.1Å; P997-V999 VanDerWaalsContact C-N 3.28Å; P997-V999 PolarHBondContact O-N 2.89Å; V999-T1001 VanDerWaalsContact C-N 3.31Å; V999-T1001 PolarHBondContact O-N 3.49Å; V999-S1002 WeakPolarHBondContact O-CB 3.4Å; V999-S1002 PolarHBondContact O-N 3.34Å; V999-S1002 PolarHBondContact O-OG 3.45Å; V999-L1102 HydrophobicContact CG1-CD1 3.81Å; V999-K1140 HydrophobicContact CG1-CB 4.36Å; V999-K1140 HydrophobicContact CG1-CD 4.23Å; V999-A1141 WeakPolarHBondContact O-CB 3.33Å
1000	V	94.7	Very high	93	Very high	8 Å²	8	51 Å²	51	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-73.4	-21.9	-171.5	-57.7	0	0	0	0	113.6	H975 A995 D996 K1140	H975-V1000 HydrophobicContact CB-CB 4.01Å; H975-V1000 PolarHBondContact CD2-O 3.33Å; A995-V1000 HydrophobicContact CB-CG1 3.54Å; D996-V1000 WeakPolarHBondContact O-CG2 3.36Å; D996-V1000 PolarHBondContact O-N 2.92Å; D996-V1000 VanDerWaalsContact O-N 3.12Å; V1000-K1140 WeakPolarHBondContact CG1-O 3.04Å
1001	T	94.1	Very high	93	Very high	62 Å²	62	53.4 Å²	53.4	38%	0.38	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94	-6.1	176.9	68.5	0	0	0	0	114	P997 V999 L1003 L1004	P997-T1001 VanDerWaalsContact O-CB 3.26Å; P997-T1001 WeakPolarHBondContact O-CB 3.3Å; P997-T1001 VanDerWaalsContact O-CG2 3.28Å; P997-T1001 WeakPolarHBondContact O-CG2 3.39Å; P997-T1001 PolarHBondContact O-N 3.4Å; P997-T1001 PolarHBondContact O-OG1 3.27Å; V999-T1001 VanDerWaalsContact C-N 3.31Å; V999-T1001 PolarHBondContact O-N 3.49Å; T1001-L1003 PolarHBondContact O-N 3.31Å; T1001-L1004 HydrophobicContact CG2-CD1 3.81Å; T1001-L1004 WeakPolarHBondContact O-CB 3.23Å; T1001-L1004 WeakPolarHBondContact O-CG 3.25Å; T1001-L1004 PolarHBondContact O-N 2.9Å; T1001-L1004 VanDerWaalsContact O-N 3.08Å
1002	S	93.5	Very high	92.7	Very high	53 Å²	53	58.2 Å²	58.2	37%	0.371	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-28.8	-172.9	59.2	0	0	0	0	114.8	V999	V999-S1002 WeakPolarHBondContact O-CB 3.4Å; V999-S1002 PolarHBondContact O-N 3.34Å; V999-S1002 PolarHBondContact O-OG 3.45Å
1003	L	93.1	Very high	92.5	Very high	5 Å²	5	55.5 Å²	55.5	3%	0.026	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-109.3	5.7	-177	-64.2	176.8	0	0	0	114.3	T1001 G1005 W1006 L1009 V1058 L1102 V1103 A1141 L1142	T1001-L1003 PolarHBondContact O-N 3.31Å; L1003-G1005 PolarHBondContact O-N 3.23Å; L1003-W1006 VanDerWaalsContact O-CB 3.23Å; L1003-W1006 WeakPolarHBondContact O-CB 3.12Å; L1003-W1006 PolarHBondContact O-N 3.03Å; L1003-L1009 WeakPolarHBondContact O-CD1 3.37Å; L1003-V1058 HydrophobicContact CD1-CG2 4.12Å; L1003-V1058 HydrophobicContact CD2-CG2 3.77Å; L1003-L1102 HydrophobicContact CD1-CD2 4.3Å; L1003-L1102 HydrophobicContact CD1-CG 4.29Å; L1003-V1103 HydrophobicContact CD1-CG2 3.36Å; L1003-A1141 HydrophobicContact CD1-CB 4.26Å; L1003-A1141 HydrophobicContact CG-CB 4.48Å; L1003-L1142 HydrophobicContact CD1-CB 3.87Å; L1003-L1142 HydrophobicContact CD1-CD2 4.21Å
1004	L	92.5	Very high	92.5	Very high	32 Å²	32	53.4 Å²	53.4	17%	0.168	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-24.4	-179.2	-67.6	-173.6	0	0	0	114	T1001 L1009 G1013 P1015	T1001-L1004 HydrophobicContact CG2-CD1 3.81Å; T1001-L1004 WeakPolarHBondContact O-CB 3.23Å; T1001-L1004 WeakPolarHBondContact O-CG 3.25Å; T1001-L1004 PolarHBondContact O-N 2.9Å; T1001-L1004 VanDerWaalsContact O-N 3.08Å; L1004-L1009 WeakPolarHBondContact O-CD1 3.26Å; L1004-G1013 PolarHBondContact O-N 2.79Å; L1004-P1015 HydrophobicContact CD2-CB 3.83Å; L1004-P1015 HydrophobicContact CD2-CG 3.82Å
1005	G	87.6	Confident	92.6	Very high	57 Å²	57	51.2 Å²	51.2	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.3	175.5	0	0	0	0	0	114.2	L1003 E1007	L1003-G1005 PolarHBondContact O-N 3.23Å; G1005-E1007 PolarHBondContact O-N 3.37Å
1006	W	91.9	Very high	92.7	Very high	1 Å²	1	51 Å²	51	0%	0.004	30%	0.296	C	S	.	.			trans	-56.1	128.2	-171.2	-174.9	48.5	0	0	0	111.4	L1003 K1008 L1009 K1012 I1017 Y1046 L1049 L1050 L1142 I1144	L1003-W1006 VanDerWaalsContact O-CB 3.23Å; L1003-W1006 WeakPolarHBondContact O-CB 3.12Å; L1003-W1006 PolarHBondContact O-N 3.03Å; W1006-K1008 HydrophobicContact CD2-CB 4.12Å; W1006-K1008 HydrophobicContact CE3-CB 4.16Å; W1006-K1008 HydrophobicContact CH2-CB 4Å; W1006-K1008 HydrophobicContact CH2-CG 4.47Å; W1006-K1008 HydrophobicContact CZ2-CB 3.94Å; W1006-K1008 HydrophobicContact CZ2-CG 3.98Å; W1006-K1008 HydrophobicContact CZ3-CB 4.1Å; W1006-K1008 PolarHBondContact O-N 3.02Å; W1006-K1008 VanDerWaalsContact O-N 3.11Å; W1006-L1009 HydrophobicContact CB-CD1 4.36Å; W1006-L1009 HydrophobicContact CB-CG 4.25Å; W1006-L1009 HydrophobicContact CE3-CD2 4.2Å; W1006-L1009 HydrophobicContact CE3-CG 4.19Å; W1006-L1009 PolarHBondContact O-N 3.42Å; W1006-L1009 VanDerWaalsContact O-N 3.17Å; W1006-K1012 PolarHBondContact O-NZ 3.13Å; W1006-I1017 HydrophobicContact CZ3-CD1 3.85Å; W1006-Y1046 HydrophobicContact CH2-CD1 4.06Å; W1006-Y1046 HydrophobicContact CH2-CE1 4.45Å; W1006-L1049 HydrophobicContact CZ2-CB 3.9Å; W1006-L1050 HydrophobicContact CD2-CD2 4.21Å; W1006-L1050 HydrophobicContact CE3-CD2 4.32Å; W1006-L1050 HydrophobicContact CH2-CD2 3.67Å; W1006-L1050 HydrophobicContact CH2-CG 3.89Å; W1006-L1050 HydrophobicContact CZ2-CD2 3.53Å; W1006-L1050 HydrophobicContact CZ2-CG 3.79Å; W1006-L1050 HydrophobicContact CZ3-CD2 4.08Å; W1006-L1142 HydrophobicContact CE3-CD2 3.79Å; W1006-L1142 HydrophobicContact CZ3-CD2 3.76Å; W1006-I1144 HydrophobicContact CH2-CD1 4.26Å; W1006-I1144 HydrophobicContact CZ3-CD1 4.14Å
1007	E	88.3	Confident	92.9	Very high	111 Å²	111	46.9 Å²	46.9	52%	0.519	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.7	-168	51.3	163.8	-139	0	0	113.3	G1005 K1012	G1005-E1007 PolarHBondContact O-N 3.37Å; E1007-K1012 VanDerWaalsContact C-NZ 3.28Å; E1007-K1012 PolarHBondContact O-NZ 3.12Å
1008	K	87.8	Confident	93	Very high	87 Å²	87	42.8 Å²	42.8	38%	0.378	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-1	-175.9	-54.1	-49.9	-166.1	-147.4	0	115.3	W1006 L1049	W1006-K1008 HydrophobicContact CD2-CB 4.12Å; W1006-K1008 HydrophobicContact CE3-CB 4.16Å; W1006-K1008 HydrophobicContact CH2-CB 4Å; W1006-K1008 HydrophobicContact CH2-CG 4.47Å; W1006-K1008 HydrophobicContact CZ2-CB 3.94Å; W1006-K1008 HydrophobicContact CZ2-CG 3.98Å; W1006-K1008 HydrophobicContact CZ3-CB 4.1Å; W1006-K1008 PolarHBondContact O-N 3.02Å; W1006-K1008 VanDerWaalsContact O-N 3.11Å; K1008-L1049 HydrophobicContact CG-CD1 4.34Å
1009	L	92.1	Very high	93.1	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.042	22%	0.223	C	C	.	.			trans	-65.7	130.9	174.8	-72.3	174.8	0	0	0	110.9	L1003 L1004 W1006 K1011 I1017 L1142	L1003-L1009 WeakPolarHBondContact O-CD1 3.37Å; L1004-L1009 WeakPolarHBondContact O-CD1 3.26Å; W1006-L1009 HydrophobicContact CB-CD1 4.36Å; W1006-L1009 HydrophobicContact CB-CG 4.25Å; W1006-L1009 HydrophobicContact CE3-CD2 4.2Å; W1006-L1009 HydrophobicContact CE3-CG 4.19Å; W1006-L1009 PolarHBondContact O-N 3.42Å; W1006-L1009 VanDerWaalsContact O-N 3.17Å; L1009-K1011 VanDerWaalsContact C-N 3.3Å; L1009-K1011 PolarHBondContact O-N 3.2Å; L1009-I1017 HydrophobicContact CD2-CD1 4.14Å; L1009-I1017 HydrophobicContact CD2-CG1 4.05Å; L1009-L1142 HydrophobicContact CD2-CD1 3.81Å
1010	P	90.4	Very high	93.2	Very high	45 Å²	45	36.7 Å²	36.7	29%	0.292	21%	0.209	S	C	.	.	S	Bend	trans	-59.4	-42	176.1	-13.1	19.6	0	0	0	112	I1017 M1172	P1010-I1017 HydrophobicContact CG-CG1 4.28Å; P1010-I1017 HydrophobicContact CG-CG2 4.44Å; P1010-M1172 HydrophobicContact CB-CE 4.49Å; P1010-M1172 HydrophobicContact CB-CG 3.93Å; P1010-M1172 HydrophobicContact CB-SD 3.75Å; P1010-M1172 HydrophobicContact CG-CE 3.79Å; P1010-M1172 HydrophobicContact CG-CG 3.79Å; P1010-M1172 HydrophobicContact CG-SD 3.68Å
1011	K	91.8	Very high	93	Very high	96 Å²	96	36.7 Å²	36.7	42%	0.417	21%	0.209	S	C	.	.	S	Bend	trans	-121.2	120.6	175.3	-177.8	174.8	178.7	178.4	0	109.1	L1009 F1014 N1168 V1170	L1009-K1011 VanDerWaalsContact C-N 3.3Å; L1009-K1011 PolarHBondContact O-N 3.2Å; K1011-F1014 HydrophobicContact CB-CB 4.19Å; K1011-F1014 HydrophobicContact CD-CB 4.28Å; K1011-F1014 HydrophobicContact CG-CB 4.22Å; K1011-F1014 PolarHBondContact O-N 2.93Å; K1011-N1168 WeakPolarHBondContact CD-O 3.47Å; K1011-N1168 PolarHBondContact NZ-O 3.34Å; K1011-V1170 HydrophobicContact CB-CG1 3.95Å
1012	K	89.8	Confident	92.8	Very high	118 Å²	118	34.1 Å²	34.1	51%	0.513	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	140	175.9	-62.2	-61.9	173.5	-170.3	0	110.5	W1006 E1007 F1014	W1006-K1012 PolarHBondContact O-NZ 3.13Å; E1007-K1012 VanDerWaalsContact C-NZ 3.28Å; E1007-K1012 PolarHBondContact O-NZ 3.12Å; K1012-F1014 VanDerWaalsContact C-N 3.27Å; K1012-F1014 PolarHBondContact O-N 3.13Å
1013	G	92	Very high	92.4	Very high	40 Å²	40	32.1 Å²	32.1	41%	0.412	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.7	4	-177.6	0	0	0	0	0	115.3	L1004	L1004-G1013 PolarHBondContact O-N 2.79Å
1014	F	96.1	Very high	92.1	Very high	19 Å²	19	35.3 Å²	35.3	8%	0.083	20%	0.203	C	C	.	.			trans	-120.7	107.4	179.1	-152.8	-76.3	0	0	0	111.3	A977 K1011 K1012 L1016 Y1164 N1168 V1170	A977-F1014 HydrophobicContact CB-CD1 4.34Å; A977-F1014 HydrophobicContact CB-CD2 4.39Å; A977-F1014 HydrophobicContact CB-CE1 3.99Å; A977-F1014 HydrophobicContact CB-CE2 4.03Å; A977-F1014 HydrophobicContact CB-CZ 3.84Å; K1011-F1014 HydrophobicContact CB-CB 4.19Å; K1011-F1014 HydrophobicContact CD-CB 4.28Å; K1011-F1014 HydrophobicContact CG-CB 4.22Å; K1011-F1014 PolarHBondContact O-N 2.93Å; K1012-F1014 VanDerWaalsContact C-N 3.27Å; K1012-F1014 PolarHBondContact O-N 3.13Å; F1014-L1016 HydrophobicContact CD1-CB 3.8Å; F1014-L1016 HydrophobicContact CE1-CB 3.73Å; F1014-L1016 HydrophobicContact CE1-CD2 4.15Å; F1014-L1016 PolarHBondContact O-N 2.92Å; F1014-Y1164 HydrophobicContact CE1-CE1 4.19Å; F1014-Y1164 AromaticContact CZ-CE1 3.9Å; F1014-Y1164 HydrophobicContact CZ-CE1 3.9Å; F1014-Y1164 AromaticContact CZ-CZ 3.76Å; F1014-Y1164 WeakPolarHBondContact CZ-OH 3.36Å; F1014-N1168 HydrophobicContact CD2-CB 4.39Å; F1014-N1168 HydrophobicContact CE1-CB 4.18Å; F1014-N1168 HydrophobicContact CE2-CB 3.75Å; F1014-N1168 WeakPolarHBondContact CE2-OD1 3.36Å; F1014-N1168 HydrophobicContact CZ-CB 3.61Å; F1014-V1170 HydrophobicContact CB-CG1 3.96Å; F1014-V1170 HydrophobicContact CD1-CB 4.43Å; F1014-V1170 HydrophobicContact CD1-CG1 3.51Å; F1014-V1170 HydrophobicContact CD1-CG2 4.25Å; F1014-V1170 HydrophobicContact CE1-CG1 4.19Å; F1014-V1170 HydrophobicContact CE1-CG2 4.14Å; F1014-V1170 HydrophobicContact CG-CG1 3.86Å
1015	P	96.3	Very high	91.8	Very high	1 Å²	1	35.5 Å²	35.5	1%	0.006	20%	0.203	C	C	.	.			trans	-82.4	39.3	-169.8	31.5	-33.5	0	0	0	114.6	H975 A977 L978 L1004 A1141 L1142 L1143	H975-P1015 HydrophobicContact CB-CG 3.91Å; H975-P1015 WeakPolarHBondContact ND1-CG 3.07Å; A977-P1015 HydrophobicContact CB-CG 4.2Å; L978-P1015 HydrophobicContact CD1-CG 4.47Å; L978-P1015 WeakPolarHBondContact CD2-O 3.48Å; L978-P1015 HydrophobicContact CG-CG 4.18Å; L1004-P1015 HydrophobicContact CD2-CB 3.83Å; L1004-P1015 HydrophobicContact CD2-CG 3.82Å; P1015-A1141 WeakPolarHBondContact CB-O 3.36Å; P1015-L1142 WeakPolarHBondContact O-CD1 3.5Å; P1015-L1143 PolarHBondContact O-N 2.98Å
1016	L	98.1	Very high	91.8	Very high	3 Å²	3	34.1 Å²	34.1	2%	0.016	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	138.5	178.2	178.3	61.4	0	0	0	108.9	L978 F1014 L1143 L1161 Y1164 V1170	L978-L1016 HydrophobicContact CD2-CB 4.33Å; L978-L1016 HydrophobicContact CD2-CD1 4.5Å; F1014-L1016 HydrophobicContact CD1-CB 3.8Å; F1014-L1016 HydrophobicContact CE1-CB 3.73Å; F1014-L1016 HydrophobicContact CE1-CD2 4.15Å; F1014-L1016 PolarHBondContact O-N 2.92Å; L1016-L1143 CarbonylContact C-O 3.54Å; L1016-L1143 WeakPolarHBondContact CA-O 3.4Å; L1016-L1143 HydrophobicContact CD1-CB 3.88Å; L1016-L1143 HydrophobicContact CD1-CD2 3.83Å; L1016-L1143 HydrophobicContact CD1-CG 3.8Å; L1016-L1161 HydrophobicContact CD2-CD1 4.31Å; L1016-Y1164 HydrophobicContact CD2-CD1 3.83Å; L1016-Y1164 HydrophobicContact CD2-CE1 3.96Å; L1016-V1170 HydrophobicContact CB-CG2 4.21Å; L1016-V1170 HydrophobicContact CD2-CG2 4.02Å; L1016-V1170 HydrophobicContact CG-CG2 4.04Å; L1016-V1170 VanDerWaalsContact O-CB 3.27Å; L1016-V1170 WeakPolarHBondContact O-CB 3.42Å
1017	I	97.5	Very high	91.5	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	125.9	166.6	-55.5	-177.1	0	0	0	107.4	W1006 L1009 P1010 Y1046 L1143 I1144 V1145 M1172	W1006-I1017 HydrophobicContact CZ3-CD1 3.85Å; L1009-I1017 HydrophobicContact CD2-CD1 4.14Å; L1009-I1017 HydrophobicContact CD2-CG1 4.05Å; P1010-I1017 HydrophobicContact CG-CG1 4.28Å; P1010-I1017 HydrophobicContact CG-CG2 4.44Å; I1017-Y1046 HydrophobicContact CD1-CE1 4.24Å; I1017-L1143 PolarHBondContact N-O 3.1Å; I1017-I1144 HydrophobicContact CB-CG1 4.28Å; I1017-I1144 HydrophobicContact CB-CG2 4.26Å; I1017-I1144 HydrophobicContact CD1-CD1 4.38Å; I1017-I1144 HydrophobicContact CD1-CG1 4.32Å; I1017-I1144 HydrophobicContact CG1-CG1 4.47Å; I1017-I1144 HydrophobicContact CG2-CG2 4.47Å; I1017-I1144 CarbonylContact O-C 3.59Å; I1017-I1144 WeakPolarHBondContact O-CA 3.42Å; I1017-V1145 PolarHBondContact O-N 2.95Å; I1017-M1172 HydrophobicContact CG2-CE 4.37Å
1018	F	97.7	Very high	91.2	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	117.2	161.6	-166	-70.9	0	0	0	108	V1145 L1152 L1161 L1162 V1170 Y1171 M1172	F1018-V1145 HydrophobicContact CD2-CB 3.99Å; F1018-V1145 HydrophobicContact CD2-CG1 4.03Å; F1018-V1145 HydrophobicContact CE2-CB 4.3Å; F1018-V1145 HydrophobicContact CE2-CG1 3.81Å; F1018-L1152 HydrophobicContact CE2-CD1 4.45Å; F1018-L1152 HydrophobicContact CZ-CD1 3.78Å; F1018-L1161 HydrophobicContact CD2-CD2 4.19Å; F1018-L1161 HydrophobicContact CD2-CG 4.2Å; F1018-L1161 HydrophobicContact CE2-CD2 4.18Å; F1018-L1161 HydrophobicContact CE2-CG 4.44Å; F1018-L1162 HydrophobicContact CD1-CD2 3.89Å; F1018-L1162 HydrophobicContact CD2-CD2 4.15Å; F1018-L1162 HydrophobicContact CE1-CD2 3.45Å; F1018-L1162 VanDerWaalsContact CE1-CD2 3.45Å; F1018-L1162 HydrophobicContact CE2-CD2 3.71Å; F1018-L1162 HydrophobicContact CE2-CG 4.08Å; F1018-L1162 HydrophobicContact CG-CD2 4.23Å; F1018-L1162 HydrophobicContact CZ-CD2 3.35Å; F1018-L1162 HydrophobicContact CZ-CG 4.02Å; F1018-V1170 PolarHBondContact N-O 2.94Å; F1018-V1170 VanDerWaalsContact N-O 3.09Å; F1018-Y1171 HydrophobicContact CB-CD2 4.22Å; F1018-Y1171 AromaticContact CD1-CD2 3.52Å; F1018-Y1171 HydrophobicContact CD1-CD2 3.52Å; F1018-Y1171 AromaticContact CD1-CE2 3.57Å; F1018-Y1171 HydrophobicContact CD1-CE2 3.57Å; F1018-Y1171 HydrophobicContact CE1-CD2 4.27Å; F1018-Y1171 AromaticContact CE1-CE2 3.92Å; F1018-Y1171 HydrophobicContact CE1-CE2 3.92Å; F1018-Y1171 HydrophobicContact CG-CD2 4.13Å; F1018-Y1171 WeakPolarHBondContact O-CA 3.31Å; F1018-M1172 PolarHBondContact O-N 2.78Å
1019	H	96.2	Very high	90.7	Very high	22 Å²	22	28.8 Å²	28.8	10%	0.102	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	106.7	177.8	-164.1	141.8	0	0	0	109.4	V1021 Q1042 Y1046 V1145 L1146 G1147 M1172	H1019-V1021 PolarHBondContact O-N 2.97Å; H1019-Q1042 VanDerWaalsContact CE1-CD 3.44Å; H1019-Q1042 PolarHBondContact CE1-NE2 2.7Å; H1019-Y1046 HydrophobicContact CB-CE2 4.26Å; H1019-Y1046 AromaticContact ND1-CE2 3.48Å; H1019-Y1046 WeakPolarHBondContact ND1-CE2 3.45Å; H1019-Y1046 AromaticContact ND1-CZ 3.56Å; H1019-Y1046 PolarHBondContact ND1-OH 3.06Å; H1019-V1145 PolarHBondContact N-O 2.78Å; H1019-L1146 HydrophobicContact CB-CD2 3.53Å; H1019-L1146 WeakPolarHBondContact O-CA 3.45Å; H1019-G1147 PolarHBondContact O-N 3.21Å; H1019-M1172 CarbonylContact C-O 3.59Å; H1019-M1172 WeakPolarHBondContact CA-O 3.48Å
1020	G	95.1	Very high	89.6	Confident	2 Å²	2	36 Å²	36	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	116.3	173.3	0	0	0	0	0	111.6	G1147 M1172 G1173 C1174	G1020-G1147 CarbonylContact C-O 3.58Å; G1020-G1147 VanDerWaalsContact CA-O 3.3Å; G1020-G1147 WeakPolarHBondContact CA-O 3.43Å; G1020-M1172 PolarHBondContact N-O 2.97Å; G1020-G1173 CarbonylContact O-C 3.59Å; G1020-G1173 WeakPolarHBondContact O-CA 3.27Å; G1020-C1174 PolarHBondContact O-N 3.14Å
1021	V	91.5	Very high	88.6	Confident	8 Å²	8	35 Å²	35	5%	0.048	19%	0.185	C	C	.	.			trans	-125.3	116.3	177.3	-177.7	0	0	0	0	108.6	H1019 G1023 A1038 E1039 Q1042 G1147 N1148	H1019-V1021 PolarHBondContact O-N 2.97Å; V1021-G1023 PolarHBondContact O-N 3.38Å; V1021-A1038 HydrophobicContact CG1-CB 3.98Å; V1021-E1039 HydrophobicContact CB-CG 4.07Å; V1021-E1039 HydrophobicContact CG1-CG 4.02Å; V1021-Q1042 HydrophobicContact CG2-CG 4.33Å; V1021-G1147 PolarHBondContact N-O 3.37Å; V1021-G1147 CarbonylContact O-C 3.54Å; V1021-N1148 WeakPolarHBondContact O-CA 3.36Å; V1021-N1148 WeakPolarHBondContact O-CB 3.3Å; V1021-N1148 PolarHBondContact O-N 2.75Å
1022	R	89.6	Confident	87.7	Confident	9 Å²	9	33.4 Å²	33.4	3%	0.034	18%	0.184	C	C	.	.			trans	-91.6	74.1	172	-62.5	173.7	70.8	178.1	2.2	109	R424 K426 E1113 C1174 D1175	R424-R1022 HydrophobicContact CB-CB 3.94Å; R424-R1022 WeakPolarHBondContact CB-O 3.49Å; R424-R1022 PolarHBondContact N-O 2.9Å; R424-R1022 WeakPolarHBondContact O-CB 3.36Å; K426-R1022 VanDerWaalsContact CB-NH1 3.33Å; R1022-E1113 IonicContact CZ-OE1 3.58Å; R1022-E1113 IonicContact CZ-OE2 2.72Å; R1022-E1113 IonicContact NE-OE1 3.47Å; R1022-E1113 PolarHBondContact NE-OE1 3.43Å; R1022-E1113 IonicContact NE-OE2 3.94Å; R1022-E1113 VanDerWaalsContact NH2-CD 3.32Å; R1022-E1113 IonicContact NH2-OE1 2.7Å; R1022-E1113 PolarHBondContact NH2-OE1 3.45Å; R1022-E1113 VanDerWaalsContact NH2-OE1 3.16Å; R1022-E1113 IonicContact NH2-OE2 2.78Å; R1022-E1113 PolarHBondContact NH2-OE2 3.29Å; R1022-C1174 HydrophobicContact CG-CB 3.92Å; R1022-D1175 IonicContact CZ-OD1 3.98Å; R1022-D1175 IonicContact NH1-OD1 3.32Å; R1022-D1175 PolarHBondContact NH1-OD1 3.29Å; R1022-D1175 IonicContact NH1-OD2 2.82Å; R1022-D1175 PolarHBondContact NH1-OD2 3.01Å
1023	G	85.6	Confident	87.4	Confident	10 Å²	10	28.7 Å²	28.7	10%	0.103	17%	0.166	C	C	.	.			trans	-79.6	-177.6	-179.3	0	0	0	0	0	113.5	V1021 S1111	V1021-G1023 PolarHBondContact O-N 3.38Å; G1023-S1111 PolarHBondContact N-OG 3.25Å; G1023-S1111 WeakPolarHBondContact O-CB 3.44Å
1024	S	85.9	Confident	87.2	Confident	73 Å²	73	29.4 Å²	29.4	51%	0.51	16%	0.156	S	C	.	.			trans	-106.7	123	169.6	-64.8	0	0	0	0	109.4	P1037	S1024-P1037 WeakPolarHBondContact O-CD 3.49Å
1025	E	87.2	Confident	87.1	Confident	35 Å²	35	28.5 Å²	28.5	16%	0.164	15%	0.152	C	C	.	.			trans	-82.9	133.6	174.3	63.2	-176.9	-144.5	0	0	111	W1034 R1110 S1111 N1112 F1122	E1025-W1034 HydrophobicContact CB-CE3 4.17Å; E1025-W1034 HydrophobicContact CG-CE3 4.25Å; E1025-W1034 HydrophobicContact CG-CZ3 4.19Å; E1025-R1110 IonicContact OE1-CZ 3.69Å; E1025-R1110 IonicContact OE1-NE 2.61Å; E1025-R1110 IonicContact OE1-NH2 3.51Å; E1025-R1110 PolarHBondContact OE1-NH2 2.69Å; E1025-R1110 VanDerWaalsContact OE1-NH2 3.17Å; E1025-R1110 VanDerWaalsContact OE2-CA 3.3Å; E1025-R1110 WeakPolarHBondContact OE2-CA 3.3Å; E1025-R1110 IonicContact OE2-CZ 3.6Å; E1025-R1110 IonicContact OE2-NE 3.32Å; E1025-R1110 PolarHBondContact OE2-NE 2.83Å; E1025-R1110 IonicContact OE2-NH2 2.62Å; E1025-S1111 PolarHBondContact OE2-N 2.86Å; E1025-N1112 HydrophobicContact CG-CB 4.18Å; E1025-N1112 PolarHBondContact OE2-N 3.44Å; E1025-F1122 WeakPolarHBondContact OE1-CZ 3.34Å
1026	A	87.4	Confident	86.9	Confident	28 Å²	28	28.5 Å²	28.5	23%	0.231	15%	0.152	C	C	.	.	B	Isolated β-bridge	trans	-136.3	162.7	-177.6	0	0	0	0	0	112	W1034 F1035	A1026-W1034 WeakPolarHBondContact O-CA 3.32Å; A1026-F1035 HydrophobicContact CB-CD1 4.39Å; A1026-F1035 HydrophobicContact CB-CE1 3.85Å; A1026-F1035 HydrophobicContact CB-CE2 4.18Å; A1026-F1035 HydrophobicContact CB-CZ 3.74Å; A1026-F1035 PolarHBondContact N-O 2.79Å; A1026-F1035 VanDerWaalsContact O-CD1 3.27Å; A1026-F1035 WeakPolarHBondContact O-CD1 3.42Å; A1026-F1035 PolarHBondContact O-N 3.34Å
1027	R	85.6	Confident	86.7	Confident	73 Å²	73	29.1 Å²	29.1	28%	0.275	16%	0.157	S	C	.	.			trans	-131.8	149.9	167.8	-74.3	176.8	-68.9	179.8	-1.5	108	F460 W1034	F460-R1027 HydrophobicContact CB-CB 3.72Å; F460-R1027 HydrophobicContact CD2-CB 4.06Å; F460-R1027 HydrophobicContact CG-CB 3.87Å; R1027-W1034 HydrophobicContact CG-CD2 3.73Å; R1027-W1034 HydrophobicContact CG-CE3 3.61Å; R1027-W1034 HydrophobicContact CG-CG 4.26Å; R1027-W1034 HydrophobicContact CG-CH2 4.41Å; R1027-W1034 HydrophobicContact CG-CZ2 4.49Å; R1027-W1034 HydrophobicContact CG-CZ3 3.96Å; R1027-W1034 VanDerWaalsContact CZ-CH2 3.49Å; R1027-W1034 VanDerWaalsContact CZ-CZ2 3.42Å; R1027-W1034 VanDerWaalsContact NE-CH2 3.25Å
1028	E	80.8	Confident	86.3	Confident	13 Å²	13	29.2 Å²	29.2	6%	0.061	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-129.7	143.6	177.9	66.2	177.5	-160.1	0	0	112.2	A456 R457 E458 K1030 S1031 F1035 K1071 K1075	A456-E1028 VanDerWaalsContact CA-OE2 3.32Å; A456-E1028 WeakPolarHBondContact CA-OE2 3.44Å; A456-E1028 HydrophobicContact CB-CB 4.07Å; R457-E1028 PolarHBondContact N-OE2 3.22Å; R457-E1028 VanDerWaalsContact N-OE2 3.16Å; E458-E1028 VanDerWaalsContact O-CA 3.3Å; E458-E1028 WeakPolarHBondContact O-CA 3.34Å; E458-E1028 WeakPolarHBondContact O-CB 3.25Å; E1028-K1030 PolarHBondContact O-N 3.45Å; E1028-S1031 PolarHBondContact O-N 2.9Å; E1028-F1035 HydrophobicContact CB-CE1 4.14Å; E1028-F1035 HydrophobicContact CG-CE1 4.04Å; E1028-K1071 HydrophobicContact CG-CD 4.42Å; E1028-K1071 VanDerWaalsContact CG-CE 3.45Å; E1028-K1071 WeakPolarHBondContact OE1-CE 3.31Å; E1028-K1071 IonicContact OE1-NZ 2.72Å; E1028-K1071 PolarHBondContact OE1-NZ 2.89Å; E1028-K1075 VanDerWaalsContact CD-NZ 3.26Å; E1028-K1075 WeakPolarHBondContact OE1-CE 3.47Å; E1028-K1075 IonicContact OE1-NZ 3.16Å; E1028-K1075 PolarHBondContact OE1-NZ 3.03Å; E1028-K1075 VanDerWaalsContact OE1-NZ 3.1Å; E1028-K1075 IonicContact OE2-NZ 3.32Å; E1028-K1075 PolarHBondContact OE2-NZ 3Å
1029	G	77.3	Confident	86.2	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.021	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	-128.6	172.4	0	0	0	0	0	114.1	E458 F460 S461	E458-G1029 PolarHBondContact O-N 3.08Å; E458-G1029 VanDerWaalsContact O-N 3.11Å; E458-G1029 WeakPolarHBondContact OE1-CA 3.25Å; F460-G1029 CarbonylContact C-O 3.56Å; F460-G1029 VanDerWaalsContact CA-O 3.26Å; F460-G1029 WeakPolarHBondContact CA-O 3.24Å; F460-G1029 VanDerWaalsContact CD2-O 3.31Å; F460-G1029 WeakPolarHBondContact CD2-O 3.25Å; S461-G1029 PolarHBondContact N-O 2.74Å
1030	K	70	Confident	86.1	Confident	160 Å²	160	28.2 Å²	28.2	70%	0.696	15%	0.153	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.9	178.2	-59.7	175	-171.7	166.5	0	113	E1028 P1032	E1028-K1030 PolarHBondContact O-N 3.45Å; K1030-P1032 WeakPolarHBondContact O-CD 3.44Å
1031	S	69.6	Low	85.9	Confident	24 Å²	24	28.1 Å²	28.1	17%	0.168	15%	0.152	C	C	.	.			trans	-79.2	122.8	-174.2	-170.9	0	0	0	0	110.9	F460 E1028 S1033	F460-S1031 VanDerWaalsContact CD2-O 3.29Å; F460-S1031 WeakPolarHBondContact CD2-O 3.18Å; F460-S1031 WeakPolarHBondContact CE2-O 3.43Å; E1028-S1031 PolarHBondContact O-N 2.9Å; S1031-S1033 PolarHBondContact O-N 2.92Å; S1031-S1033 PolarHBondContact OG-N 3.31Å
1032	P	73.3	Confident	86	Confident	62 Å²	62	28.5 Å²	28.5	40%	0.403	15%	0.153	S	C	.	.			trans	-74.8	-5.8	174.5	32.3	-35.6	0	0	0	112.6	K1030	K1030-P1032 WeakPolarHBondContact O-CD 3.44Å
1033	S	82.6	Confident	86.3	Confident	19 Å²	19	28 Å²	28	13%	0.133	15%	0.151	C	C	.	.			trans	-79.1	130.1	-175.5	179	0	0	0	0	111.8	S1031 R1070 K1071	S1031-S1033 PolarHBondContact O-N 2.92Å; S1031-S1033 PolarHBondContact OG-N 3.31Å; S1033-R1070 PolarHBondContact OG-N 3.08Å; S1033-K1071 WeakPolarHBondContact OG-CB 3.39Å; S1033-K1071 PolarHBondContact OG-N 3.42Å
1034	W	88.7	Confident	86.7	Confident	55 Å²	55	28.2 Å²	28.2	21%	0.208	15%	0.15	C	C	.	.			trans	-74.8	154.6	177	-62	96.5	0	0	0	112.5	E1025 A1026 R1027 Y1069 V1109	E1025-W1034 HydrophobicContact CB-CE3 4.17Å; E1025-W1034 HydrophobicContact CG-CE3 4.25Å; E1025-W1034 HydrophobicContact CG-CZ3 4.19Å; A1026-W1034 WeakPolarHBondContact O-CA 3.32Å; R1027-W1034 HydrophobicContact CG-CD2 3.73Å; R1027-W1034 HydrophobicContact CG-CE3 3.61Å; R1027-W1034 HydrophobicContact CG-CG 4.26Å; R1027-W1034 HydrophobicContact CG-CH2 4.41Å; R1027-W1034 HydrophobicContact CG-CZ2 4.49Å; R1027-W1034 HydrophobicContact CG-CZ3 3.96Å; R1027-W1034 VanDerWaalsContact CZ-CH2 3.49Å; R1027-W1034 VanDerWaalsContact CZ-CZ2 3.42Å; R1027-W1034 VanDerWaalsContact NE-CH2 3.25Å; W1034-Y1069 HydrophobicContact CB-CD1 3.99Å; W1034-Y1069 HydrophobicContact CB-CD2 4.45Å; W1034-Y1069 HydrophobicContact CB-CE1 4.14Å; W1034-Y1069 HydrophobicContact CB-CG 4.17Å; W1034-Y1069 AromaticContact CD1-CE1 3.62Å; W1034-Y1069 HydrophobicContact CG-CD1 4.5Å; W1034-Y1069 HydrophobicContact CG-CE1 4.27Å; W1034-Y1069 WeakPolarHBondContact O-CB 3.19Å; W1034-V1109 HydrophobicContact CB-CG1 4.18Å
1035	F	92.3	Very high	86.9	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-145.1	158.7	166.9	69.8	-81.8	0	0	0	110.3	A456 A1026 E1028 P1037 K1071 Q1072 K1075	A456-F1035 HydrophobicContact CB-CZ 3.97Å; A1026-F1035 HydrophobicContact CB-CD1 4.39Å; A1026-F1035 HydrophobicContact CB-CE1 3.85Å; A1026-F1035 HydrophobicContact CB-CE2 4.18Å; A1026-F1035 HydrophobicContact CB-CZ 3.74Å; A1026-F1035 PolarHBondContact N-O 2.79Å; A1026-F1035 VanDerWaalsContact O-CD1 3.27Å; A1026-F1035 WeakPolarHBondContact O-CD1 3.42Å; A1026-F1035 PolarHBondContact O-N 3.34Å; E1028-F1035 HydrophobicContact CB-CE1 4.14Å; E1028-F1035 HydrophobicContact CG-CE1 4.04Å; F1035-P1037 HydrophobicContact CD2-CG 3.97Å; F1035-P1037 HydrophobicContact CE2-CG 3.79Å; F1035-K1071 HydrophobicContact CB-CB 4.26Å; F1035-K1071 HydrophobicContact CB-CG 4.2Å; F1035-K1071 HydrophobicContact CD1-CB 4.48Å; F1035-K1071 HydrophobicContact CD1-CG 3.77Å; F1035-K1071 HydrophobicContact CG-CG 4.25Å; F1035-Q1072 VanDerWaalsContact CA-OE1 3.29Å; F1035-Q1072 HydrophobicContact CB-CB 4.5Å; F1035-K1075 HydrophobicContact CB-CG 4.28Å; F1035-K1075 HydrophobicContact CD2-CG 3.92Å; F1035-K1075 HydrophobicContact CE2-CG 4.49Å; F1035-K1075 HydrophobicContact CG-CG 4.18Å
1036	N	93.6	Very high	87.3	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.13	C	C	.	.			trans	-134.3	104.2	-178.9	-177.8	-26.5	0	0	0	108.9	A1038 E1039 A1040 Q1072 V1109 S1111	N1036-A1038 PolarHBondContact O-N 2.83Å; N1036-A1038 PolarHBondContact OD1-N 3.47Å; N1036-E1039 HydrophobicContact CB-CB 4.19Å; N1036-E1039 HydrophobicContact CB-CG 4.41Å; N1036-E1039 PolarHBondContact ND2-OE1 3.4Å; N1036-E1039 VanDerWaalsContact ND2-OE1 3.14Å; N1036-E1039 PolarHBondContact O-N 2.92Å; N1036-E1039 PolarHBondContact OD1-N 2.73Å; N1036-A1040 PolarHBondContact O-N 2.87Å; N1036-Q1072 PolarHBondContact O-NE2 3.13Å; N1036-Q1072 PolarHBondContact O-OE1 2.69Å; N1036-V1109 HydrophobicContact CB-CB 4.41Å; N1036-V1109 HydrophobicContact CB-CG1 3.86Å; N1036-V1109 WeakPolarHBondContact CB-O 3.41Å; N1036-V1109 PolarHBondContact ND2-O 3.34Å; N1036-S1111 PolarHBondContact ND2-OG 3.06Å
1037	P	92.6	Very high	87.6	Confident	17 Å²	17	25 Å²	25	11%	0.11	12%	0.119	C	C	.	.	H	α-helix	trans	-58.9	-42.9	-177.1	-28.8	37.6	0	0	0	114.3	E451 I454 S1024 F1035 E1039 A1040 V1041	E451-P1037 HydrophobicContact CB-CB 4.18Å; E451-P1037 HydrophobicContact CG-CB 3.73Å; I454-P1037 HydrophobicContact CD1-CB 3.95Å; I454-P1037 HydrophobicContact CG1-CB 4.24Å; S1024-P1037 WeakPolarHBondContact O-CD 3.49Å; F1035-P1037 HydrophobicContact CD2-CG 3.97Å; F1035-P1037 HydrophobicContact CE2-CG 3.79Å; P1037-E1039 PolarHBondContact O-N 2.81Å; P1037-A1040 PolarHBondContact O-N 2.99Å; P1037-A1040 VanDerWaalsContact O-N 3.17Å; P1037-V1041 WeakPolarHBondContact O-CG2 3.33Å; P1037-V1041 PolarHBondContact O-N 2.9Å
1038	A	89.8	Confident	87.8	Confident	2 Å²	2	23 Å²	23	2%	0.017	12%	0.116	C	C	.	.	H	α-helix	trans	-63.7	-43.6	-178.1	0	0	0	0	0	111.5	V1021 N1036 Q1042	V1021-A1038 HydrophobicContact CG1-CB 3.98Å; N1036-A1038 PolarHBondContact O-N 2.83Å; N1036-A1038 PolarHBondContact OD1-N 3.47Å; A1038-Q1042 WeakPolarHBondContact O-CB 3.48Å; A1038-Q1042 PolarHBondContact O-N 3.34Å
1039	E	95.2	Very high	88.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-63.5	-42.3	172.8	-76.9	-173.5	-139.3	0	0	112	V1021 N1036 P1037 V1041 Q1042 V1043 S1107 T1108 V1109	V1021-E1039 HydrophobicContact CB-CG 4.07Å; V1021-E1039 HydrophobicContact CG1-CG 4.02Å; N1036-E1039 HydrophobicContact CB-CB 4.19Å; N1036-E1039 HydrophobicContact CB-CG 4.41Å; N1036-E1039 PolarHBondContact ND2-OE1 3.4Å; N1036-E1039 VanDerWaalsContact ND2-OE1 3.14Å; N1036-E1039 PolarHBondContact O-N 2.92Å; N1036-E1039 PolarHBondContact OD1-N 2.73Å; P1037-E1039 PolarHBondContact O-N 2.81Å; E1039-V1041 PolarHBondContact O-N 2.88Å; E1039-Q1042 CarbonylContact O-C 3.44Å; E1039-Q1042 PolarHBondContact O-N 2.85Å; E1039-Q1042 VanDerWaalsContact O-N 3.15Å; E1039-V1043 WeakPolarHBondContact O-CG2 3.42Å; E1039-V1043 PolarHBondContact O-N 2.86Å; E1039-S1107 PolarHBondContact OE2-OG 2.88Å; E1039-T1108 PolarHBondContact OE2-N 3.45Å; E1039-V1109 VanDerWaalsContact CD-N 3.3Å; E1039-V1109 VanDerWaalsContact OE1-CA 3.32Å; E1039-V1109 WeakPolarHBondContact OE1-CA 3.45Å; E1039-V1109 PolarHBondContact OE1-N 3.07Å; E1039-V1109 VanDerWaalsContact OE1-N 3.09Å; E1039-V1109 WeakPolarHBondContact OE2-CA 3.18Å; E1039-V1109 PolarHBondContact OE2-N 3.26Å
1040	A	94.4	Very high	89	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-63.1	-41.2	-179.2	0	0	0	0	0	112.2	I454 N1036 P1037 Q1042 V1043 L1044 I1076 L1079	I454-A1040 HydrophobicContact CD1-CB 3.71Å; N1036-A1040 PolarHBondContact O-N 2.87Å; P1037-A1040 PolarHBondContact O-N 2.99Å; P1037-A1040 VanDerWaalsContact O-N 3.17Å; A1040-Q1042 VanDerWaalsContact C-N 3.34Å; A1040-V1043 WeakPolarHBondContact O-CB 3.43Å; A1040-V1043 PolarHBondContact O-N 3.43Å; A1040-L1044 PolarHBondContact O-N 3.01Å; A1040-I1076 HydrophobicContact CB-CG1 3.81Å; A1040-L1079 HydrophobicContact CB-CD1 3.98Å; A1040-L1079 WeakPolarHBondContact O-CD1 3.42Å
1041	V	91.3	Very high	89.9	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.4	-37.8	173.3	172	0	0	0	0	111.2	E450 E451 I454 P1037 E1039 V1043 L1044 R1045 L1079	E450-V1041 HydrophobicContact CB-CG1 4.11Å; E450-V1041 HydrophobicContact CB-CG2 3.66Å; E451-V1041 HydrophobicContact CB-CG2 4.5Å; E451-V1041 HydrophobicContact CG-CB 4.47Å; E451-V1041 HydrophobicContact CG-CG2 3.8Å; I454-V1041 HydrophobicContact CD1-CG2 4.42Å; P1037-V1041 WeakPolarHBondContact O-CG2 3.33Å; P1037-V1041 PolarHBondContact O-N 2.9Å; E1039-V1041 PolarHBondContact O-N 2.88Å; V1041-V1043 VanDerWaalsContact C-N 3.34Å; V1041-V1043 PolarHBondContact O-N 2.91Å; V1041-L1044 WeakPolarHBondContact O-CB 3.22Å; V1041-L1044 PolarHBondContact O-N 3.26Å; V1041-R1045 WeakPolarHBondContact O-CG 3.29Å; V1041-R1045 PolarHBondContact O-N 2.79Å; V1041-L1079 HydrophobicContact CG2-CD1 4.04Å
1042	Q	93.1	Very high	90.6	Very high	16 Å²	16	23 Å²	23	8%	0.075	12%	0.117	C	C	.	.	H	α-helix	trans	-66.8	-35.1	175.4	-170.7	57.8	43.3	0	0	112.3	H1019 V1021 A1038 E1039 A1040 R1045 Y1046 L1146	H1019-Q1042 VanDerWaalsContact CE1-CD 3.44Å; H1019-Q1042 PolarHBondContact CE1-NE2 2.7Å; V1021-Q1042 HydrophobicContact CG2-CG 4.33Å; A1038-Q1042 WeakPolarHBondContact O-CB 3.48Å; A1038-Q1042 PolarHBondContact O-N 3.34Å; E1039-Q1042 CarbonylContact O-C 3.44Å; E1039-Q1042 PolarHBondContact O-N 2.85Å; E1039-Q1042 VanDerWaalsContact O-N 3.15Å; A1040-Q1042 VanDerWaalsContact C-N 3.34Å; Q1042-R1045 PolarHBondContact O-N 2.83Å; Q1042-Y1046 HydrophobicContact CG-CD2 4.09Å; Q1042-Y1046 HydrophobicContact CG-CE2 3.91Å; Q1042-Y1046 VanDerWaalsContact O-CD2 3.28Å; Q1042-Y1046 WeakPolarHBondContact O-CD2 3.49Å; Q1042-Y1046 PolarHBondContact O-N 3.41Å; Q1042-Y1046 VanDerWaalsContact O-N 3.12Å; Q1042-L1146 HydrophobicContact CB-CD1 4.04Å; Q1042-L1146 HydrophobicContact CG-CD1 4.05Å; Q1042-L1146 HydrophobicContact CG-CD2 3.99Å
1043	V	96.2	Very high	90.8	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-58.8	-50.5	169.4	173.1	0	0	0	0	110.2	E1039 A1040 V1041 R1045 Y1046 C1047 V1065 I1076 I1105 L1146	E1039-V1043 WeakPolarHBondContact O-CG2 3.42Å; E1039-V1043 PolarHBondContact O-N 2.86Å; A1040-V1043 WeakPolarHBondContact O-CB 3.43Å; A1040-V1043 PolarHBondContact O-N 3.43Å; V1041-V1043 VanDerWaalsContact C-N 3.34Å; V1041-V1043 PolarHBondContact O-N 2.91Å; V1043-R1045 VanDerWaalsContact C-N 3.32Å; V1043-R1045 PolarHBondContact O-N 3.2Å; V1043-Y1046 PolarHBondContact O-N 2.93Å; V1043-C1047 PolarHBondContact O-N 3.18Å; V1043-C1047 PolarHBondContact O-SG 2.79Å; V1043-V1065 HydrophobicContact CG1-CB 4.48Å; V1043-V1065 HydrophobicContact CG1-CG1 3.78Å; V1043-V1065 HydrophobicContact CG1-CG2 3.82Å; V1043-V1065 HydrophobicContact CG2-CG1 4.48Å; V1043-I1076 HydrophobicContact CB-CD1 4.37Å; V1043-I1076 HydrophobicContact CG1-CD1 4.33Å; V1043-I1076 HydrophobicContact CG1-CG2 3.98Å; V1043-I1076 HydrophobicContact CG2-CD1 4.03Å; V1043-I1105 HydrophobicContact CG1-CG2 4.37Å; V1043-I1105 HydrophobicContact CG2-CG2 4.12Å; V1043-L1146 HydrophobicContact CB-CD1 4.22Å; V1043-L1146 HydrophobicContact CG2-CD1 3.37Å
1044	L	93.3	Very high	90.2	Very high	14 Å²	14	28 Å²	28	7%	0.073	14%	0.139	C	C	.	.	H	α-helix	trans	-54.1	-48.9	178.1	172	69.3	0	0	0	110.9	E450 A1040 V1041 Y1046 C1047 C1048 L1079 L1080 V1083	E450-L1044 HydrophobicContact CG-CD2 4.48Å; A1040-L1044 PolarHBondContact O-N 3.01Å; V1041-L1044 WeakPolarHBondContact O-CB 3.22Å; V1041-L1044 PolarHBondContact O-N 3.26Å; L1044-Y1046 VanDerWaalsContact C-N 3.34Å; L1044-Y1046 PolarHBondContact O-N 3.18Å; L1044-C1047 WeakPolarHBondContact O-CB 3.38Å; L1044-C1047 PolarHBondContact O-N 3.2Å; L1044-C1047 VanDerWaalsContact O-N 3.13Å; L1044-C1048 PolarHBondContact O-N 3.04Å; L1044-C1048 PolarHBondContact O-SG 2.92Å; L1044-C1048 VanDerWaalsContact O-SG 3.37Å; L1044-L1079 HydrophobicContact CB-CB 4.35Å; L1044-L1079 HydrophobicContact CB-CD1 4.26Å; L1044-L1079 HydrophobicContact CD1-CB 4.28Å; L1044-L1079 HydrophobicContact CD2-CB 4.13Å; L1044-L1079 HydrophobicContact CD2-CD1 4.46Å; L1044-L1079 HydrophobicContact CD2-CD2 4.27Å; L1044-L1079 HydrophobicContact CG-CB 4.48Å; L1044-L1080 HydrophobicContact CD1-CD2 4Å; L1044-V1083 HydrophobicContact CD1-CB 4.43Å; L1044-V1083 HydrophobicContact CD1-CG1 4.08Å; L1044-V1083 HydrophobicContact CD1-CG2 3.48Å; L1044-V1083 VanDerWaalsContact CD1-CG2 3.48Å
1045	R	90.9	Very high	89.3	Confident	59 Å²	59	29 Å²	29	22%	0.223	15%	0.153	C	C	.	.	H	α-helix	trans	-55.9	-47.4	178.3	-71.5	174.3	-171.4	-155.6	-3.5	111.7	E284 V1041 Q1042 V1043 C1048 L1049	E284-R1045 IonicContact OE1-CZ 2.75Å; E284-R1045 VanDerWaalsContact OE1-CZ 3.27Å; E284-R1045 IonicContact OE1-NH1 2.68Å; E284-R1045 PolarHBondContact OE1-NH1 3.44Å; E284-R1045 IonicContact OE1-NH2 2.95Å; E284-R1045 PolarHBondContact OE1-NH2 3.17Å; E284-R1045 IonicContact OE2-CZ 3.59Å; E284-R1045 IonicContact OE2-NH2 2.64Å; E284-R1045 PolarHBondContact OE2-NH2 3.27Å; V1041-R1045 WeakPolarHBondContact O-CG 3.29Å; V1041-R1045 PolarHBondContact O-N 2.79Å; Q1042-R1045 PolarHBondContact O-N 2.83Å; V1043-R1045 VanDerWaalsContact C-N 3.32Å; V1043-R1045 PolarHBondContact O-N 3.2Å; R1045-C1048 PolarHBondContact O-N 3.07Å; R1045-L1049 WeakPolarHBondContact O-CB 3.23Å; R1045-L1049 WeakPolarHBondContact O-CG 3.36Å; R1045-L1049 PolarHBondContact O-N 3.2Å
1046	Y	94.6	Very high	88.6	Confident	10 Å²	10	30.3 Å²	30.3	4%	0.039	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-39.4	177.4	-80.9	-59.6	0	0	0	112.8	W1006 I1017 H1019 Q1042 V1043 L1044 L1049 L1050 I1144 L1146	W1006-Y1046 HydrophobicContact CH2-CD1 4.06Å; W1006-Y1046 HydrophobicContact CH2-CE1 4.45Å; I1017-Y1046 HydrophobicContact CD1-CE1 4.24Å; H1019-Y1046 HydrophobicContact CB-CE2 4.26Å; H1019-Y1046 AromaticContact ND1-CE2 3.48Å; H1019-Y1046 WeakPolarHBondContact ND1-CE2 3.45Å; H1019-Y1046 AromaticContact ND1-CZ 3.56Å; H1019-Y1046 PolarHBondContact ND1-OH 3.06Å; Q1042-Y1046 HydrophobicContact CG-CD2 4.09Å; Q1042-Y1046 HydrophobicContact CG-CE2 3.91Å; Q1042-Y1046 VanDerWaalsContact O-CD2 3.28Å; Q1042-Y1046 WeakPolarHBondContact O-CD2 3.49Å; Q1042-Y1046 PolarHBondContact O-N 3.41Å; Q1042-Y1046 VanDerWaalsContact O-N 3.12Å; V1043-Y1046 PolarHBondContact O-N 2.93Å; L1044-Y1046 VanDerWaalsContact C-N 3.34Å; L1044-Y1046 PolarHBondContact O-N 3.18Å; Y1046-L1049 HydrophobicContact CD1-CD1 4.35Å; Y1046-L1049 PolarHBondContact O-N 2.7Å; Y1046-L1050 WeakPolarHBondContact O-CB 3.24Å; Y1046-L1050 WeakPolarHBondContact O-CD1 3.45Å; Y1046-L1050 VanDerWaalsContact O-CG 3.27Å; Y1046-L1050 WeakPolarHBondContact O-CG 3.23Å; Y1046-L1050 PolarHBondContact O-N 3.49Å; Y1046-I1144 HydrophobicContact CD1-CD1 3.71Å; Y1046-I1144 HydrophobicContact CD2-CG2 3.85Å; Y1046-I1144 HydrophobicContact CE1-CD1 4.18Å; Y1046-I1144 HydrophobicContact CE1-CG2 4.49Å; Y1046-I1144 HydrophobicContact CE2-CG2 3.79Å; Y1046-I1144 HydrophobicContact CG-CD1 3.92Å; Y1046-I1144 HydrophobicContact CG-CG2 4.22Å; Y1046-L1146 HydrophobicContact CD2-CD2 3.87Å; Y1046-L1146 HydrophobicContact CE2-CD2 3.58Å
1047	C	94.1	Very high	88.1	Confident	0 Å²	0	37.5 Å²	37.5	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-60	-47.7	174.9	-65.2	0	0	0	0	111.2	V1043 L1044 L1049 L1050 A1051 L1080 L1085 I1088	V1043-C1047 PolarHBondContact O-N 3.18Å; V1043-C1047 PolarHBondContact O-SG 2.79Å; L1044-C1047 WeakPolarHBondContact O-CB 3.38Å; L1044-C1047 PolarHBondContact O-N 3.2Å; L1044-C1047 VanDerWaalsContact O-N 3.13Å; C1047-L1049 PolarHBondContact O-N 3.47Å; C1047-L1050 PolarHBondContact O-N 3.22Å; C1047-A1051 VanDerWaalsContact O-CB 3.3Å; C1047-A1051 WeakPolarHBondContact O-CB 3.17Å; C1047-A1051 PolarHBondContact O-N 2.94Å; C1047-L1080 HydrophobicContact CB-CD2 3.79Å; C1047-L1085 HydrophobicContact CB-CD1 4.24Å; C1047-I1088 HydrophobicContact CB-CD1 3.72Å
1048	C	90	Very high	88	Confident	31 Å²	31	37 Å²	37	21%	0.209	19%	0.193	C	C	.	.	H	α-helix	trans	-62	-43.6	176.2	-65.9	0	0	0	0	112.2	L1044 R1045 L1050 A1051 H1052	L1044-C1048 PolarHBondContact O-N 3.04Å; L1044-C1048 PolarHBondContact O-SG 2.92Å; L1044-C1048 VanDerWaalsContact O-SG 3.37Å; R1045-C1048 PolarHBondContact O-N 3.07Å; C1048-L1050 VanDerWaalsContact C-N 3.25Å; C1048-L1050 PolarHBondContact O-N 3.34Å; C1048-A1051 PolarHBondContact O-N 2.96Å; C1048-H1052 WeakPolarHBondContact O-CB 3.32Å; C1048-H1052 PolarHBondContact O-CD2 2.77Å; C1048-H1052 PolarHBondContact O-N 3.21Å
1049	L	90.2	Very high	88.2	Confident	67 Å²	67	39.7 Å²	39.7	35%	0.351	21%	0.212	S	C	.	.	H	α-helix	trans	-62.7	-31.1	178.1	-74.4	173.5	0	0	0	112.9	W1006 K1008 R1045 Y1046 C1047 S1053	W1006-L1049 HydrophobicContact CZ2-CB 3.9Å; K1008-L1049 HydrophobicContact CG-CD1 4.34Å; R1045-L1049 WeakPolarHBondContact O-CB 3.23Å; R1045-L1049 WeakPolarHBondContact O-CG 3.36Å; R1045-L1049 PolarHBondContact O-N 3.2Å; Y1046-L1049 HydrophobicContact CD1-CD1 4.35Å; Y1046-L1049 PolarHBondContact O-N 2.7Å; C1047-L1049 PolarHBondContact O-N 3.47Å; L1049-S1053 VanDerWaalsContact O-CB 3.3Å; L1049-S1053 WeakPolarHBondContact O-CB 3.28Å; L1049-S1053 PolarHBondContact O-N 3.17Å
1050	L	92.5	Very high	88	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-81.6	-44.2	177	-71.1	163.3	0	0	0	111.9	W1006 Y1046 C1047 C1048 V1058 I1063 V1103 I1105 L1142 I1144	W1006-L1050 HydrophobicContact CD2-CD2 4.21Å; W1006-L1050 HydrophobicContact CE3-CD2 4.32Å; W1006-L1050 HydrophobicContact CH2-CD2 3.67Å; W1006-L1050 HydrophobicContact CH2-CG 3.89Å; W1006-L1050 HydrophobicContact CZ2-CD2 3.53Å; W1006-L1050 HydrophobicContact CZ2-CG 3.79Å; W1006-L1050 HydrophobicContact CZ3-CD2 4.08Å; Y1046-L1050 WeakPolarHBondContact O-CB 3.24Å; Y1046-L1050 WeakPolarHBondContact O-CD1 3.45Å; Y1046-L1050 VanDerWaalsContact O-CG 3.27Å; Y1046-L1050 WeakPolarHBondContact O-CG 3.23Å; Y1046-L1050 PolarHBondContact O-N 3.49Å; C1047-L1050 PolarHBondContact O-N 3.22Å; C1048-L1050 VanDerWaalsContact C-N 3.25Å; C1048-L1050 PolarHBondContact O-N 3.34Å; L1050-V1058 HydrophobicContact CD2-CG2 4.39Å; L1050-V1058 PolarHBondContact O-N 2.71Å; L1050-V1058 VanDerWaalsContact O-N 3.13Å; L1050-I1063 HydrophobicContact CB-CD1 3.88Å; L1050-I1063 HydrophobicContact CD1-CD1 4.4Å; L1050-V1103 HydrophobicContact CD1-CB 4.46Å; L1050-V1103 HydrophobicContact CD1-CG1 3.72Å; L1050-V1103 HydrophobicContact CD2-CG2 4.47Å; L1050-I1105 HydrophobicContact CD1-CD1 4.25Å; L1050-L1142 HydrophobicContact CD2-CD2 3.86Å; L1050-I1144 HydrophobicContact CD1-CD1 4.32Å
1051	A	89.3	Confident	87.9	Confident	6 Å²	6	43.6 Å²	43.6	5%	0.05	24%	0.24	C	C	.	.	H	α-helix	trans	-73.7	-26.8	-177.2	0	0	0	0	0	113.7	C1047 C1048 Q1057 L1085	C1047-A1051 VanDerWaalsContact O-CB 3.3Å; C1047-A1051 WeakPolarHBondContact O-CB 3.17Å; C1047-A1051 PolarHBondContact O-N 2.94Å; C1048-A1051 PolarHBondContact O-N 2.96Å; A1051-Q1057 VanDerWaalsContact O-CG 3.27Å; A1051-Q1057 WeakPolarHBondContact O-CG 3.18Å; A1051-Q1057 PolarHBondContact O-NE2 2.78Å; A1051-L1085 HydrophobicContact CB-CD1 4Å; A1051-L1085 HydrophobicContact CB-CD2 3.63Å
1052	H	84.8	Confident	88.1	Confident	124 Å²	124	47.1 Å²	47.1	57%	0.574	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.2	17.5	179.4	-55.1	-55.1	0	0	0	113.2	C1048 I1054	C1048-H1052 WeakPolarHBondContact O-CB 3.32Å; C1048-H1052 PolarHBondContact O-CD2 2.77Å; C1048-H1052 PolarHBondContact O-N 3.21Å; H1052-I1054 PolarHBondContact O-N 2.58Å
1053	S	77.7	Confident	88.3	Confident	9 Å²	9	46.3 Å²	46.3	6%	0.063	26%	0.255	C	S	.	.			trans	-63.5	127.8	174.6	-177	0	0	0	0	111	L1049 S1056	L1049-S1053 VanDerWaalsContact O-CB 3.3Å; L1049-S1053 WeakPolarHBondContact O-CB 3.28Å; L1049-S1053 PolarHBondContact O-N 3.17Å; S1053-S1056 WeakPolarHBondContact CB-O 3.38Å; S1053-S1056 PolarHBondContact OG-N 3.03Å
1054	I	70.7	Confident	88.3	Confident	179 Å²	179	46.3 Å²	46.3	92%	0.918	26%	0.255	S	S	*	.	S	Bend	trans	-70.3	-36.4	177.6	-59.3	169.2	0	0	0	111.1	H1052	H1052-I1054 PolarHBondContact O-N 2.58Å
1055	S	69.9	Low	88.6	Confident	74 Å²	74	45.7 Å²	45.7	52%	0.517	25%	0.252	S	S	.	.	S	Bend	trans	-87.6	-28.5	-172.4	69.1	0	0	0	0	114
1056	S	76.8	Confident	88.9	Confident	28 Å²	28	43 Å²	43	20%	0.196	24%	0.242	C	C	.	.	S	Bend	trans	-155.3	66.4	-168	-46.5	0	0	0	0	109.3	S1053 V1058	S1053-S1056 WeakPolarHBondContact CB-O 3.38Å; S1053-S1056 PolarHBondContact OG-N 3.03Å; S1056-V1058 PolarHBondContact O-N 3.12Å
1057	Q	83.9	Confident	88.9	Confident	151 Å²	151	42.5 Å²	42.5	71%	0.706	24%	0.24	S	C	*	.	P	Polyproline II helix	trans	-66.4	125.4	-179.6	-167.5	175.3	4.2	0	0	110.2	A1051	A1051-Q1057 VanDerWaalsContact O-CG 3.27Å; A1051-Q1057 WeakPolarHBondContact O-CG 3.18Å; A1051-Q1057 PolarHBondContact O-NE2 2.78Å
1058	V	90.5	Very high	88.7	Confident	7 Å²	7	43.6 Å²	43.6	4%	0.042	25%	0.247	C	C	.	.	P	Polyproline II helix	trans	-103.1	132.9	176.8	-176.6	0	0	0	0	109.1	L1003 L1050 S1056 D1062 I1063 L1102 V1103	L1003-V1058 HydrophobicContact CD1-CG2 4.12Å; L1003-V1058 HydrophobicContact CD2-CG2 3.77Å; L1050-V1058 HydrophobicContact CD2-CG2 4.39Å; L1050-V1058 PolarHBondContact O-N 2.71Å; L1050-V1058 VanDerWaalsContact O-N 3.13Å; S1056-V1058 PolarHBondContact O-N 3.12Å; V1058-D1062 HydrophobicContact CG1-CB 3.9Å; V1058-I1063 HydrophobicContact CB-CD1 4.38Å; V1058-I1063 HydrophobicContact CB-CG1 4.42Å; V1058-I1063 HydrophobicContact CG1-CD1 4.2Å; V1058-I1063 HydrophobicContact CG1-CG1 3.72Å; V1058-L1102 HydrophobicContact CG1-CD2 4.18Å; V1058-V1103 HydrophobicContact CG1-CG2 4.19Å; V1058-V1103 HydrophobicContact CG2-CG2 4.36Å
1059	S	92.3	Very high	88.6	Confident	59 Å²	59	42.6 Å²	42.6	41%	0.413	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-60.9	140.7	172.9	-179	0	0	0	0	110.4	S1061 D1062	S1059-S1061 PolarHBondContact O-N 2.95Å; S1059-S1061 PolarHBondContact OG-N 2.8Å; S1059-S1061 PolarHBondContact OG-OG 3Å; S1059-D1062 WeakPolarHBondContact O-CB 3.3Å; S1059-D1062 PolarHBondContact O-N 3.04Å
1060	A	91.7	Very high	88.4	Confident	17 Å²	17	45 Å²	45	14%	0.14	24%	0.243	C	C	.	.	G	3₁₀ helix	trans	-55.7	-35.4	176.1	0	0	0	0	0	112.3	D1062 I1063 D1087 I1088	A1060-D1062 PolarHBondContact O-N 2.87Å; A1060-I1063 PolarHBondContact O-N 3.41Å; A1060-D1087 HydrophobicContact CB-CB 3.87Å; A1060-I1088 HydrophobicContact CB-CG1 3.89Å
1061	S	92.6	Very high	88.2	Confident	65 Å²	65	45.8 Å²	45.8	46%	0.455	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-66.1	-19.3	176.6	62.5	0	0	0	0	114.4	S1059 Y1101	S1059-S1061 PolarHBondContact O-N 2.95Å; S1059-S1061 PolarHBondContact OG-N 2.8Å; S1059-S1061 PolarHBondContact OG-OG 3Å; S1061-Y1101 WeakPolarHBondContact O-CD1 3.45Å; S1061-Y1101 WeakPolarHBondContact O-CE1 3.32Å
1062	D	95.4	Very high	88.4	Confident	73 Å²	73	45.5 Å²	45.5	39%	0.39	24%	0.244	S	C	.	.	G	3₁₀ helix	trans	-94.6	2.6	-179.9	-71.1	-38.6	0	0	0	112.9	V1058 S1059 A1060 L1102 V1103	V1058-D1062 HydrophobicContact CG1-CB 3.9Å; S1059-D1062 WeakPolarHBondContact O-CB 3.3Å; S1059-D1062 PolarHBondContact O-N 3.04Å; A1060-D1062 PolarHBondContact O-N 2.87Å; D1062-L1102 HydrophobicContact CB-CB 3.92Å; D1062-L1102 PolarHBondContact O-N 2.86Å; D1062-L1102 VanDerWaalsContact O-N 3.1Å; D1062-V1103 PolarHBondContact O-N 3.3Å; D1062-V1103 VanDerWaalsContact O-N 3.11Å
1063	I	96.9	Very high	88.8	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	127.9	177.3	-54.6	173.9	0	0	0	109.3	L1050 V1058 A1060 I1088 K1089 V1103 I1105	L1050-I1063 HydrophobicContact CB-CD1 3.88Å; L1050-I1063 HydrophobicContact CD1-CD1 4.4Å; V1058-I1063 HydrophobicContact CB-CD1 4.38Å; V1058-I1063 HydrophobicContact CB-CG1 4.42Å; V1058-I1063 HydrophobicContact CG1-CD1 4.2Å; V1058-I1063 HydrophobicContact CG1-CG1 3.72Å; A1060-I1063 PolarHBondContact O-N 3.41Å; I1063-I1088 HydrophobicContact CB-CD1 4.36Å; I1063-I1088 HydrophobicContact CB-CG1 4.26Å; I1063-I1088 HydrophobicContact CB-CG2 4.22Å; I1063-I1088 HydrophobicContact CD1-CD1 4.16Å; I1063-I1088 HydrophobicContact CG2-CD1 4.31Å; I1063-I1088 HydrophobicContact CG2-CG2 3.97Å; I1063-K1089 PolarHBondContact O-N 2.9Å; I1063-V1103 HydrophobicContact CG1-CB 4.49Å; I1063-I1105 HydrophobicContact CG2-CD1 4.45Å
1064	G	97.5	Very high	89.4	Confident	0 Å²	0	42.1 Å²	42.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	135.3	171.9	0	0	0	0	0	112.2	K1089 V1103 I1104 I1105	G1064-K1089 CarbonylContact C-O 3.58Å; G1064-V1103 PolarHBondContact N-O 2.81Å; G1064-I1104 CarbonylContact O-C 3.59Å; G1064-I1104 VanDerWaalsContact O-CA 3.31Å; G1064-I1104 WeakPolarHBondContact O-CA 3.45Å; G1064-I1105 PolarHBondContact O-N 3.37Å
1065	V	98.3	Very high	90.4	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	118.3	173.5	-178.1	0	0	0	0	110	V1043 I1076 I1088 K1089 V1090 G1091 F1096 I1105	V1043-V1065 HydrophobicContact CG1-CB 4.48Å; V1043-V1065 HydrophobicContact CG1-CG1 3.78Å; V1043-V1065 HydrophobicContact CG1-CG2 3.82Å; V1043-V1065 HydrophobicContact CG2-CG1 4.48Å; V1065-I1076 HydrophobicContact CG1-CD1 4.04Å; V1065-I1076 HydrophobicContact CG1-CG2 4.43Å; V1065-I1088 HydrophobicContact CG2-CG2 3.86Å; V1065-K1089 PolarHBondContact N-O 3.25Å; V1065-V1090 HydrophobicContact CB-CB 4.34Å; V1065-V1090 HydrophobicContact CB-CG1 4.05Å; V1065-V1090 HydrophobicContact CB-CG2 4.09Å; V1065-V1090 HydrophobicContact CG1-CG1 4.05Å; V1065-V1090 HydrophobicContact CG2-CG2 4.38Å; V1065-V1090 WeakPolarHBondContact O-CA 3.25Å; V1065-G1091 PolarHBondContact O-N 3.2Å; V1065-F1096 VanDerWaalsContact O-CE2 3.31Å; V1065-F1096 WeakPolarHBondContact O-CE2 3.45Å; V1065-F1096 WeakPolarHBondContact O-CZ 2.99Å; V1065-I1105 CarbonylContact C-O 3.55Å; V1065-I1105 VanDerWaalsContact CA-O 3.31Å; V1065-I1105 WeakPolarHBondContact CA-O 3.5Å; V1065-I1105 HydrophobicContact CG2-CB 4.34Å
1066	I	96.9	Very high	91.6	Very high	2 Å²	2	30.3 Å²	30.3	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	127.5	179.5	-58.7	-179.3	0	0	0	109.3	G1091 V1093 F1096 I1104 I1105 I1106 S1107 A1135 R1138	I1066-G1091 WeakPolarHBondContact CA-O 3.32Å; I1066-V1093 HydrophobicContact CG2-CB 4.43Å; I1066-V1093 HydrophobicContact CG2-CG2 3.59Å; I1066-F1096 HydrophobicContact CD1-CB 4.15Å; I1066-F1096 HydrophobicContact CD1-CD1 4.08Å; I1066-F1096 HydrophobicContact CD1-CD2 4.35Å; I1066-F1096 HydrophobicContact CD1-CG 3.94Å; I1066-F1096 HydrophobicContact CG1-CB 4.45Å; I1066-F1096 HydrophobicContact CG1-CD1 3.97Å; I1066-F1096 HydrophobicContact CG1-CD2 3.73Å; I1066-F1096 HydrophobicContact CG1-CE1 4.06Å; I1066-F1096 HydrophobicContact CG1-CE2 3.8Å; I1066-F1096 HydrophobicContact CG1-CG 3.79Å; I1066-F1096 HydrophobicContact CG1-CZ 3.96Å; I1066-I1104 HydrophobicContact CD1-CD1 4.32Å; I1066-I1104 HydrophobicContact CD1-CG2 3.78Å; I1066-I1104 HydrophobicContact CG1-CG2 4.13Å; I1066-I1105 PolarHBondContact N-O 2.85Å; I1066-I1106 HydrophobicContact CB-CG1 4.4Å; I1066-I1106 WeakPolarHBondContact O-CA 3.27Å; I1066-S1107 PolarHBondContact O-N 2.88Å; I1066-A1135 HydrophobicContact CD1-CB 4.38Å; I1066-A1135 HydrophobicContact CG2-CB 4.31Å; I1066-R1138 HydrophobicContact CD1-CB 4.22Å; I1066-R1138 HydrophobicContact CD1-CG 3.81Å
1067	T	95.5	Very high	92.4	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.172	C	C	.	.			trans	-147.1	139.1	171.8	-176.4	0	0	0	0	111.7	Y1069 Q1072 V1073 I1076 G1091 S1092 S1107 V1109	T1067-Y1069 PolarHBondContact O-N 3.45Å; T1067-Q1072 HydrophobicContact CG2-CB 3.86Å; T1067-Q1072 HydrophobicContact CG2-CG 3.87Å; T1067-Q1072 WeakPolarHBondContact OG1-CG 3.16Å; T1067-V1073 HydrophobicContact CG2-CB 4.37Å; T1067-V1073 HydrophobicContact CG2-CG2 3.42Å; T1067-V1073 VanDerWaalsContact CG2-CG2 3.42Å; T1067-I1076 HydrophobicContact CG2-CD1 4.44Å; T1067-G1091 PolarHBondContact N-O 2.82Å; T1067-S1092 WeakPolarHBondContact O-CA 3.23Å; T1067-S1107 WeakPolarHBondContact CA-O 3.42Å; T1067-S1107 WeakPolarHBondContact CB-O 3.5Å; T1067-S1107 PolarHBondContact OG1-O 2.98Å; T1067-V1109 VanDerWaalsContact OG1-CG2 3.31Å; T1067-V1109 WeakPolarHBondContact OG1-CG2 3.22Å
1068	P	89.5	Confident	92.7	Very high	23 Å²	23	29.8 Å²	29.8	15%	0.149	15%	0.151	C	C	.	.	S	Bend	trans	-73.8	-11.9	-172	26.1	-31	0	0	0	114.3	S1107 F1125 L1126	P1068-S1107 WeakPolarHBondContact CD-O 3.39Å; P1068-F1125 HydrophobicContact CB-CB 4.01Å; P1068-L1126 HydrophobicContact CG-CD2 4.03Å
1069	Y	89	Confident	92.7	Very high	10 Å²	10	29.6 Å²	29.6	4%	0.039	15%	0.15	C	C	.	.			trans	-114.4	125.6	-174.4	-62.3	-80.1	0	0	0	111.6	W1034 T1067 K1071 Q1072 V1073 V1109 R1110 F1125	W1034-Y1069 HydrophobicContact CB-CD1 3.99Å; W1034-Y1069 HydrophobicContact CB-CD2 4.45Å; W1034-Y1069 HydrophobicContact CB-CE1 4.14Å; W1034-Y1069 HydrophobicContact CB-CG 4.17Å; W1034-Y1069 AromaticContact CD1-CE1 3.62Å; W1034-Y1069 HydrophobicContact CG-CD1 4.5Å; W1034-Y1069 HydrophobicContact CG-CE1 4.27Å; W1034-Y1069 WeakPolarHBondContact O-CB 3.19Å; T1067-Y1069 PolarHBondContact O-N 3.45Å; Y1069-K1071 PolarHBondContact O-N 2.92Å; Y1069-Q1072 WeakPolarHBondContact O-CB 3.33Å; Y1069-Q1072 PolarHBondContact O-N 3.39Å; Y1069-V1073 PolarHBondContact O-N 3Å; Y1069-V1073 VanDerWaalsContact O-N 3.12Å; Y1069-V1109 HydrophobicContact CD2-CB 3.61Å; Y1069-V1109 HydrophobicContact CD2-CG1 3.84Å; Y1069-V1109 HydrophobicContact CD2-CG2 3.76Å; Y1069-V1109 HydrophobicContact CE2-CB 3.95Å; Y1069-V1109 HydrophobicContact CE2-CG1 4.3Å; Y1069-V1109 HydrophobicContact CE2-CG2 4.49Å; Y1069-R1110 HydrophobicContact CE2-CG 3.95Å; Y1069-R1110 WeakPolarHBondContact OH-CD 3.47Å; Y1069-R1110 WeakPolarHBondContact OH-CG 3.36Å; Y1069-F1125 HydrophobicContact CD1-CD2 4.21Å; Y1069-F1125 HydrophobicContact CD1-CE2 4.44Å; Y1069-F1125 AromaticContact CE1-CD2 3.71Å; Y1069-F1125 HydrophobicContact CE1-CD2 3.71Å; Y1069-F1125 HydrophobicContact CE1-CE2 4.15Å
1070	R	85.5	Confident	92.7	Very high	118 Å²	118	26.9 Å²	26.9	45%	0.445	13%	0.131	S	C	.	.	H	α-helix	trans	-58.6	-36.8	-179.6	-170.5	-179.9	-175.7	109.8	5.1	112.3	A574 E575 S1033 Q1072 V1073 E1074	A574-R1070 PolarHBondContact O-NH2 3.43Å; A574-R1070 VanDerWaalsContact O-NH2 3.16Å; E575-R1070 PolarHBondContact O-NE 2.89Å; E575-R1070 VanDerWaalsContact O-NE 3.11Å; E575-R1070 PolarHBondContact O-NH1 3.11Å; E575-R1070 PolarHBondContact O-NH2 3.41Å; E575-R1070 VanDerWaalsContact O-NH2 3.13Å; S1033-R1070 PolarHBondContact OG-N 3.08Å; R1070-Q1072 VanDerWaalsContact C-N 3.31Å; R1070-Q1072 PolarHBondContact O-N 3.3Å; R1070-V1073 WeakPolarHBondContact O-CA 3.36Å; R1070-V1073 VanDerWaalsContact O-CB 3.29Å; R1070-V1073 WeakPolarHBondContact O-CB 3.35Å; R1070-V1073 PolarHBondContact O-N 3.06Å; R1070-V1073 VanDerWaalsContact O-N 3.12Å; R1070-E1074 PolarHBondContact O-N 3.31Å
1071	K	88.1	Confident	92.7	Very high	16 Å²	16	34.5 Å²	34.5	7%	0.07	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-35.9	177	-158.2	71.1	-170.3	171	0	112.4	E1028 S1033 F1035 Y1069 E1074 K1075	E1028-K1071 HydrophobicContact CG-CD 4.42Å; E1028-K1071 VanDerWaalsContact CG-CE 3.45Å; E1028-K1071 WeakPolarHBondContact OE1-CE 3.31Å; E1028-K1071 IonicContact OE1-NZ 2.72Å; E1028-K1071 PolarHBondContact OE1-NZ 2.89Å; S1033-K1071 WeakPolarHBondContact OG-CB 3.39Å; S1033-K1071 PolarHBondContact OG-N 3.42Å; F1035-K1071 HydrophobicContact CB-CB 4.26Å; F1035-K1071 HydrophobicContact CB-CG 4.2Å; F1035-K1071 HydrophobicContact CD1-CB 4.48Å; F1035-K1071 HydrophobicContact CD1-CG 3.77Å; F1035-K1071 HydrophobicContact CG-CG 4.25Å; Y1069-K1071 PolarHBondContact O-N 2.92Å; K1071-E1074 WeakPolarHBondContact CD-OE2 3.45Å; K1071-E1074 VanDerWaalsContact CE-OE2 3.32Å; K1071-E1074 WeakPolarHBondContact CE-OE2 3.28Å; K1071-E1074 IonicContact NZ-OE1 3.57Å; K1071-E1074 PolarHBondContact NZ-OE1 3.17Å; K1071-E1074 IonicContact NZ-OE2 3.54Å; K1071-E1074 PolarHBondContact NZ-OE2 3.41Å; K1071-E1074 PolarHBondContact O-N 3.36Å; K1071-K1075 WeakPolarHBondContact O-CG 3.43Å; K1071-K1075 PolarHBondContact O-N 3.41Å
1072	Q	93.8	Very high	92.4	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-41.4	170.8	-169.8	75.5	-14	0	0	111.5	F1035 N1036 T1067 Y1069 R1070 E1074 K1075 I1076 S1107 V1109	F1035-Q1072 VanDerWaalsContact CA-OE1 3.29Å; F1035-Q1072 HydrophobicContact CB-CB 4.5Å; N1036-Q1072 PolarHBondContact O-NE2 3.13Å; N1036-Q1072 PolarHBondContact O-OE1 2.69Å; T1067-Q1072 HydrophobicContact CG2-CB 3.86Å; T1067-Q1072 HydrophobicContact CG2-CG 3.87Å; T1067-Q1072 WeakPolarHBondContact OG1-CG 3.16Å; Y1069-Q1072 WeakPolarHBondContact O-CB 3.33Å; Y1069-Q1072 PolarHBondContact O-N 3.39Å; R1070-Q1072 VanDerWaalsContact C-N 3.31Å; R1070-Q1072 PolarHBondContact O-N 3.3Å; Q1072-E1074 VanDerWaalsContact C-N 3.33Å; Q1072-E1074 PolarHBondContact O-N 3.1Å; Q1072-K1075 PolarHBondContact O-N 3.06Å; Q1072-I1076 HydrophobicContact CG-CD1 3.78Å; Q1072-I1076 HydrophobicContact CG-CG1 4.39Å; Q1072-I1076 WeakPolarHBondContact O-CB 3.47Å; Q1072-I1076 VanDerWaalsContact O-CG1 3.27Å; Q1072-I1076 WeakPolarHBondContact O-CG1 3.26Å; Q1072-I1076 PolarHBondContact O-N 3.48Å; Q1072-S1107 PolarHBondContact NE2-OG 3.12Å; Q1072-S1107 VanDerWaalsContact NE2-OG 3.11Å; Q1072-V1109 HydrophobicContact CB-CG2 3.8Å; Q1072-V1109 HydrophobicContact CG-CG2 3.53Å
1073	V	92.7	Very high	92.1	Very high	5 Å²	5	35 Å²	35	3%	0.03	16%	0.156	C	C	.	.	H	α-helix	trans	-55.8	-48.6	174	175	0	0	0	0	110.9	T1067 Y1069 R1070 I1076 R1077 V1090	T1067-V1073 HydrophobicContact CG2-CB 4.37Å; T1067-V1073 HydrophobicContact CG2-CG2 3.42Å; T1067-V1073 VanDerWaalsContact CG2-CG2 3.42Å; Y1069-V1073 PolarHBondContact O-N 3Å; Y1069-V1073 VanDerWaalsContact O-N 3.12Å; R1070-V1073 WeakPolarHBondContact O-CA 3.36Å; R1070-V1073 VanDerWaalsContact O-CB 3.29Å; R1070-V1073 WeakPolarHBondContact O-CB 3.35Å; R1070-V1073 PolarHBondContact O-N 3.06Å; R1070-V1073 VanDerWaalsContact O-N 3.12Å; V1073-I1076 PolarHBondContact O-N 2.67Å; V1073-R1077 HydrophobicContact CG1-CG 4.43Å; V1073-R1077 WeakPolarHBondContact O-CB 3.26Å; V1073-R1077 VanDerWaalsContact O-CG 3.32Å; V1073-R1077 WeakPolarHBondContact O-CG 3.31Å; V1073-R1077 PolarHBondContact O-N 3.12Å; V1073-V1090 HydrophobicContact CB-CG1 4.21Å; V1073-V1090 HydrophobicContact CG1-CB 4.19Å; V1073-V1090 HydrophobicContact CG1-CG1 3.85Å; V1073-V1090 HydrophobicContact CG2-CG1 4.32Å
1074	E	89.6	Confident	91.7	Very high	57 Å²	57	41.5 Å²	41.5	27%	0.266	19%	0.19	S	C	.	.	H	α-helix	trans	-59.9	-51	178.7	-174.2	-163.6	136.6	0	0	111.9	R1070 K1071 Q1072 I1076 R1077 I1078	R1070-E1074 PolarHBondContact O-N 3.31Å; K1071-E1074 WeakPolarHBondContact CD-OE2 3.45Å; K1071-E1074 VanDerWaalsContact CE-OE2 3.32Å; K1071-E1074 WeakPolarHBondContact CE-OE2 3.28Å; K1071-E1074 IonicContact NZ-OE1 3.57Å; K1071-E1074 PolarHBondContact NZ-OE1 3.17Å; K1071-E1074 IonicContact NZ-OE2 3.54Å; K1071-E1074 PolarHBondContact NZ-OE2 3.41Å; K1071-E1074 PolarHBondContact O-N 3.36Å; Q1072-E1074 VanDerWaalsContact C-N 3.33Å; Q1072-E1074 PolarHBondContact O-N 3.1Å; E1074-I1076 VanDerWaalsContact C-N 3.33Å; E1074-I1076 PolarHBondContact O-N 3.36Å; E1074-R1077 PolarHBondContact O-N 2.88Å; E1074-I1078 HydrophobicContact CG-CD1 4.26Å; E1074-I1078 WeakPolarHBondContact O-CG1 3.04Å; E1074-I1078 PolarHBondContact O-N 2.78Å
1075	K	92.1	Very high	91.4	Very high	4 Å²	4	42.1 Å²	42.1	2%	0.017	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-41	180	-63.6	-55.6	-170.3	165.2	0	112	I454 A455 E1028 F1035 K1071 Q1072 I1078 L1079	I454-K1075 HydrophobicContact CB-CB 4.37Å; I454-K1075 HydrophobicContact CB-CD 4.01Å; I454-K1075 HydrophobicContact CB-CG 4.5Å; I454-K1075 HydrophobicContact CD1-CB 4.34Å; I454-K1075 HydrophobicContact CG2-CB 4.39Å; I454-K1075 HydrophobicContact CG2-CD 4.34Å; I454-K1075 WeakPolarHBondContact O-CE 3.45Å; I454-K1075 PolarHBondContact O-NZ 3.5Å; A455-K1075 PolarHBondContact O-NZ 3.37Å; E1028-K1075 VanDerWaalsContact CD-NZ 3.26Å; E1028-K1075 WeakPolarHBondContact OE1-CE 3.47Å; E1028-K1075 IonicContact OE1-NZ 3.16Å; E1028-K1075 PolarHBondContact OE1-NZ 3.03Å; E1028-K1075 VanDerWaalsContact OE1-NZ 3.1Å; E1028-K1075 IonicContact OE2-NZ 3.32Å; E1028-K1075 PolarHBondContact OE2-NZ 3Å; F1035-K1075 HydrophobicContact CB-CG 4.28Å; F1035-K1075 HydrophobicContact CD2-CG 3.92Å; F1035-K1075 HydrophobicContact CE2-CG 4.49Å; F1035-K1075 HydrophobicContact CG-CG 4.18Å; K1071-K1075 WeakPolarHBondContact O-CG 3.43Å; K1071-K1075 PolarHBondContact O-N 3.41Å; Q1072-K1075 PolarHBondContact O-N 3.06Å; K1075-I1078 PolarHBondContact O-N 3.46Å; K1075-L1079 WeakPolarHBondContact O-CG 3.44Å; K1075-L1079 PolarHBondContact O-N 2.96Å; K1075-L1079 VanDerWaalsContact O-N 3.13Å
1076	I	94.9	Very high	91	Very high	1 Å²	1	47.7 Å²	47.7	1%	0.005	22%	0.221	C	C	.	.	H	α-helix	trans	-65.7	-42.8	176.3	-67.2	169.8	0	0	0	110.8	A1040 V1043 V1065 T1067 Q1072 V1073 E1074 I1078 L1079 L1080 V1090	A1040-I1076 HydrophobicContact CB-CG1 3.81Å; V1043-I1076 HydrophobicContact CB-CD1 4.37Å; V1043-I1076 HydrophobicContact CG1-CD1 4.33Å; V1043-I1076 HydrophobicContact CG1-CG2 3.98Å; V1043-I1076 HydrophobicContact CG2-CD1 4.03Å; V1065-I1076 HydrophobicContact CG1-CD1 4.04Å; V1065-I1076 HydrophobicContact CG1-CG2 4.43Å; T1067-I1076 HydrophobicContact CG2-CD1 4.44Å; Q1072-I1076 HydrophobicContact CG-CD1 3.78Å; Q1072-I1076 HydrophobicContact CG-CG1 4.39Å; Q1072-I1076 WeakPolarHBondContact O-CB 3.47Å; Q1072-I1076 VanDerWaalsContact O-CG1 3.27Å; Q1072-I1076 WeakPolarHBondContact O-CG1 3.26Å; Q1072-I1076 PolarHBondContact O-N 3.48Å; V1073-I1076 PolarHBondContact O-N 2.67Å; E1074-I1076 VanDerWaalsContact C-N 3.33Å; E1074-I1076 PolarHBondContact O-N 3.36Å; I1076-I1078 VanDerWaalsContact C-N 3.3Å; I1076-I1078 PolarHBondContact O-N 2.85Å; I1076-L1079 WeakPolarHBondContact O-CB 3.38Å; I1076-L1079 PolarHBondContact O-N 3.18Å; I1076-L1080 HydrophobicContact CG2-CD1 3.8Å; I1076-L1080 HydrophobicContact CG2-CG 4.14Å; I1076-L1080 WeakPolarHBondContact O-CG 3.24Å; I1076-L1080 PolarHBondContact O-N 2.95Å; I1076-V1090 HydrophobicContact CB-CG1 4.12Å; I1076-V1090 HydrophobicContact CG2-CG1 3.95Å; I1076-V1090 HydrophobicContact CG2-CG2 3.93Å
1077	R	93.6	Very high	90.7	Very high	114 Å²	114	53.7 Å²	53.7	43%	0.43	25%	0.253	S	S	.	.	H	α-helix	trans	-60.9	-38.8	176.7	-75.3	178.2	-176	170.2	4.1	112.3	V1073 E1074 L1080 R1081 V1090	V1073-R1077 HydrophobicContact CG1-CG 4.43Å; V1073-R1077 WeakPolarHBondContact O-CB 3.26Å; V1073-R1077 VanDerWaalsContact O-CG 3.32Å; V1073-R1077 WeakPolarHBondContact O-CG 3.31Å; V1073-R1077 PolarHBondContact O-N 3.12Å; E1074-R1077 PolarHBondContact O-N 2.88Å; R1077-L1080 PolarHBondContact O-N 3.18Å; R1077-R1081 WeakPolarHBondContact O-CB 3.22Å; R1077-R1081 PolarHBondContact O-N 3.34Å; R1077-V1090 HydrophobicContact CG-CB 4.04Å; R1077-V1090 HydrophobicContact CG-CG2 4.13Å; R1077-V1090 PolarHBondContact NH2-O 3.03Å
1078	I	90.2	Very high	90.7	Very high	54 Å²	54	54 Å²	54	28%	0.277	26%	0.255	S	S	.	.	H	α-helix	trans	-60.4	-47.9	174.1	-67.3	165.8	0	0	0	110.4	I454 E1074 K1075 I1076 R1081 N1082	I454-I1078 HydrophobicContact CG2-CG2 4.39Å; E1074-I1078 HydrophobicContact CG-CD1 4.26Å; E1074-I1078 WeakPolarHBondContact O-CG1 3.04Å; E1074-I1078 PolarHBondContact O-N 2.78Å; K1075-I1078 PolarHBondContact O-N 3.46Å; I1076-I1078 VanDerWaalsContact C-N 3.3Å; I1076-I1078 PolarHBondContact O-N 2.85Å; I1078-R1081 PolarHBondContact O-N 2.87Å; I1078-N1082 PolarHBondContact O-N 2.85Å; I1078-N1082 PolarHBondContact O-OD1 2.94Å
1079	L	91	Very high	91	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.016	26%	0.261	C	S	.	.	H	α-helix	trans	-60.7	-45.6	177.8	-72.7	-179.8	0	0	0	112.5	E450 I454 A1040 V1041 L1044 K1075 I1076 R1081 N1082	E450-L1079 HydrophobicContact CB-CD2 4.41Å; I454-L1079 HydrophobicContact CD1-CD1 3.83Å; I454-L1079 HydrophobicContact CD1-CG 4.34Å; I454-L1079 HydrophobicContact CG2-CD2 3.78Å; I454-L1079 HydrophobicContact CG2-CG 3.85Å; A1040-L1079 HydrophobicContact CB-CD1 3.98Å; A1040-L1079 WeakPolarHBondContact O-CD1 3.42Å; V1041-L1079 HydrophobicContact CG2-CD1 4.04Å; L1044-L1079 HydrophobicContact CB-CB 4.35Å; L1044-L1079 HydrophobicContact CB-CD1 4.26Å; L1044-L1079 HydrophobicContact CD1-CB 4.28Å; L1044-L1079 HydrophobicContact CD2-CB 4.13Å; L1044-L1079 HydrophobicContact CD2-CD1 4.46Å; L1044-L1079 HydrophobicContact CD2-CD2 4.27Å; L1044-L1079 HydrophobicContact CG-CB 4.48Å; K1075-L1079 WeakPolarHBondContact O-CG 3.44Å; K1075-L1079 PolarHBondContact O-N 2.96Å; K1075-L1079 VanDerWaalsContact O-N 3.13Å; I1076-L1079 WeakPolarHBondContact O-CB 3.38Å; I1076-L1079 PolarHBondContact O-N 3.18Å; L1079-R1081 VanDerWaalsContact C-N 3.33Å; L1079-R1081 PolarHBondContact O-N 2.98Å; L1079-N1082 PolarHBondContact O-N 3.09Å
1080	L	92.3	Very high	91.3	Very high	2 Å²	2	55.5 Å²	55.5	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-66.6	-34.5	-179.9	-69.1	175.6	0	0	0	112.7	L1044 C1047 I1076 R1077 N1082 V1083 D1084 L1085 I1088 V1090	L1044-L1080 HydrophobicContact CD1-CD2 4Å; C1047-L1080 HydrophobicContact CB-CD2 3.79Å; I1076-L1080 HydrophobicContact CG2-CD1 3.8Å; I1076-L1080 HydrophobicContact CG2-CG 4.14Å; I1076-L1080 WeakPolarHBondContact O-CG 3.24Å; I1076-L1080 PolarHBondContact O-N 2.95Å; R1077-L1080 PolarHBondContact O-N 3.18Å; L1080-N1082 VanDerWaalsContact C-N 3.29Å; L1080-N1082 PolarHBondContact O-N 3Å; L1080-V1083 WeakPolarHBondContact O-CG2 3.42Å; L1080-V1083 PolarHBondContact O-N 2.79Å; L1080-D1084 PolarHBondContact O-N 2.89Å; L1080-L1085 HydrophobicContact CB-CB 4.49Å; L1080-L1085 HydrophobicContact CD2-CB 4.14Å; L1080-L1085 PolarHBondContact O-N 2.82Å; L1080-I1088 HydrophobicContact CD1-CB 4.05Å; L1080-I1088 HydrophobicContact CD1-CG2 4.08Å; L1080-I1088 HydrophobicContact CD2-CD1 4.13Å; L1080-V1090 HydrophobicContact CD1-CG2 3.54Å
1081	R	90.9	Very high	91.6	Very high	177 Å²	177	49.9 Å²	49.9	67%	0.668	24%	0.238	S	C	*	.	H	α-helix	trans	-63.4	-36	174.3	-173.1	179.3	-176.6	175.7	2.7	112	R1077 I1078 L1079 V1083 D1084	R1077-R1081 WeakPolarHBondContact O-CB 3.22Å; R1077-R1081 PolarHBondContact O-N 3.34Å; I1078-R1081 PolarHBondContact O-N 2.87Å; L1079-R1081 VanDerWaalsContact C-N 3.33Å; L1079-R1081 PolarHBondContact O-N 2.98Å; R1081-V1083 PolarHBondContact O-N 2.96Å; R1081-D1084 PolarHBondContact O-N 2.56Å
1082	N	87.6	Confident	91.7	Very high	100 Å²	100	50.2 Å²	50.2	54%	0.535	24%	0.242	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-13.2	179.8	-67.1	-14.8	0	0	0	113.7	I1078 L1079 L1080	I1078-N1082 PolarHBondContact O-N 2.85Å; I1078-N1082 PolarHBondContact O-OD1 2.94Å; L1079-N1082 PolarHBondContact O-N 3.09Å; L1080-N1082 VanDerWaalsContact C-N 3.29Å; L1080-N1082 PolarHBondContact O-N 3Å
1083	V	87.6	Confident	91.4	Very high	49 Å²	49	50.7 Å²	50.7	30%	0.297	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	17.9	178.3	-60.4	0	0	0	0	112.5	L1044 L1080 R1081 L1085	L1044-V1083 HydrophobicContact CD1-CB 4.43Å; L1044-V1083 HydrophobicContact CD1-CG1 4.08Å; L1044-V1083 HydrophobicContact CD1-CG2 3.48Å; L1044-V1083 VanDerWaalsContact CD1-CG2 3.48Å; L1080-V1083 WeakPolarHBondContact O-CG2 3.42Å; L1080-V1083 PolarHBondContact O-N 2.79Å; R1081-V1083 PolarHBondContact O-N 2.96Å; V1083-L1085 VanDerWaalsContact C-N 3.27Å; V1083-L1085 HydrophobicContact CG2-CB 4.12Å; V1083-L1085 HydrophobicContact CG2-CD1 3.94Å; V1083-L1085 HydrophobicContact CG2-CG 3.98Å; V1083-L1085 PolarHBondContact O-N 3.24Å
1084	D	88.8	Confident	91	Very high	137 Å²	137	53.4 Å²	53.4	73%	0.733	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.1	31.5	179.3	-58.8	-47.2	0	0	0	115.2	L1080 R1081	L1080-D1084 PolarHBondContact O-N 2.89Å; R1081-D1084 PolarHBondContact O-N 2.56Å
1085	L	91.6	Very high	90.7	Very high	12 Å²	12	54.2 Å²	54.2	6%	0.063	26%	0.261	C	S	.	.			trans	-108.9	38.8	176.2	-64.9	178.5	0	0	0	112.4	C1047 A1051 L1080 V1083 D1087 I1088	C1047-L1085 HydrophobicContact CB-CD1 4.24Å; A1051-L1085 HydrophobicContact CB-CD1 4Å; A1051-L1085 HydrophobicContact CB-CD2 3.63Å; L1080-L1085 HydrophobicContact CB-CB 4.49Å; L1080-L1085 HydrophobicContact CD2-CB 4.14Å; L1080-L1085 PolarHBondContact O-N 2.82Å; V1083-L1085 VanDerWaalsContact C-N 3.27Å; V1083-L1085 HydrophobicContact CG2-CB 4.12Å; V1083-L1085 HydrophobicContact CG2-CD1 3.94Å; V1083-L1085 HydrophobicContact CG2-CG 3.98Å; V1083-L1085 PolarHBondContact O-N 3.24Å; L1085-D1087 VanDerWaalsContact C-N 3.26Å; L1085-D1087 PolarHBondContact O-N 3.49Å; L1085-I1088 HydrophobicContact CB-CD1 3.92Å; L1085-I1088 HydrophobicContact CB-CG1 4.37Å; L1085-I1088 HydrophobicContact CD1-CD1 4.26Å; L1085-I1088 PolarHBondContact O-N 3.07Å
1086	M	89.2	Confident	90.5	Very high	118 Å²	118	54 Å²	54	58%	0.581	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-19.3	-175.1	66.4	-173.5	76.9	0	0	114.7	I1088	M1086-I1088 PolarHBondContact O-N 2.72Å
1087	D	92.1	Very high	89.8	Confident	127 Å²	127	55.2 Å²	55.2	68%	0.679	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.4	179	-66.8	-25	0	0	0	113.4	A1060 L1085 K1089	A1060-D1087 HydrophobicContact CB-CB 3.87Å; L1085-D1087 VanDerWaalsContact C-N 3.26Å; L1085-D1087 PolarHBondContact O-N 3.49Å; D1087-K1089 PolarHBondContact O-N 3.4Å
1088	I	95.4	Very high	89	Confident	8 Å²	8	52.5 Å²	52.5	4%	0.041	27%	0.274	C	S	.	.	S	Bend	trans	-67.9	123.2	174.7	-62.9	-177.7	0	0	0	109.2	C1047 A1060 I1063 V1065 L1080 L1085 M1086 V1090	C1047-I1088 HydrophobicContact CB-CD1 3.72Å; A1060-I1088 HydrophobicContact CB-CG1 3.89Å; I1063-I1088 HydrophobicContact CB-CD1 4.36Å; I1063-I1088 HydrophobicContact CB-CG1 4.26Å; I1063-I1088 HydrophobicContact CB-CG2 4.22Å; I1063-I1088 HydrophobicContact CD1-CD1 4.16Å; I1063-I1088 HydrophobicContact CG2-CD1 4.31Å; I1063-I1088 HydrophobicContact CG2-CG2 3.97Å; V1065-I1088 HydrophobicContact CG2-CG2 3.86Å; L1080-I1088 HydrophobicContact CD1-CB 4.05Å; L1080-I1088 HydrophobicContact CD1-CG2 4.08Å; L1080-I1088 HydrophobicContact CD2-CD1 4.13Å; L1085-I1088 HydrophobicContact CB-CD1 3.92Å; L1085-I1088 HydrophobicContact CB-CG1 4.37Å; L1085-I1088 HydrophobicContact CD1-CD1 4.26Å; L1085-I1088 PolarHBondContact O-N 3.07Å; M1086-I1088 PolarHBondContact O-N 2.72Å; I1088-V1090 HydrophobicContact CG2-CG2 4.44Å; I1088-V1090 PolarHBondContact O-N 3.5Å
1089	K	94.6	Very high	88.8	Confident	62 Å²	62	53.5 Å²	53.5	27%	0.27	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	120	175.9	178.8	68.1	-177.1	170.5	0	109.4	I1063 G1064 V1065 D1087 E1095 F1096 Y1101	I1063-K1089 PolarHBondContact O-N 2.9Å; G1064-K1089 CarbonylContact C-O 3.58Å; V1065-K1089 PolarHBondContact N-O 3.25Å; D1087-K1089 PolarHBondContact O-N 3.4Å; K1089-E1095 IonicContact NZ-OE2 3.29Å; K1089-E1095 PolarHBondContact NZ-OE2 3.14Å; K1089-F1096 HydrophobicContact CB-CZ 4.19Å; K1089-F1096 HydrophobicContact CG-CE1 4.03Å; K1089-F1096 HydrophobicContact CG-CE2 4.1Å; K1089-F1096 HydrophobicContact CG-CZ 3.58Å; K1089-F1096 WeakPolarHBondContact O-CZ 3.36Å; K1089-Y1101 HydrophobicContact CB-CE1 4.09Å; K1089-Y1101 WeakPolarHBondContact CB-OH 3.4Å; K1089-Y1101 WeakPolarHBondContact CG-OH 3.41Å
1090	V	95.9	Very high	88.8	Confident	1 Å²	1	57 Å²	57	1%	0.006	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.9	131	170.7	-168.2	0	0	0	0	109.2	V1065 V1073 I1076 R1077 L1080 I1088	V1065-V1090 HydrophobicContact CB-CB 4.34Å; V1065-V1090 HydrophobicContact CB-CG1 4.05Å; V1065-V1090 HydrophobicContact CB-CG2 4.09Å; V1065-V1090 HydrophobicContact CG1-CG1 4.05Å; V1065-V1090 HydrophobicContact CG2-CG2 4.38Å; V1065-V1090 WeakPolarHBondContact O-CA 3.25Å; V1073-V1090 HydrophobicContact CB-CG1 4.21Å; V1073-V1090 HydrophobicContact CG1-CB 4.19Å; V1073-V1090 HydrophobicContact CG1-CG1 3.85Å; V1073-V1090 HydrophobicContact CG2-CG1 4.32Å; I1076-V1090 HydrophobicContact CB-CG1 4.12Å; I1076-V1090 HydrophobicContact CG2-CG1 3.95Å; I1076-V1090 HydrophobicContact CG2-CG2 3.93Å; R1077-V1090 HydrophobicContact CG-CB 4.04Å; R1077-V1090 HydrophobicContact CG-CG2 4.13Å; R1077-V1090 PolarHBondContact NH2-O 3.03Å; L1080-V1090 HydrophobicContact CD1-CG2 3.54Å; I1088-V1090 HydrophobicContact CG2-CG2 4.44Å; I1088-V1090 PolarHBondContact O-N 3.5Å
1091	G	91.7	Very high	89	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-174.6	178.5	-177.2	0	0	0	0	0	114.2	V1065 I1066 T1067	V1065-G1091 PolarHBondContact O-N 3.2Å; I1066-G1091 WeakPolarHBondContact CA-O 3.32Å; T1067-G1091 PolarHBondContact N-O 2.82Å
1092	S	89.6	Confident	89.3	Confident	24 Å²	24	51.5 Å²	51.5	17%	0.168	28%	0.275	C	S	.	.			trans	-78.9	166.8	173.9	81.8	0	0	0	0	112.3	T1067 E1094 E1095 F1096	T1067-S1092 WeakPolarHBondContact O-CA 3.23Å; S1092-E1094 VanDerWaalsContact CB-OE2 3.31Å; S1092-E1094 WeakPolarHBondContact CB-OE2 3.49Å; S1092-E1094 PolarHBondContact O-N 3.36Å; S1092-E1094 PolarHBondContact OG-OE2 3.04Å; S1092-E1095 PolarHBondContact O-N 3.16Å; S1092-F1096 WeakPolarHBondContact O-CD2 2.91Å; S1092-F1096 PolarHBondContact O-N 2.88Å
1093	V	87.8	Confident	89.7	Confident	10 Å²	10	46.8 Å²	46.8	6%	0.061	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.3	-36.4	179.2	-177.5	0	0	0	0	111.9	L919 I1066 E1095 F1096 Q1097 R1131 V1134 A1135	L919-V1093 HydrophobicContact CD1-CG1 4.3Å; I1066-V1093 HydrophobicContact CG2-CB 4.43Å; I1066-V1093 HydrophobicContact CG2-CG2 3.59Å; V1093-E1095 PolarHBondContact O-N 2.84Å; V1093-F1096 PolarHBondContact O-N 2.74Å; V1093-Q1097 PolarHBondContact O-N 2.8Å; V1093-R1131 HydrophobicContact CG1-CB 4.33Å; V1093-R1131 HydrophobicContact CG1-CG 4.39Å; V1093-R1131 HydrophobicContact CG2-CB 4.48Å; V1093-V1134 HydrophobicContact CG1-CB 3.72Å; V1093-V1134 HydrophobicContact CG1-CG1 3.57Å; V1093-A1135 HydrophobicContact CG2-CB 4.24Å
1094	E	84.3	Confident	90.3	Very high	61 Å²	61	44.4 Å²	44.4	29%	0.285	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-39.4	177.3	-64.4	76.1	-169.3	0	0	112.5	L919 S1092 F1096 Q1097 R1131	L919-E1094 HydrophobicContact CD1-CG 4.21Å; S1092-E1094 VanDerWaalsContact CB-OE2 3.31Å; S1092-E1094 WeakPolarHBondContact CB-OE2 3.49Å; S1092-E1094 PolarHBondContact O-N 3.36Å; S1092-E1094 PolarHBondContact OG-OE2 3.04Å; E1094-F1096 PolarHBondContact O-N 2.64Å; E1094-Q1097 WeakPolarHBondContact O-CB 3.39Å; E1094-Q1097 PolarHBondContact O-N 2.81Å; E1094-R1131 IonicContact OE1-CZ 3.6Å; E1094-R1131 IonicContact OE1-NE 3.74Å; E1094-R1131 PolarHBondContact OE1-NE 2.98Å; E1094-R1131 IonicContact OE1-NH1 2.66Å; E1094-R1131 IonicContact OE1-NH2 3.22Å; E1094-R1131 PolarHBondContact OE1-NH2 3.17Å
1095	E	83.8	Confident	90.7	Very high	74 Å²	74	37.9 Å²	37.9	35%	0.346	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.9	-24.2	177.9	-67.8	-176	-142.7	0	0	112.9	K1089 S1092 V1093	K1089-E1095 IonicContact NZ-OE2 3.29Å; K1089-E1095 PolarHBondContact NZ-OE2 3.14Å; S1092-E1095 PolarHBondContact O-N 3.16Å; V1093-E1095 PolarHBondContact O-N 2.84Å
1096	F	87.1	Confident	91	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-0.2	179.4	-80.9	-97.4	0	0	0	113.5	V1065 I1066 K1089 S1092 V1093 E1094 G1098 Q1099 Y1101 I1104 R1138	V1065-F1096 VanDerWaalsContact O-CE2 3.31Å; V1065-F1096 WeakPolarHBondContact O-CE2 3.45Å; V1065-F1096 WeakPolarHBondContact O-CZ 2.99Å; I1066-F1096 HydrophobicContact CD1-CB 4.15Å; I1066-F1096 HydrophobicContact CD1-CD1 4.08Å; I1066-F1096 HydrophobicContact CD1-CD2 4.35Å; I1066-F1096 HydrophobicContact CD1-CG 3.94Å; I1066-F1096 HydrophobicContact CG1-CB 4.45Å; I1066-F1096 HydrophobicContact CG1-CD1 3.97Å; I1066-F1096 HydrophobicContact CG1-CD2 3.73Å; I1066-F1096 HydrophobicContact CG1-CE1 4.06Å; I1066-F1096 HydrophobicContact CG1-CE2 3.8Å; I1066-F1096 HydrophobicContact CG1-CG 3.79Å; I1066-F1096 HydrophobicContact CG1-CZ 3.96Å; K1089-F1096 HydrophobicContact CB-CZ 4.19Å; K1089-F1096 HydrophobicContact CG-CE1 4.03Å; K1089-F1096 HydrophobicContact CG-CE2 4.1Å; K1089-F1096 HydrophobicContact CG-CZ 3.58Å; K1089-F1096 WeakPolarHBondContact O-CZ 3.36Å; S1092-F1096 WeakPolarHBondContact O-CD2 2.91Å; S1092-F1096 PolarHBondContact O-N 2.88Å; V1093-F1096 PolarHBondContact O-N 2.74Å; E1094-F1096 PolarHBondContact O-N 2.64Å; F1096-G1098 PolarHBondContact O-N 3.41Å; F1096-Q1099 PolarHBondContact O-N 2.85Å; F1096-Q1099 VanDerWaalsContact O-N 3.09Å; F1096-Y1101 AromaticContact CD1-CD2 3.91Å; F1096-Y1101 HydrophobicContact CD1-CD2 3.91Å; F1096-Y1101 AromaticContact CD1-CE2 3.58Å; F1096-Y1101 HydrophobicContact CD1-CE2 3.58Å; F1096-Y1101 AromaticContact CE1-CD2 3.71Å; F1096-Y1101 HydrophobicContact CE1-CD2 3.71Å; F1096-Y1101 AromaticContact CE1-CE2 3.38Å; F1096-Y1101 HydrophobicContact CE1-CE2 3.38Å; F1096-I1104 HydrophobicContact CD1-CD1 4.32Å; F1096-I1104 HydrophobicContact CE1-CD1 4.13Å; F1096-R1138 HydrophobicContact CB-CG 4.34Å
1097	Q	80.7	Confident	91.4	Very high	26 Å²	26	32.3 Å²	32.3	12%	0.121	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	134.7	177.5	-171.8	169.3	-3.9	0	0	110.7	L919 V1093 E1094 Q1099	L919-Q1097 HydrophobicContact CD1-CB 4.38Å; V1093-Q1097 PolarHBondContact O-N 2.8Å; E1094-Q1097 WeakPolarHBondContact O-CB 3.39Å; E1094-Q1097 PolarHBondContact O-N 2.81Å; Q1097-Q1099 PolarHBondContact O-N 3.17Å; Q1097-Q1099 VanDerWaalsContact O-N 3.15Å
1098	G	77.4	Confident	91.6	Very high	58 Å²	58	26.2 Å²	26.2	60%	0.598	14%	0.141	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	-12	-174.5	0	0	0	0	0	115.2	F1096	F1096-G1098 PolarHBondContact O-N 3.41Å
1099	Q	86	Confident	91.4	Very high	75 Å²	75	25.9 Å²	25.9	35%	0.35	14%	0.139	S	C	.	.			trans	-93.4	164.8	176.4	-57.3	-172.1	-3.6	0	0	111.6	F1096 Q1097 Y1101 R1138	F1096-Q1099 PolarHBondContact O-N 2.85Å; F1096-Q1099 VanDerWaalsContact O-N 3.09Å; Q1097-Q1099 PolarHBondContact O-N 3.17Å; Q1097-Q1099 VanDerWaalsContact O-N 3.15Å; Q1099-Y1101 HydrophobicContact CB-CE2 3.98Å; Q1099-Y1101 PolarHBondContact OE1-OH 3.24Å; Q1099-R1138 VanDerWaalsContact O-CD 3.24Å; Q1099-R1138 WeakPolarHBondContact O-CD 3.23Å; Q1099-R1138 PolarHBondContact O-NH1 2.98Å; Q1099-R1138 VanDerWaalsContact O-NH1 3.17Å
1100	E	90.8	Very high	91.3	Very high	75 Å²	75	23.6 Å²	23.6	35%	0.35	13%	0.128	S	C	.	.			trans	-154.8	144.7	177.1	54.2	-176.7	-136.8	0	0	108.9	R973 R1138 K1140	R973-E1100 IonicContact CZ-OE2 2.86Å; R973-E1100 IonicContact NE-OE2 3.89Å; R973-E1100 PolarHBondContact NE-OE2 3.46Å; R973-E1100 IonicContact NH2-OE2 3.34Å; R973-E1100 PolarHBondContact NH2-OE2 3.15Å; E1100-R1138 WeakPolarHBondContact CA-O 3.28Å; E1100-K1140 WeakPolarHBondContact OE1-CE 3.38Å; E1100-K1140 IonicContact OE1-NZ 2.83Å; E1100-K1140 PolarHBondContact OE1-NZ 2.91Å
1101	Y	96.3	Very high	90.9	Very high	35 Å²	35	23.9 Å²	23.9	14%	0.137	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	158	-176.8	-69.3	-97.3	0	0	0	109.9	S1061 K1089 F1096 Q1099 V1103 I1104 R1138 P1139 K1140	S1061-Y1101 WeakPolarHBondContact O-CD1 3.45Å; S1061-Y1101 WeakPolarHBondContact O-CE1 3.32Å; K1089-Y1101 HydrophobicContact CB-CE1 4.09Å; K1089-Y1101 WeakPolarHBondContact CB-OH 3.4Å; K1089-Y1101 WeakPolarHBondContact CG-OH 3.41Å; F1096-Y1101 AromaticContact CD1-CD2 3.91Å; F1096-Y1101 HydrophobicContact CD1-CD2 3.91Å; F1096-Y1101 AromaticContact CD1-CE2 3.58Å; F1096-Y1101 HydrophobicContact CD1-CE2 3.58Å; F1096-Y1101 AromaticContact CE1-CD2 3.71Å; F1096-Y1101 HydrophobicContact CE1-CD2 3.71Å; F1096-Y1101 AromaticContact CE1-CE2 3.38Å; F1096-Y1101 HydrophobicContact CE1-CE2 3.38Å; Q1099-Y1101 HydrophobicContact CB-CE2 3.98Å; Q1099-Y1101 PolarHBondContact OE1-OH 3.24Å; Y1101-V1103 VanDerWaalsContact C-N 3.3Å; Y1101-I1104 HydrophobicContact CD2-CD1 3.84Å; Y1101-I1104 HydrophobicContact CG-CD1 4.1Å; Y1101-R1138 PolarHBondContact N-O 3.28Å; Y1101-P1139 WeakPolarHBondContact O-CA 3.38Å; Y1101-K1140 PolarHBondContact O-N 2.87Å
1102	L	96.6	Very high	90.5	Very high	30 Å²	30	26 Å²	26	16%	0.157	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.7	-45.3	176.1	-170	67.1	0	0	0	110.1	V999 L1003 V1058 D1062 K1140 A1141 L1142	V999-L1102 HydrophobicContact CG1-CD1 3.81Å; L1003-L1102 HydrophobicContact CD1-CD2 4.3Å; L1003-L1102 HydrophobicContact CD1-CG 4.29Å; V1058-L1102 HydrophobicContact CG1-CD2 4.18Å; D1062-L1102 HydrophobicContact CB-CB 3.92Å; D1062-L1102 PolarHBondContact O-N 2.86Å; D1062-L1102 VanDerWaalsContact O-N 3.1Å; L1102-K1140 HydrophobicContact CD1-CB 4.4Å; L1102-A1141 HydrophobicContact CD1-CB 3.51Å; L1102-A1141 HydrophobicContact CG-CB 3.99Å; L1102-A1141 PolarHBondContact O-N 3.32Å; L1102-L1142 PolarHBondContact O-N 2.98Å
1103	V	97.6	Very high	90.2	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134	178	-171.7	0	0	0	0	110.8	L1003 L1050 V1058 D1062 I1063 G1064 Y1101 L1142	L1003-V1103 HydrophobicContact CD1-CG2 3.36Å; L1050-V1103 HydrophobicContact CD1-CB 4.46Å; L1050-V1103 HydrophobicContact CD1-CG1 3.72Å; L1050-V1103 HydrophobicContact CD2-CG2 4.47Å; V1058-V1103 HydrophobicContact CG1-CG2 4.19Å; V1058-V1103 HydrophobicContact CG2-CG2 4.36Å; D1062-V1103 PolarHBondContact O-N 3.3Å; D1062-V1103 VanDerWaalsContact O-N 3.11Å; I1063-V1103 HydrophobicContact CG1-CB 4.49Å; G1064-V1103 PolarHBondContact N-O 2.81Å; Y1101-V1103 VanDerWaalsContact C-N 3.3Å; V1103-L1142 WeakPolarHBondContact CA-O 3.3Å; V1103-L1142 HydrophobicContact CB-CB 4.48Å; V1103-L1142 HydrophobicContact CG1-CB 4.06Å; V1103-L1142 HydrophobicContact CG1-CD2 3.97Å; V1103-L1142 HydrophobicContact CG1-CG 4.04Å; V1103-L1142 HydrophobicContact CG2-CB 4.11Å; V1103-L1142 HydrophobicContact CG2-CD2 4.39Å
1104	I	98.2	Very high	89.5	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	131	170.6	-65.3	-71.4	0	0	0	110	G1064 I1066 F1096 Y1101 I1106 R1138 P1139 L1142 L1143 I1144	G1064-I1104 CarbonylContact O-C 3.59Å; G1064-I1104 VanDerWaalsContact O-CA 3.31Å; G1064-I1104 WeakPolarHBondContact O-CA 3.45Å; I1066-I1104 HydrophobicContact CD1-CD1 4.32Å; I1066-I1104 HydrophobicContact CD1-CG2 3.78Å; I1066-I1104 HydrophobicContact CG1-CG2 4.13Å; F1096-I1104 HydrophobicContact CD1-CD1 4.32Å; F1096-I1104 HydrophobicContact CE1-CD1 4.13Å; Y1101-I1104 HydrophobicContact CD2-CD1 3.84Å; Y1101-I1104 HydrophobicContact CG-CD1 4.1Å; I1104-I1106 HydrophobicContact CG2-CG1 3.92Å; I1104-R1138 HydrophobicContact CD1-CB 3.79Å; I1104-R1138 HydrophobicContact CG1-CB 3.68Å; I1104-P1139 HydrophobicContact CB-CB 3.88Å; I1104-P1139 HydrophobicContact CB-CG 4.21Å; I1104-P1139 HydrophobicContact CG1-CB 3.81Å; I1104-P1139 HydrophobicContact CG1-CG 4.34Å; I1104-L1142 PolarHBondContact N-O 3.38Å; I1104-L1143 HydrophobicContact CB-CD1 4.26Å; I1104-L1143 HydrophobicContact CG2-CD1 4.07Å; I1104-L1143 WeakPolarHBondContact O-CA 3.49Å; I1104-I1144 PolarHBondContact O-N 3.38Å
1105	I	98.5	Very high	88	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	125.7	170.9	-51.7	178.4	0	0	0	108.3	V1043 L1050 I1063 G1064 V1065 I1066 I1144 L1146	V1043-I1105 HydrophobicContact CG1-CG2 4.37Å; V1043-I1105 HydrophobicContact CG2-CG2 4.12Å; L1050-I1105 HydrophobicContact CD1-CD1 4.25Å; I1063-I1105 HydrophobicContact CG2-CD1 4.45Å; G1064-I1105 PolarHBondContact O-N 3.37Å; V1065-I1105 CarbonylContact C-O 3.55Å; V1065-I1105 VanDerWaalsContact CA-O 3.31Å; V1065-I1105 WeakPolarHBondContact CA-O 3.5Å; V1065-I1105 HydrophobicContact CG2-CB 4.34Å; I1066-I1105 PolarHBondContact N-O 2.85Å; I1105-I1144 CarbonylContact C-O 3.58Å; I1105-I1144 VanDerWaalsContact CA-O 3.27Å; I1105-I1144 WeakPolarHBondContact CA-O 3.3Å; I1105-I1144 HydrophobicContact CG1-CB 4.23Å; I1105-I1144 HydrophobicContact CG1-CD1 4.38Å; I1105-I1144 HydrophobicContact CG2-CB 4.34Å; I1105-I1144 HydrophobicContact CG2-CG2 4.39Å; I1105-L1146 HydrophobicContact CG2-CD1 4.24Å; I1105-L1146 HydrophobicContact CG2-CG 4.34Å
1106	I	98.1	Very high	86.6	Confident	12 Å²	12	40.8 Å²	40.8	6%	0.062	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	123.4	177.7	-56.8	178.4	0	0	0	108.9	I1066 I1104 T1108 A1135 I1136 L1143 I1144 V1145 L1146	I1066-I1106 HydrophobicContact CB-CG1 4.4Å; I1066-I1106 WeakPolarHBondContact O-CA 3.27Å; I1104-I1106 HydrophobicContact CG2-CG1 3.92Å; I1106-T1108 HydrophobicContact CG2-CG2 4.36Å; I1106-A1135 HydrophobicContact CD1-CB 3.79Å; I1106-I1136 HydrophobicContact CD1-CG2 4.06Å; I1106-L1143 HydrophobicContact CD1-CD1 3.78Å; I1106-L1143 HydrophobicContact CG1-CD1 4.03Å; I1106-I1144 PolarHBondContact N-O 3.02Å; I1106-V1145 HydrophobicContact CB-CG1 4.41Å; I1106-V1145 HydrophobicContact CB-CG2 4.38Å; I1106-V1145 HydrophobicContact CD1-CG2 4.25Å; I1106-L1146 PolarHBondContact O-N 3.45Å
1107	S	97.3	Very high	84.8	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	121.1	168.4	167.2	0	0	0	0	109.9	E1039 I1066 T1067 P1068 Q1072	E1039-S1107 PolarHBondContact OE2-OG 2.88Å; I1066-S1107 PolarHBondContact O-N 2.88Å; T1067-S1107 WeakPolarHBondContact CA-O 3.42Å; T1067-S1107 WeakPolarHBondContact CB-O 3.5Å; T1067-S1107 PolarHBondContact OG1-O 2.98Å; P1068-S1107 WeakPolarHBondContact CD-O 3.39Å; Q1072-S1107 PolarHBondContact NE2-OG 3.12Å; Q1072-S1107 VanDerWaalsContact NE2-OG 3.11Å
1108	T	95.1	Very high	83.5	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.			trans	-89.9	-19.8	-173.8	58.5	0	0	0	0	113.9	E1039 I1106 R1110 L1126 L1146 G1147 L1152 F1158	E1039-T1108 PolarHBondContact OE2-N 3.45Å; I1106-T1108 HydrophobicContact CG2-CG2 4.36Å; T1108-R1110 PolarHBondContact O-N 2.83Å; T1108-L1126 HydrophobicContact CG2-CD2 4.12Å; T1108-L1146 WeakPolarHBondContact CG2-O 3.44Å; T1108-L1146 PolarHBondContact N-O 2.93Å; T1108-L1146 VanDerWaalsContact N-O 3.09Å; T1108-L1146 PolarHBondContact OG1-O 3.19Å; T1108-G1147 WeakPolarHBondContact OG1-CA 3.25Å; T1108-L1152 HydrophobicContact CG2-CD1 4.03Å; T1108-L1152 HydrophobicContact CG2-CD2 4.13Å; T1108-F1158 HydrophobicContact CG2-CE1 3.76Å; T1108-F1158 HydrophobicContact CG2-CZ 4.02Å
1109	V	92.8	Very high	82.2	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	23%	0.228	C	C	.	.			trans	71.6	-47.9	170.7	-173	0	0	0	0	114.8	W1034 N1036 E1039 T1067 Y1069 Q1072 S1111	W1034-V1109 HydrophobicContact CB-CG1 4.18Å; N1036-V1109 HydrophobicContact CB-CB 4.41Å; N1036-V1109 HydrophobicContact CB-CG1 3.86Å; N1036-V1109 WeakPolarHBondContact CB-O 3.41Å; N1036-V1109 PolarHBondContact ND2-O 3.34Å; E1039-V1109 VanDerWaalsContact CD-N 3.3Å; E1039-V1109 VanDerWaalsContact OE1-CA 3.32Å; E1039-V1109 WeakPolarHBondContact OE1-CA 3.45Å; E1039-V1109 PolarHBondContact OE1-N 3.07Å; E1039-V1109 VanDerWaalsContact OE1-N 3.09Å; E1039-V1109 WeakPolarHBondContact OE2-CA 3.18Å; E1039-V1109 PolarHBondContact OE2-N 3.26Å; T1067-V1109 VanDerWaalsContact OG1-CG2 3.31Å; T1067-V1109 WeakPolarHBondContact OG1-CG2 3.22Å; Y1069-V1109 HydrophobicContact CD2-CB 3.61Å; Y1069-V1109 HydrophobicContact CD2-CG1 3.84Å; Y1069-V1109 HydrophobicContact CD2-CG2 3.76Å; Y1069-V1109 HydrophobicContact CE2-CB 3.95Å; Y1069-V1109 HydrophobicContact CE2-CG1 4.3Å; Y1069-V1109 HydrophobicContact CE2-CG2 4.49Å; Q1072-V1109 HydrophobicContact CB-CG2 3.8Å; Q1072-V1109 HydrophobicContact CG-CG2 3.53Å; V1109-S1111 PolarHBondContact O-N 2.86Å
1110	R	90.9	Very high	80.5	Confident	15 Å²	15	49.5 Å²	49.5	6%	0.057	23%	0.225	C	C	.	.			trans	-70.2	126.6	-172.7	-59.3	-53.3	-61.9	-84.5	-5.7	111.1	E1025 Y1069 T1108 F1122 L1126	E1025-R1110 IonicContact OE1-CZ 3.69Å; E1025-R1110 IonicContact OE1-NE 2.61Å; E1025-R1110 IonicContact OE1-NH2 3.51Å; E1025-R1110 PolarHBondContact OE1-NH2 2.69Å; E1025-R1110 VanDerWaalsContact OE1-NH2 3.17Å; E1025-R1110 VanDerWaalsContact OE2-CA 3.3Å; E1025-R1110 WeakPolarHBondContact OE2-CA 3.3Å; E1025-R1110 IonicContact OE2-CZ 3.6Å; E1025-R1110 IonicContact OE2-NE 3.32Å; E1025-R1110 PolarHBondContact OE2-NE 2.83Å; E1025-R1110 IonicContact OE2-NH2 2.62Å; Y1069-R1110 HydrophobicContact CE2-CG 3.95Å; Y1069-R1110 WeakPolarHBondContact OH-CD 3.47Å; Y1069-R1110 WeakPolarHBondContact OH-CG 3.36Å; T1108-R1110 PolarHBondContact O-N 2.83Å; R1110-F1122 PolarHBondContact NH1-O 2.8Å; R1110-F1122 VanDerWaalsContact NH2-CZ 3.28Å; R1110-F1122 PolarHBondContact NH2-O 2.74Å; R1110-L1126 HydrophobicContact CB-CD1 3.9Å; R1110-L1126 HydrophobicContact CG-CD1 3.84Å
1111	S	88.8	Confident	78.4	Confident	7 Å²	7	53.7 Å²	53.7	5%	0.049	24%	0.239	C	C	.	.			trans	-140.4	-2.4	-171.2	-77.9	0	0	0	0	115.1	G1023 E1025 N1036 V1109 N1148	G1023-S1111 PolarHBondContact N-OG 3.25Å; G1023-S1111 WeakPolarHBondContact O-CB 3.44Å; E1025-S1111 PolarHBondContact OE2-N 2.86Å; N1036-S1111 PolarHBondContact ND2-OG 3.06Å; V1109-S1111 PolarHBondContact O-N 2.86Å; S1111-N1148 PolarHBondContact O-ND2 3.16Å
1112	N	83.9	Confident	76.3	Confident	44 Å²	44	53 Å²	53	24%	0.235	24%	0.236	C	C	.	.			trans	-75.8	129.5	175.5	154.2	22.5	0	0	0	111.5	E1025 D1114 F1122 V1151	E1025-N1112 HydrophobicContact CG-CB 4.18Å; E1025-N1112 PolarHBondContact OE2-N 3.44Å; N1112-D1114 VanDerWaalsContact OD1-CB 3.25Å; N1112-D1114 WeakPolarHBondContact OD1-CB 3.3Å; N1112-D1114 PolarHBondContact OD1-N 2.72Å; N1112-D1114 PolarHBondContact OD1-OD2 3.26Å; N1112-F1122 HydrophobicContact CB-CE1 4.39Å; N1112-F1122 HydrophobicContact CB-CE2 4.24Å; N1112-F1122 HydrophobicContact CB-CZ 3.51Å; N1112-F1122 WeakPolarHBondContact O-CE1 3.36Å; N1112-F1122 WeakPolarHBondContact O-CZ 3.45Å; N1112-V1151 WeakPolarHBondContact O-CG2 3.23Å
1113	E	81.8	Confident	74.5	Confident	49 Å²	49	51.8 Å²	51.8	23%	0.229	23%	0.23	C	C	.	.			trans	-100.2	-2	-169.7	-67.9	171.1	-161.4	0	0	113.7	R1022 R1115 N1148 H1150 V1151 R1154	R1022-E1113 IonicContact CZ-OE1 3.58Å; R1022-E1113 IonicContact CZ-OE2 2.72Å; R1022-E1113 IonicContact NE-OE1 3.47Å; R1022-E1113 PolarHBondContact NE-OE1 3.43Å; R1022-E1113 IonicContact NE-OE2 3.94Å; R1022-E1113 VanDerWaalsContact NH2-CD 3.32Å; R1022-E1113 IonicContact NH2-OE1 2.7Å; R1022-E1113 PolarHBondContact NH2-OE1 3.45Å; R1022-E1113 VanDerWaalsContact NH2-OE1 3.16Å; R1022-E1113 IonicContact NH2-OE2 2.78Å; R1022-E1113 PolarHBondContact NH2-OE2 3.29Å; E1113-R1115 PolarHBondContact O-N 3.02Å; E1113-N1148 WeakPolarHBondContact CG-ND2 3.4Å; E1113-N1148 PolarHBondContact OE1-ND2 2.84Å; E1113-H1150 HydrophobicContact CG-CB 4.07Å; E1113-V1151 HydrophobicContact CG-CG2 4.13Å; E1113-R1154 PolarHBondContact O-NH2 2.66Å
1114	D	73.3	Confident	73.2	Confident	94 Å²	94	53.3 Å²	53.3	50%	0.503	25%	0.245	S	C	.	.			trans	-54.1	139.7	-178.6	-66.9	-27.8	0	0	0	110.5	N1112 F1116 R1154	N1112-D1114 VanDerWaalsContact OD1-CB 3.25Å; N1112-D1114 WeakPolarHBondContact OD1-CB 3.3Å; N1112-D1114 PolarHBondContact OD1-N 2.72Å; N1112-D1114 PolarHBondContact OD1-OD2 3.26Å; D1114-F1116 HydrophobicContact CB-CD2 4.21Å; D1114-F1116 HydrophobicContact CB-CE2 3.52Å; D1114-F1116 HydrophobicContact CB-CZ 3.83Å; D1114-F1116 PolarHBondContact O-N 3.48Å; D1114-R1154 PolarHBondContact O-NH1 3.45Å; D1114-R1154 PolarHBondContact O-NH2 2.94Å
1115	R	53.8	Low	71.8	Confident	225 Å²	225	58.3 Å²	58.3	85%	0.849	27%	0.267	S	S	*	.			trans	-83.5	107.9	176.2	-72.3	-173.9	179.1	-174.3	-0.9	108.2	E1113	E1113-R1115 PolarHBondContact O-N 3.02Å
1116	F	53.1	Low	70.6	Confident	112 Å²	112	58.9 Å²	58.9	49%	0.491	27%	0.27	S	S	.	.			trans	-107.9	155.5	165.3	-60	-75.6	0	0	0	108.3	D1114 D1118 F1122	D1114-F1116 HydrophobicContact CB-CD2 4.21Å; D1114-F1116 HydrophobicContact CB-CE2 3.52Å; D1114-F1116 HydrophobicContact CB-CZ 3.83Å; D1114-F1116 PolarHBondContact O-N 3.48Å; F1116-D1118 PolarHBondContact O-N 3.15Å; F1116-F1122 HydrophobicContact CD2-CD2 4.22Å; F1116-F1122 HydrophobicContact CE2-CD2 4.31Å; F1116-F1122 HydrophobicContact CE2-CE2 4.34Å
1117	E	50.3	Low	69.7	Low	157 Å²	157	60 Å²	60	73%	0.734	28%	0.279	S	S	*	.	S	Bend	trans	-63.1	-21	178.6	-63.7	-176.1	154.7	0	0	113.4
1118	D	53.2	Low	69.1	Low	43 Å²	43	63 Å²	63	23%	0.23	30%	0.296	C	S	.	.			trans	-119	98.9	-179.6	-167.1	-28	0	0	0	113.2	K153 F1116 R1120 Y1121	K153-D1118 IonicContact NZ-OD1 2.92Å; K153-D1118 PolarHBondContact NZ-OD1 2.78Å; K153-D1118 IonicContact NZ-OD2 3.97Å; K153-D1118 PolarHBondContact NZ-OD2 2.8Å; F1116-D1118 PolarHBondContact O-N 3.15Å; D1118-R1120 VanDerWaalsContact C-N 3.33Å; D1118-R1120 PolarHBondContact O-N 3.42Å; D1118-R1120 PolarHBondContact OD1-N 3.38Å; D1118-Y1121 PolarHBondContact OD1-N 3.45Å; D1118-Y1121 WeakPolarHBondContact OD2-CD2 3.09Å
1119	D	50.2	Low	68.9	Low	66 Å²	66	63.9 Å²	63.9	35%	0.353	30%	0.302	S	S	.	.	H	α-helix	trans	-68.3	-25.9	179.2	-72.7	-31.9	0	0	0	114.3	F1122 L1123 R1154	D1119-F1122 PolarHBondContact O-N 3.3Å; D1119-L1123 PolarHBondContact O-N 2.8Å; D1119-R1154 HydrophobicContact CB-CB 4.39Å; D1119-R1154 VanDerWaalsContact OD1-CD 3.3Å; D1119-R1154 WeakPolarHBondContact OD1-CD 3.42Å; D1119-R1154 IonicContact OD1-CZ 2.78Å; D1119-R1154 IonicContact OD1-NE 3.22Å; D1119-R1154 IonicContact OD1-NH1 3.45Å; D1119-R1154 PolarHBondContact OD1-NH1 2.78Å
1120	R	50.5	Low	68.9	Low	75 Å²	75	65.7 Å²	65.7	28%	0.283	31%	0.309	S	S	.	.	H	α-helix	trans	-81	-36.2	-174	-94.6	-171.7	-90.4	-168.6	-12.5	112.8	K153 S231 D1118 F1122 G1124	K153-R1120 HydrophobicContact CD-CB 4.24Å; K153-R1120 VanDerWaalsContact NZ-CB 3.33Å; K153-R1120 PolarHBondContact O-NH2 3.45Å; S231-R1120 PolarHBondContact O-NH1 2.74Å; D1118-R1120 VanDerWaalsContact C-N 3.33Å; D1118-R1120 PolarHBondContact O-N 3.42Å; D1118-R1120 PolarHBondContact OD1-N 3.38Å; R1120-F1122 PolarHBondContact O-N 3Å; R1120-G1124 PolarHBondContact O-N 3.05Å
1121	Y	47.1	Very low	68.9	Low	164 Å²	164	67.5 Å²	67.5	64%	0.643	32%	0.316	S	S	*	.	H	α-helix	trans	-61.9	-30	171.6	-102.3	-83.4	0	0	0	111.5	D1118	D1118-Y1121 PolarHBondContact OD1-N 3.45Å; D1118-Y1121 WeakPolarHBondContact OD2-CD2 3.09Å
1122	F	52.1	Low	69.2	Low	21 Å²	21	67.5 Å²	67.5	9%	0.092	32%	0.315	C	S	.	.	H	α-helix	trans	-76.2	-47.4	-177.6	-166.2	-93.3	0	0	0	113	E1025 R1110 N1112 F1116 D1119 R1120 G1124 V1151	E1025-F1122 WeakPolarHBondContact OE1-CZ 3.34Å; R1110-F1122 PolarHBondContact NH1-O 2.8Å; R1110-F1122 VanDerWaalsContact NH2-CZ 3.28Å; R1110-F1122 PolarHBondContact NH2-O 2.74Å; N1112-F1122 HydrophobicContact CB-CE1 4.39Å; N1112-F1122 HydrophobicContact CB-CE2 4.24Å; N1112-F1122 HydrophobicContact CB-CZ 3.51Å; N1112-F1122 WeakPolarHBondContact O-CE1 3.36Å; N1112-F1122 WeakPolarHBondContact O-CZ 3.45Å; F1116-F1122 HydrophobicContact CD2-CD2 4.22Å; F1116-F1122 HydrophobicContact CE2-CD2 4.31Å; F1116-F1122 HydrophobicContact CE2-CE2 4.34Å; D1119-F1122 PolarHBondContact O-N 3.3Å; R1120-F1122 PolarHBondContact O-N 3Å; F1122-G1124 VanDerWaalsContact C-N 3.26Å; F1122-G1124 PolarHBondContact O-N 2.89Å; F1122-V1151 HydrophobicContact CD1-CG1 4.28Å; F1122-V1151 HydrophobicContact CE1-CG1 4.13Å
1123	L	58.9	Low	69.8	Low	3 Å²	3	65.4 Å²	65.4	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-64.9	-29.1	178.3	-76.5	168.4	0	0	0	113.4	D1119 F1125 L1126 V1151 R1154 D1155	D1119-L1123 PolarHBondContact O-N 2.8Å; L1123-F1125 PolarHBondContact O-N 3.27Å; L1123-L1126 HydrophobicContact CB-CB 4.18Å; L1123-L1126 HydrophobicContact CD2-CB 4.19Å; L1123-L1126 HydrophobicContact CD2-CD1 3.98Å; L1123-L1126 WeakPolarHBondContact O-CB 3.49Å; L1123-L1126 PolarHBondContact O-N 3.31Å; L1123-V1151 HydrophobicContact CD2-CG1 3.81Å; L1123-R1154 HydrophobicContact CD1-CB 4.45Å; L1123-D1155 HydrophobicContact CD1-CB 3.79Å
1124	G	68.7	Low	70.4	Confident	32 Å²	32	63.1 Å²	63.1	33%	0.33	29%	0.293	S	S	.	.	G	3₁₀ helix	trans	57.1	-120.3	178.9	0	0	0	0	0	111.6	R1120 F1122 L1126 S1127	R1120-G1124 PolarHBondContact O-N 3.05Å; F1122-G1124 VanDerWaalsContact C-N 3.26Å; F1122-G1124 PolarHBondContact O-N 2.89Å; G1124-L1126 PolarHBondContact O-N 3.34Å; G1124-L1126 VanDerWaalsContact O-N 3.1Å; G1124-S1127 PolarHBondContact O-N 2.81Å; G1124-S1127 PolarHBondContact O-OG 2.67Å; G1124-S1127 VanDerWaalsContact O-OG 3.07Å
1125	F	69.2	Low	71.4	Confident	105 Å²	105	59 Å²	59	46%	0.461	27%	0.272	S	S	.	.	G	3₁₀ helix	trans	-61.4	-18.7	-178.3	-65.9	-50.5	0	0	0	115.3	P1068 Y1069 L1123 S1127 R1131	P1068-F1125 HydrophobicContact CB-CB 4.01Å; Y1069-F1125 HydrophobicContact CD1-CD2 4.21Å; Y1069-F1125 HydrophobicContact CD1-CE2 4.44Å; Y1069-F1125 AromaticContact CE1-CD2 3.71Å; Y1069-F1125 HydrophobicContact CE1-CD2 3.71Å; Y1069-F1125 HydrophobicContact CE1-CE2 4.15Å; L1123-F1125 PolarHBondContact O-N 3.27Å; F1125-S1127 VanDerWaalsContact C-N 3.35Å; F1125-R1131 VanDerWaalsContact CB-NH1 3.3Å
1126	L	74.1	Confident	73.5	Confident	12 Å²	12	48.5 Å²	48.5	6%	0.063	23%	0.233	C	C	.	.	G	3₁₀ helix	trans	-73.7	-23.2	178.6	-65.4	171.5	0	0	0	113	P1068 T1108 R1110 L1123 G1124 N1128 L1152 F1158	P1068-L1126 HydrophobicContact CG-CD2 4.03Å; T1108-L1126 HydrophobicContact CG2-CD2 4.12Å; R1110-L1126 HydrophobicContact CB-CD1 3.9Å; R1110-L1126 HydrophobicContact CG-CD1 3.84Å; L1123-L1126 HydrophobicContact CB-CB 4.18Å; L1123-L1126 HydrophobicContact CD2-CB 4.19Å; L1123-L1126 HydrophobicContact CD2-CD1 3.98Å; L1123-L1126 WeakPolarHBondContact O-CB 3.49Å; L1123-L1126 PolarHBondContact O-N 3.31Å; G1124-L1126 PolarHBondContact O-N 3.34Å; G1124-L1126 VanDerWaalsContact O-N 3.1Å; L1126-N1128 PolarHBondContact O-N 3.03Å; L1126-L1152 HydrophobicContact CD1-CD2 4Å; L1126-F1158 HydrophobicContact CB-CE2 4.09Å; L1126-F1158 HydrophobicContact CD2-CE2 4.06Å; L1126-F1158 HydrophobicContact CD2-CZ 3.9Å
1127	S	78	Confident	75.5	Confident	35 Å²	35	43.4 Å²	43.4	25%	0.245	21%	0.211	C	C	.	.	G	3₁₀ helix	trans	-77.9	1.9	-178.3	73	0	0	0	0	113.9	G1124 F1125	G1124-S1127 PolarHBondContact O-N 2.81Å; G1124-S1127 PolarHBondContact O-OG 2.67Å; G1124-S1127 VanDerWaalsContact O-OG 3.07Å; F1125-S1127 VanDerWaalsContact C-N 3.35Å
1128	N	85.4	Confident	77.7	Confident	65 Å²	65	36.1 Å²	36.1	35%	0.348	18%	0.177	S	C	.	.			trans	-89.9	106.7	-179.4	-175.6	-47.3	0	0	0	110	L1126 K1130 R1131 F1132	L1126-N1128 PolarHBondContact O-N 3.03Å; N1128-K1130 VanDerWaalsContact C-N 3.32Å; N1128-K1130 PolarHBondContact O-N 3Å; N1128-K1130 WeakPolarHBondContact OD1-CB 3.4Å; N1128-K1130 PolarHBondContact OD1-N 2.58Å; N1128-R1131 HydrophobicContact CB-CB 4.13Å; N1128-R1131 HydrophobicContact CB-CG 4.18Å; N1128-R1131 WeakPolarHBondContact O-CB 3.32Å; N1128-R1131 PolarHBondContact O-N 3.25Å; N1128-R1131 PolarHBondContact OD1-N 2.87Å; N1128-F1132 PolarHBondContact O-N 3.06Å
1129	S	90.9	Very high	79.8	Confident	18 Å²	18	34 Å²	34	13%	0.126	17%	0.166	C	C	.	.	H	α-helix	trans	-61.2	-35.2	-178	58	0	0	0	0	113.7	S233 F986 F1132 N1133	S233-S1129 WeakPolarHBondContact O-CB 3.43Å; S233-S1129 PolarHBondContact O-OG 3.08Å; F986-S1129 WeakPolarHBondContact CZ-O 3.47Å; S1129-F1132 WeakPolarHBondContact O-CB 3.16Å; S1129-F1132 PolarHBondContact O-N 3.24Å; S1129-N1133 PolarHBondContact O-N 3.41Å
1130	K	92.2	Very high	82	Confident	37 Å²	37	33.6 Å²	33.6	16%	0.161	16%	0.161	C	C	.	.	H	α-helix	trans	-65.1	-40.2	175.8	-67.2	173.8	173.4	-158.7	0	111.6	P916 Q918 E939 N1128 N1133 V1134	P916-K1130 WeakPolarHBondContact O-CE 3.12Å; P916-K1130 PolarHBondContact O-NZ 3.11Å; P916-K1130 VanDerWaalsContact O-NZ 3.1Å; Q918-K1130 WeakPolarHBondContact O-CB 3.3Å; Q918-K1130 VanDerWaalsContact O-CD 3.22Å; Q918-K1130 WeakPolarHBondContact O-CD 3.42Å; Q918-K1130 WeakPolarHBondContact O-CG 3.44Å; E939-K1130 IonicContact OE1-NZ 3.74Å; E939-K1130 PolarHBondContact OE1-NZ 2.93Å; E939-K1130 IonicContact OE2-NZ 2.7Å; E939-K1130 PolarHBondContact OE2-NZ 2.93Å; N1128-K1130 VanDerWaalsContact C-N 3.32Å; N1128-K1130 PolarHBondContact O-N 3Å; N1128-K1130 WeakPolarHBondContact OD1-CB 3.4Å; N1128-K1130 PolarHBondContact OD1-N 2.58Å; K1130-N1133 PolarHBondContact O-N 3.25Å; K1130-V1134 WeakPolarHBondContact O-CG2 3.5Å; K1130-V1134 PolarHBondContact O-N 2.54Å
1131	R	92	Very high	84.2	Confident	53 Å²	53	30 Å²	30	20%	0.2	15%	0.147	C	C	.	.	H	α-helix	trans	-65.2	-43.4	173.6	-78	179.8	177.7	-179.9	-0.2	112	L919 V1093 E1094 F1125 N1128 V1134 A1135	L919-R1131 HydrophobicContact CD2-CG 3.55Å; V1093-R1131 HydrophobicContact CG1-CB 4.33Å; V1093-R1131 HydrophobicContact CG1-CG 4.39Å; V1093-R1131 HydrophobicContact CG2-CB 4.48Å; E1094-R1131 IonicContact OE1-CZ 3.6Å; E1094-R1131 IonicContact OE1-NE 3.74Å; E1094-R1131 PolarHBondContact OE1-NE 2.98Å; E1094-R1131 IonicContact OE1-NH1 2.66Å; E1094-R1131 IonicContact OE1-NH2 3.22Å; E1094-R1131 PolarHBondContact OE1-NH2 3.17Å; F1125-R1131 VanDerWaalsContact CB-NH1 3.3Å; N1128-R1131 HydrophobicContact CB-CB 4.13Å; N1128-R1131 HydrophobicContact CB-CG 4.18Å; N1128-R1131 WeakPolarHBondContact O-CB 3.32Å; N1128-R1131 PolarHBondContact O-N 3.25Å; N1128-R1131 PolarHBondContact OD1-N 2.87Å; R1131-V1134 PolarHBondContact O-N 2.87Å; R1131-A1135 WeakPolarHBondContact O-CB 3.38Å; R1131-A1135 PolarHBondContact O-N 2.67Å
1132	F	94.6	Very high	86.6	Confident	8 Å²	8	22.2 Å²	22.2	4%	0.035	12%	0.117	C	C	.	.	H	α-helix	trans	-56.4	-50.8	174.6	173.8	-89.3	0	0	0	110.8	L981 L985 F986 N1128 S1129 V1134 A1135 I1136 C1157 F1158 L1161	L981-F1132 HydrophobicContact CD2-CZ 4.43Å; L985-F1132 HydrophobicContact CD1-CE1 3.96Å; F986-F1132 AromaticContact CE2-CD1 3.86Å; F986-F1132 HydrophobicContact CE2-CD1 3.86Å; F986-F1132 HydrophobicContact CE2-CE1 4.11Å; F986-F1132 AromaticContact CZ-CD1 3.85Å; F986-F1132 HydrophobicContact CZ-CD1 3.85Å; F986-F1132 HydrophobicContact CZ-CE1 4.44Å; N1128-F1132 PolarHBondContact O-N 3.06Å; S1129-F1132 WeakPolarHBondContact O-CB 3.16Å; S1129-F1132 PolarHBondContact O-N 3.24Å; F1132-V1134 PolarHBondContact O-N 3.1Å; F1132-A1135 PolarHBondContact O-N 3.08Å; F1132-I1136 HydrophobicContact CD1-CD1 4.06Å; F1132-I1136 HydrophobicContact CD1-CG1 4.45Å; F1132-I1136 HydrophobicContact CD2-CG2 4.45Å; F1132-I1136 HydrophobicContact CE1-CD1 3.38Å; F1132-I1136 HydrophobicContact CE1-CG1 4.19Å; F1132-I1136 HydrophobicContact CE1-CG2 4.41Å; F1132-I1136 HydrophobicContact CE2-CG2 4.1Å; F1132-I1136 HydrophobicContact CZ-CD1 3.81Å; F1132-I1136 HydrophobicContact CZ-CG2 4.08Å; F1132-I1136 WeakPolarHBondContact O-CG1 3.3Å; F1132-I1136 PolarHBondContact O-N 3.23Å; F1132-C1157 HydrophobicContact CB-CB 4.43Å; F1132-C1157 HydrophobicContact CD1-CB 3.61Å; F1132-C1157 HydrophobicContact CD2-CB 4.04Å; F1132-C1157 HydrophobicContact CE1-CB 3.72Å; F1132-C1157 HydrophobicContact CE2-CB 4.15Å; F1132-C1157 HydrophobicContact CG-CB 3.77Å; F1132-C1157 HydrophobicContact CZ-CB 4Å; F1132-C1157 WeakPolarHBondContact CZ-O 3.38Å; F1132-F1158 HydrophobicContact CD2-CD1 4.17Å; F1132-F1158 HydrophobicContact CD2-CD2 4.06Å; F1132-F1158 AromaticContact CD2-CE1 3.97Å; F1132-F1158 HydrophobicContact CD2-CE1 3.97Å; F1132-F1158 AromaticContact CD2-CE2 3.85Å; F1132-F1158 HydrophobicContact CD2-CE2 3.85Å; F1132-F1158 HydrophobicContact CD2-CG 4.21Å; F1132-F1158 AromaticContact CD2-CZ 3.81Å; F1132-F1158 HydrophobicContact CD2-CZ 3.81Å; F1132-F1158 AromaticContact CE2-CD1 3.92Å; F1132-F1158 HydrophobicContact CE2-CD1 3.92Å; F1132-F1158 HydrophobicContact CE2-CD2 4.42Å; F1132-F1158 HydrophobicContact CE2-CE1 4.04Å; F1132-F1158 HydrophobicContact CE2-CG 4.12Å; F1132-F1158 HydrophobicContact CE2-CZ 4.35Å; F1132-L1161 HydrophobicContact CE2-CB 4.33Å; F1132-L1161 HydrophobicContact CE2-CD2 4.04Å; F1132-L1161 HydrophobicContact CZ-CB 4.09Å; F1132-L1161 HydrophobicContact CZ-CD2 4.34Å
1133	N	95.6	Very high	88.8	Confident	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-57.9	-46.8	179.1	-170.9	19.3	0	0	0	112.3	M917 F986 Y987 S1129 K1130 A1135 T1137	M917-N1133 PolarHBondContact O-ND2 3.43Å; F986-N1133 HydrophobicContact CD1-CB 4.18Å; F986-N1133 HydrophobicContact CD2-CB 3.8Å; F986-N1133 VanDerWaalsContact CD2-CG 3.43Å; F986-N1133 WeakPolarHBondContact CD2-OD1 2.87Å; F986-N1133 HydrophobicContact CE1-CB 3.95Å; F986-N1133 HydrophobicContact CE2-CB 3.57Å; F986-N1133 HydrophobicContact CG-CB 4.12Å; F986-N1133 HydrophobicContact CZ-CB 3.66Å; Y987-N1133 PolarHBondContact OH-ND2 2.91Å; S1129-N1133 PolarHBondContact O-N 3.41Å; K1130-N1133 PolarHBondContact O-N 3.25Å; N1133-A1135 PolarHBondContact O-N 3.38Å; N1133-T1137 WeakPolarHBondContact O-CB 3.46Å; N1133-T1137 WeakPolarHBondContact O-CG2 3.46Å; N1133-T1137 PolarHBondContact O-N 2.98Å; N1133-T1137 PolarHBondContact O-OG1 3.21Å; N1133-T1137 WeakPolarHBondContact OD1-CG2 3.26Å
1134	V	94.8	Very high	90.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.4	-48.6	176.7	171.8	0	0	0	0	110.6	Q918 L919 V1093 K1130 R1131 F1132 I1136 T1137 R1138	Q918-V1134 HydrophobicContact CB-CG2 3.85Å; Q918-V1134 HydrophobicContact CG-CG2 3.79Å; L919-V1134 HydrophobicContact CG-CG2 4.02Å; V1093-V1134 HydrophobicContact CG1-CB 3.72Å; V1093-V1134 HydrophobicContact CG1-CG1 3.57Å; K1130-V1134 WeakPolarHBondContact O-CG2 3.5Å; K1130-V1134 PolarHBondContact O-N 2.54Å; R1131-V1134 PolarHBondContact O-N 2.87Å; F1132-V1134 PolarHBondContact O-N 3.1Å; V1134-I1136 PolarHBondContact O-N 3.35Å; V1134-T1137 PolarHBondContact O-N 2.89Å; V1134-T1137 PolarHBondContact O-OG1 3.44Å; V1134-T1137 VanDerWaalsContact O-OG1 3.11Å; V1134-R1138 VanDerWaalsContact O-CG 3.26Å; V1134-R1138 WeakPolarHBondContact O-CG 3.2Å; V1134-R1138 PolarHBondContact O-N 2.9Å; V1134-R1138 PolarHBondContact O-NE 2.98Å
1135	A	95.5	Very high	92.1	Very high	7 Å²	7	19.8 Å²	19.8	6%	0.058	10%	0.097	C	C	.	.	H	α-helix	trans	-60.3	-47.6	-176.3	0	0	0	0	0	112.8	I1066 V1093 I1106 R1131 F1132 N1133 T1137	I1066-A1135 HydrophobicContact CD1-CB 4.38Å; I1066-A1135 HydrophobicContact CG2-CB 4.31Å; V1093-A1135 HydrophobicContact CG2-CB 4.24Å; I1106-A1135 HydrophobicContact CD1-CB 3.79Å; R1131-A1135 WeakPolarHBondContact O-CB 3.38Å; R1131-A1135 PolarHBondContact O-N 2.67Å; F1132-A1135 PolarHBondContact O-N 3.08Å; N1133-A1135 PolarHBondContact O-N 3.38Å; A1135-T1137 VanDerWaalsContact C-N 3.29Å; A1135-T1137 PolarHBondContact O-N 3.2Å
1136	I	96.5	Very high	93.4	Very high	6 Å²	6	14.8 Å²	14.8	3%	0.031	8%	0.075	C	C	.	.	H	α-helix	trans	-76.7	-12.7	-177.1	68.8	166.2	0	0	0	114	L981 P982 I1106 F1132 V1134 P1139 L1143	L981-I1136 HydrophobicContact CD2-CD1 4.49Å; P982-I1136 HydrophobicContact CB-CD1 3.87Å; P982-I1136 HydrophobicContact CB-CG1 4.35Å; P982-I1136 HydrophobicContact CG-CD1 4.1Å; I1106-I1136 HydrophobicContact CD1-CG2 4.06Å; F1132-I1136 HydrophobicContact CD1-CD1 4.06Å; F1132-I1136 HydrophobicContact CD1-CG1 4.45Å; F1132-I1136 HydrophobicContact CD2-CG2 4.45Å; F1132-I1136 HydrophobicContact CE1-CD1 3.38Å; F1132-I1136 HydrophobicContact CE1-CG1 4.19Å; F1132-I1136 HydrophobicContact CE1-CG2 4.41Å; F1132-I1136 HydrophobicContact CE2-CG2 4.1Å; F1132-I1136 HydrophobicContact CZ-CD1 3.81Å; F1132-I1136 HydrophobicContact CZ-CG2 4.08Å; F1132-I1136 WeakPolarHBondContact O-CG1 3.3Å; F1132-I1136 PolarHBondContact O-N 3.23Å; V1134-I1136 PolarHBondContact O-N 3.35Å; I1136-P1139 VanDerWaalsContact O-CD 3.32Å; I1136-P1139 WeakPolarHBondContact O-CD 3.38Å; I1136-L1143 HydrophobicContact CB-CD2 4.16Å; I1136-L1143 HydrophobicContact CG2-CD2 4.29Å
1137	T	96.1	Very high	94.4	Very high	5 Å²	5	14.2 Å²	14.2	3%	0.031	7%	0.072	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.6	6.3	179.7	58.9	0	0	0	0	114	P772 R973 P982 N1133 V1134 A1135	P772-T1137 HydrophobicContact CG-CG2 3.66Å; R973-T1137 VanDerWaalsContact CD-O 3.24Å; R973-T1137 WeakPolarHBondContact CD-O 3.27Å; R973-T1137 PolarHBondContact NH1-O 2.97Å; P982-T1137 HydrophobicContact CB-CG2 3.7Å; P982-T1137 HydrophobicContact CG-CG2 3.88Å; N1133-T1137 WeakPolarHBondContact O-CB 3.46Å; N1133-T1137 WeakPolarHBondContact O-CG2 3.46Å; N1133-T1137 PolarHBondContact O-N 2.98Å; N1133-T1137 PolarHBondContact O-OG1 3.21Å; N1133-T1137 WeakPolarHBondContact OD1-CG2 3.26Å; V1134-T1137 PolarHBondContact O-N 2.89Å; V1134-T1137 PolarHBondContact O-OG1 3.44Å; V1134-T1137 VanDerWaalsContact O-OG1 3.11Å; A1135-T1137 VanDerWaalsContact C-N 3.29Å; A1135-T1137 PolarHBondContact O-N 3.2Å
1138	R	95.5	Very high	95.1	Very high	3 Å²	3	12.5 Å²	12.5	1%	0.011	6%	0.06	C	C	.	.	S	Bend	trans	-77.4	-31.1	171.8	-64.1	-42.2	88.6	178.4	11.2	116.1	R973 I1066 F1096 Q1099 E1100 Y1101 I1104 V1134	R973-R1138 VanDerWaalsContact NH1-NH1 3.11Å; I1066-R1138 HydrophobicContact CD1-CB 4.22Å; I1066-R1138 HydrophobicContact CD1-CG 3.81Å; F1096-R1138 HydrophobicContact CB-CG 4.34Å; Q1099-R1138 VanDerWaalsContact O-CD 3.24Å; Q1099-R1138 WeakPolarHBondContact O-CD 3.23Å; Q1099-R1138 PolarHBondContact O-NH1 2.98Å; Q1099-R1138 VanDerWaalsContact O-NH1 3.17Å; E1100-R1138 WeakPolarHBondContact CA-O 3.28Å; Y1101-R1138 PolarHBondContact N-O 3.28Å; I1104-R1138 HydrophobicContact CD1-CB 3.79Å; I1104-R1138 HydrophobicContact CG1-CB 3.68Å; V1134-R1138 VanDerWaalsContact O-CG 3.26Å; V1134-R1138 WeakPolarHBondContact O-CG 3.2Å; V1134-R1138 PolarHBondContact O-N 2.9Å; V1134-R1138 PolarHBondContact O-NE 2.98Å
1139	P	97.3	Very high	95.4	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.044	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	143.8	-175.3	26.8	-30	0	0	0	113.1	S974 L978 Y1101 I1104 I1136 L1142 L1143	S974-P1139 PolarHBondContact OG-O 2.86Å; L978-P1139 HydrophobicContact CD1-CB 4.19Å; L978-P1139 HydrophobicContact CD1-CG 4.13Å; Y1101-P1139 WeakPolarHBondContact O-CA 3.38Å; I1104-P1139 HydrophobicContact CB-CB 3.88Å; I1104-P1139 HydrophobicContact CB-CG 4.21Å; I1104-P1139 HydrophobicContact CG1-CB 3.81Å; I1104-P1139 HydrophobicContact CG1-CG 4.34Å; I1136-P1139 VanDerWaalsContact O-CD 3.32Å; I1136-P1139 WeakPolarHBondContact O-CD 3.38Å; P1139-L1142 VanDerWaalsContact CB-O 3.27Å; P1139-L1142 WeakPolarHBondContact CB-O 3.31Å; P1139-L1143 HydrophobicContact CB-CB 4.41Å; P1139-L1143 HydrophobicContact CG-CB 3.9Å; P1139-L1143 HydrophobicContact CG-CD1 4.15Å; P1139-L1143 HydrophobicContact CG-CD2 4.45Å; P1139-L1143 HydrophobicContact CG-CG 4.37Å
1140	K	97.1	Very high	95.3	Very high	56 Å²	56	10 Å²	10	24%	0.243	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	-50.6	170.5	-61	178.2	179.3	-174.1	0	112	R973 H975 V999 V1000 E1100 Y1101 L1102	R973-K1140 HydrophobicContact CG-CG 4.06Å; R973-K1140 WeakPolarHBondContact O-CA 3.49Å; R973-K1140 WeakPolarHBondContact O-CB 3.47Å; H975-K1140 PolarHBondContact N-O 2.82Å; H975-K1140 VanDerWaalsContact N-O 3.13Å; V999-K1140 HydrophobicContact CG1-CB 4.36Å; V999-K1140 HydrophobicContact CG1-CD 4.23Å; V1000-K1140 WeakPolarHBondContact CG1-O 3.04Å; E1100-K1140 WeakPolarHBondContact OE1-CE 3.38Å; E1100-K1140 IonicContact OE1-NZ 2.83Å; E1100-K1140 PolarHBondContact OE1-NZ 2.91Å; Y1101-K1140 PolarHBondContact O-N 2.87Å; L1102-K1140 HydrophobicContact CD1-CB 4.4Å
1141	A	96.4	Very high	95.1	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	-20.8	-167.1	0	0	0	0	0	115.2	V999 L1003 P1015 L1102	V999-A1141 WeakPolarHBondContact O-CB 3.33Å; L1003-A1141 HydrophobicContact CD1-CB 4.26Å; L1003-A1141 HydrophobicContact CG-CB 4.48Å; P1015-A1141 WeakPolarHBondContact CB-O 3.36Å; L1102-A1141 HydrophobicContact CD1-CB 3.51Å; L1102-A1141 HydrophobicContact CG-CB 3.99Å; L1102-A1141 PolarHBondContact O-N 3.32Å
1142	L	97.6	Very high	95	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.027	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.8	133.6	178.2	178.5	60.6	0	0	0	112	L1003 W1006 L1009 P1015 L1050 L1102 V1103 I1104 P1139 I1144	L1003-L1142 HydrophobicContact CD1-CB 3.87Å; L1003-L1142 HydrophobicContact CD1-CD2 4.21Å; W1006-L1142 HydrophobicContact CE3-CD2 3.79Å; W1006-L1142 HydrophobicContact CZ3-CD2 3.76Å; L1009-L1142 HydrophobicContact CD2-CD1 3.81Å; P1015-L1142 WeakPolarHBondContact O-CD1 3.5Å; L1050-L1142 HydrophobicContact CD2-CD2 3.86Å; L1102-L1142 PolarHBondContact O-N 2.98Å; V1103-L1142 WeakPolarHBondContact CA-O 3.3Å; V1103-L1142 HydrophobicContact CB-CB 4.48Å; V1103-L1142 HydrophobicContact CG1-CB 4.06Å; V1103-L1142 HydrophobicContact CG1-CD2 3.97Å; V1103-L1142 HydrophobicContact CG1-CG 4.04Å; V1103-L1142 HydrophobicContact CG2-CB 4.11Å; V1103-L1142 HydrophobicContact CG2-CD2 4.39Å; I1104-L1142 PolarHBondContact N-O 3.38Å; P1139-L1142 VanDerWaalsContact CB-O 3.27Å; P1139-L1142 WeakPolarHBondContact CB-O 3.31Å; L1142-I1144 HydrophobicContact CD1-CG1 4.41Å; L1142-I1144 HydrophobicContact CD2-CD1 4.21Å; L1142-I1144 HydrophobicContact CD2-CG1 4.35Å; L1142-I1144 HydrophobicContact CG-CG1 4.15Å
1143	L	98.3	Very high	94.7	Very high	5 Å²	5	6.2 Å²	6.2	3%	0.026	3%	0.031	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	127.9	170.9	179.5	55.5	0	0	0	110.4	L978 P1015 L1016 I1017 I1104 I1106 I1136 P1139 V1145	L978-L1143 HydrophobicContact CD2-CB 3.55Å; L978-L1143 HydrophobicContact CD2-CD2 4.31Å; P1015-L1143 PolarHBondContact O-N 2.98Å; L1016-L1143 CarbonylContact C-O 3.54Å; L1016-L1143 WeakPolarHBondContact CA-O 3.4Å; L1016-L1143 HydrophobicContact CD1-CB 3.88Å; L1016-L1143 HydrophobicContact CD1-CD2 3.83Å; L1016-L1143 HydrophobicContact CD1-CG 3.8Å; I1017-L1143 PolarHBondContact N-O 3.1Å; I1104-L1143 HydrophobicContact CB-CD1 4.26Å; I1104-L1143 HydrophobicContact CG2-CD1 4.07Å; I1104-L1143 WeakPolarHBondContact O-CA 3.49Å; I1106-L1143 HydrophobicContact CD1-CD1 3.78Å; I1106-L1143 HydrophobicContact CG1-CD1 4.03Å; I1136-L1143 HydrophobicContact CB-CD2 4.16Å; I1136-L1143 HydrophobicContact CG2-CD2 4.29Å; P1139-L1143 HydrophobicContact CB-CB 4.41Å; P1139-L1143 HydrophobicContact CG-CB 3.9Å; P1139-L1143 HydrophobicContact CG-CD1 4.15Å; P1139-L1143 HydrophobicContact CG-CD2 4.45Å; P1139-L1143 HydrophobicContact CG-CG 4.37Å; L1143-V1145 HydrophobicContact CD1-CG2 3.99Å; L1143-V1145 HydrophobicContact CD2-CG2 4.17Å; L1143-V1145 HydrophobicContact CG-CG2 3.88Å
1144	I	98.3	Very high	94	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	4%	0.039	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	124.7	171.8	-54.4	180	0	0	0	108.1	W1006 I1017 Y1046 L1050 I1104 I1105 I1106 L1142 L1146	W1006-I1144 HydrophobicContact CH2-CD1 4.26Å; W1006-I1144 HydrophobicContact CZ3-CD1 4.14Å; I1017-I1144 HydrophobicContact CB-CG1 4.28Å; I1017-I1144 HydrophobicContact CB-CG2 4.26Å; I1017-I1144 HydrophobicContact CD1-CD1 4.38Å; I1017-I1144 HydrophobicContact CD1-CG1 4.32Å; I1017-I1144 HydrophobicContact CG1-CG1 4.47Å; I1017-I1144 HydrophobicContact CG2-CG2 4.47Å; I1017-I1144 CarbonylContact O-C 3.59Å; I1017-I1144 WeakPolarHBondContact O-CA 3.42Å; Y1046-I1144 HydrophobicContact CD1-CD1 3.71Å; Y1046-I1144 HydrophobicContact CD2-CG2 3.85Å; Y1046-I1144 HydrophobicContact CE1-CD1 4.18Å; Y1046-I1144 HydrophobicContact CE1-CG2 4.49Å; Y1046-I1144 HydrophobicContact CE2-CG2 3.79Å; Y1046-I1144 HydrophobicContact CG-CD1 3.92Å; Y1046-I1144 HydrophobicContact CG-CG2 4.22Å; L1050-I1144 HydrophobicContact CD1-CD1 4.32Å; I1104-I1144 PolarHBondContact O-N 3.38Å; I1105-I1144 CarbonylContact C-O 3.58Å; I1105-I1144 VanDerWaalsContact CA-O 3.27Å; I1105-I1144 WeakPolarHBondContact CA-O 3.3Å; I1105-I1144 HydrophobicContact CG1-CB 4.23Å; I1105-I1144 HydrophobicContact CG1-CD1 4.38Å; I1105-I1144 HydrophobicContact CG2-CB 4.34Å; I1105-I1144 HydrophobicContact CG2-CG2 4.39Å; I1106-I1144 PolarHBondContact N-O 3.02Å; L1142-I1144 HydrophobicContact CD1-CG1 4.41Å; L1142-I1144 HydrophobicContact CD2-CD1 4.21Å; L1142-I1144 HydrophobicContact CD2-CG1 4.35Å; L1142-I1144 HydrophobicContact CG-CG1 4.15Å; I1144-L1146 HydrophobicContact CG2-CD2 3.88Å
1145	V	98.2	Very high	93.6	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	4%	0.04	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	125.8	178.8	-175.4	0	0	0	0	109.3	I1017 F1018 H1019 I1106 L1143 L1161	I1017-V1145 PolarHBondContact O-N 2.95Å; F1018-V1145 HydrophobicContact CD2-CB 3.99Å; F1018-V1145 HydrophobicContact CD2-CG1 4.03Å; F1018-V1145 HydrophobicContact CE2-CB 4.3Å; F1018-V1145 HydrophobicContact CE2-CG1 3.81Å; H1019-V1145 PolarHBondContact N-O 2.78Å; I1106-V1145 HydrophobicContact CB-CG1 4.41Å; I1106-V1145 HydrophobicContact CB-CG2 4.38Å; I1106-V1145 HydrophobicContact CD1-CG2 4.25Å; L1143-V1145 HydrophobicContact CD1-CG2 3.99Å; L1143-V1145 HydrophobicContact CD2-CG2 4.17Å; L1143-V1145 HydrophobicContact CG-CG2 3.88Å; V1145-L1161 HydrophobicContact CG1-CD2 4.24Å; V1145-L1161 HydrophobicContact CG2-CD2 4.16Å
1146	L	97.3	Very high	93.1	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	130.9	178	-46.6	-178.1	0	0	0	109.7	H1019 Q1042 V1043 Y1046 I1105 I1106 T1108 I1144	H1019-L1146 HydrophobicContact CB-CD2 3.53Å; H1019-L1146 WeakPolarHBondContact O-CA 3.45Å; Q1042-L1146 HydrophobicContact CB-CD1 4.04Å; Q1042-L1146 HydrophobicContact CG-CD1 4.05Å; Q1042-L1146 HydrophobicContact CG-CD2 3.99Å; V1043-L1146 HydrophobicContact CB-CD1 4.22Å; V1043-L1146 HydrophobicContact CG2-CD1 3.37Å; Y1046-L1146 HydrophobicContact CD2-CD2 3.87Å; Y1046-L1146 HydrophobicContact CE2-CD2 3.58Å; I1105-L1146 HydrophobicContact CG2-CD1 4.24Å; I1105-L1146 HydrophobicContact CG2-CG 4.34Å; I1106-L1146 PolarHBondContact O-N 3.45Å; T1108-L1146 WeakPolarHBondContact CG2-O 3.44Å; T1108-L1146 PolarHBondContact N-O 2.93Å; T1108-L1146 VanDerWaalsContact N-O 3.09Å; T1108-L1146 PolarHBondContact OG1-O 3.19Å; I1144-L1146 HydrophobicContact CG2-CD2 3.88Å
1147	G	94.8	Very high	92.8	Very high	0 Å²	0	9.1 Å²	9.1	0%	0	4%	0.043	C	C	.	.	E	Extended strand (participates in β ladder)	trans	173.4	169.7	176.6	0	0	0	0	0	115	H1019 G1020 V1021 T1108 P1149	H1019-G1147 PolarHBondContact O-N 3.21Å; G1020-G1147 CarbonylContact C-O 3.58Å; G1020-G1147 VanDerWaalsContact CA-O 3.3Å; G1020-G1147 WeakPolarHBondContact CA-O 3.43Å; V1021-G1147 PolarHBondContact N-O 3.37Å; V1021-G1147 CarbonylContact O-C 3.54Å; T1108-G1147 WeakPolarHBondContact OG1-CA 3.25Å; G1147-P1149 WeakPolarHBondContact O-CD 3.49Å
1148	N	92.8	Very high	92.6	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	4%	0.044	C	C	.	.			trans	-82.2	110.6	177.5	-172.7	-18.7	0	0	0	110.9	V1021 S1111 E1113 H1150 V1151 L1152	V1021-N1148 WeakPolarHBondContact O-CA 3.36Å; V1021-N1148 WeakPolarHBondContact O-CB 3.3Å; V1021-N1148 PolarHBondContact O-N 2.75Å; S1111-N1148 PolarHBondContact O-ND2 3.16Å; E1113-N1148 WeakPolarHBondContact CG-ND2 3.4Å; E1113-N1148 PolarHBondContact OE1-ND2 2.84Å; N1148-H1150 PolarHBondContact O-N 2.85Å; N1148-H1150 WeakPolarHBondContact OD1-CB 3.3Å; N1148-H1150 PolarHBondContact OD1-CD2 2.95Å; N1148-H1150 PolarHBondContact OD1-N 3.28Å; N1148-V1151 HydrophobicContact CB-CB 4.3Å; N1148-V1151 HydrophobicContact CB-CG2 4.09Å; N1148-V1151 PolarHBondContact O-N 2.78Å; N1148-V1151 VanDerWaalsContact O-N 3.12Å; N1148-L1152 WeakPolarHBondContact O-CB 3.24Å; N1148-L1152 VanDerWaalsContact O-CG 3.29Å; N1148-L1152 WeakPolarHBondContact O-CG 3.32Å; N1148-L1152 PolarHBondContact O-N 3.48Å
1149	P	92.2	Very high	92.4	Very high	0 Å²	0	9.4 Å²	9.4	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-63	-27.2	-179	31.4	-40.2	0	0	0	113.1	G1147 V1151 V1153 L1162 Y1171 C1174	G1147-P1149 WeakPolarHBondContact O-CD 3.49Å; P1149-V1151 VanDerWaalsContact C-N 3.26Å; P1149-V1151 PolarHBondContact O-N 2.83Å; P1149-V1153 VanDerWaalsContact O-CB 3.32Å; P1149-V1153 WeakPolarHBondContact O-CB 3.19Å; P1149-V1153 WeakPolarHBondContact O-CG1 3.47Å; P1149-V1153 PolarHBondContact O-N 2.81Å; P1149-L1162 HydrophobicContact CB-CD1 4.29Å; P1149-L1162 HydrophobicContact CB-CD2 3.86Å; P1149-Y1171 HydrophobicContact CB-CE2 4.28Å; P1149-Y1171 HydrophobicContact CG-CE2 4.46Å; P1149-Y1171 WeakPolarHBondContact CG-OH 3.49Å; P1149-C1174 WeakPolarHBondContact CD-SG 3.26Å; P1149-C1174 VanDerWaalsContact CG-SG 3.59Å
1150	H	87.9	Confident	92.1	Very high	30 Å²	30	9.9 Å²	9.9	14%	0.139	5%	0.049	C	C	.	.	H	α-helix	trans	-70.6	-23.9	178.7	-60.9	-94.6	0	0	0	112.9	E1113 N1148 D1175	E1113-H1150 HydrophobicContact CG-CB 4.07Å; N1148-H1150 PolarHBondContact O-N 2.85Å; N1148-H1150 WeakPolarHBondContact OD1-CB 3.3Å; N1148-H1150 PolarHBondContact OD1-CD2 2.95Å; N1148-H1150 PolarHBondContact OD1-N 3.28Å; H1150-D1175 IonicContact CE1-OD2 3.25Å; H1150-D1175 PolarHBondContact NE2-O 2.84Å; H1150-D1175 IonicContact NE2-OD1 3.79Å; H1150-D1175 IonicContact NE2-OD2 2.83Å
1151	V	88.5	Confident	91.9	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-92.7	-45.2	175.4	-179.5	0	0	0	0	109.9	N1112 E1113 F1122 L1123 N1148 P1149 V1153 R1154	N1112-V1151 WeakPolarHBondContact O-CG2 3.23Å; E1113-V1151 HydrophobicContact CG-CG2 4.13Å; F1122-V1151 HydrophobicContact CD1-CG1 4.28Å; F1122-V1151 HydrophobicContact CE1-CG1 4.13Å; L1123-V1151 HydrophobicContact CD2-CG1 3.81Å; N1148-V1151 HydrophobicContact CB-CB 4.3Å; N1148-V1151 HydrophobicContact CB-CG2 4.09Å; N1148-V1151 PolarHBondContact O-N 2.78Å; N1148-V1151 VanDerWaalsContact O-N 3.12Å; P1149-V1151 VanDerWaalsContact C-N 3.26Å; P1149-V1151 PolarHBondContact O-N 2.83Å; V1151-V1153 PolarHBondContact O-N 3.11Å; V1151-R1154 WeakPolarHBondContact O-CB 3.46Å; V1151-R1154 WeakPolarHBondContact O-CG 3.15Å; V1151-R1154 PolarHBondContact O-N 2.84Å
1152	L	90.5	Very high	91.8	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-69.8	-27.8	-174.2	-69.2	176.9	0	0	0	114.1	F1018 T1108 L1126 N1148 R1154 D1155 F1158 L1162	F1018-L1152 HydrophobicContact CE2-CD1 4.45Å; F1018-L1152 HydrophobicContact CZ-CD1 3.78Å; T1108-L1152 HydrophobicContact CG2-CD1 4.03Å; T1108-L1152 HydrophobicContact CG2-CD2 4.13Å; L1126-L1152 HydrophobicContact CD1-CD2 4Å; N1148-L1152 WeakPolarHBondContact O-CB 3.24Å; N1148-L1152 VanDerWaalsContact O-CG 3.29Å; N1148-L1152 WeakPolarHBondContact O-CG 3.32Å; N1148-L1152 PolarHBondContact O-N 3.48Å; L1152-R1154 PolarHBondContact O-N 2.76Å; L1152-R1154 VanDerWaalsContact O-N 3.08Å; L1152-D1155 PolarHBondContact O-N 2.94Å; L1152-D1155 VanDerWaalsContact O-N 3.16Å; L1152-F1158 HydrophobicContact CB-CB 4.03Å; L1152-F1158 HydrophobicContact CB-CG 4.38Å; L1152-F1158 HydrophobicContact CD1-CD1 4.24Å; L1152-F1158 HydrophobicContact CD2-CB 4.44Å; L1152-F1158 HydrophobicContact CD2-CD1 3.95Å; L1152-F1158 HydrophobicContact CD2-CD2 4.14Å; L1152-F1158 HydrophobicContact CD2-CE1 4.18Å; L1152-F1158 HydrophobicContact CD2-CE2 4.36Å; L1152-F1158 HydrophobicContact CD2-CG 3.93Å; L1152-F1158 HydrophobicContact CD2-CZ 4.38Å; L1152-F1158 HydrophobicContact CG-CD1 4.47Å; L1152-F1158 VanDerWaalsContact O-CB 3.28Å; L1152-F1158 WeakPolarHBondContact O-CB 3.46Å; L1152-L1162 HydrophobicContact CB-CD1 4.16Å
1153	V	87.7	Confident	91.5	Very high	18 Å²	18	7.9 Å²	7.9	11%	0.109	4%	0.041	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.2	176.7	71.2	0	0	0	0	113.4	P1149 V1151 L1162 P1177 L1180	P1149-V1153 VanDerWaalsContact O-CB 3.32Å; P1149-V1153 WeakPolarHBondContact O-CB 3.19Å; P1149-V1153 WeakPolarHBondContact O-CG1 3.47Å; P1149-V1153 PolarHBondContact O-N 2.81Å; V1151-V1153 PolarHBondContact O-N 3.11Å; V1153-L1162 HydrophobicContact CB-CD1 4.06Å; V1153-P1177 HydrophobicContact CB-CG 4.34Å; V1153-P1177 HydrophobicContact CG1-CB 4.46Å; V1153-P1177 HydrophobicContact CG1-CG 4.2Å; V1153-L1180 HydrophobicContact CB-CD1 4.42Å; V1153-L1180 HydrophobicContact CG2-CD1 3.92Å; V1153-L1180 HydrophobicContact CG2-CD2 4.48Å; V1153-L1180 HydrophobicContact CG2-CG 4.09Å
1154	R	81.1	Confident	91.3	Very high	45 Å²	45	8.5 Å²	8.5	17%	0.17	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-26.1	179.8	-55.9	179.8	-174.1	-170.5	10.1	112.7	E1113 D1114 D1119 L1123 V1151 L1152	E1113-R1154 PolarHBondContact O-NH2 2.66Å; D1114-R1154 PolarHBondContact O-NH1 3.45Å; D1114-R1154 PolarHBondContact O-NH2 2.94Å; D1119-R1154 HydrophobicContact CB-CB 4.39Å; D1119-R1154 VanDerWaalsContact OD1-CD 3.3Å; D1119-R1154 WeakPolarHBondContact OD1-CD 3.42Å; D1119-R1154 IonicContact OD1-CZ 2.78Å; D1119-R1154 IonicContact OD1-NE 3.22Å; D1119-R1154 IonicContact OD1-NH1 3.45Å; D1119-R1154 PolarHBondContact OD1-NH1 2.78Å; L1123-R1154 HydrophobicContact CD1-CB 4.45Å; V1151-R1154 WeakPolarHBondContact O-CB 3.46Å; V1151-R1154 WeakPolarHBondContact O-CG 3.15Å; V1151-R1154 PolarHBondContact O-N 2.84Å; L1152-R1154 PolarHBondContact O-N 2.76Å; L1152-R1154 VanDerWaalsContact O-N 3.08Å
1155	D	85.2	Confident	91.2	Very high	6 Å²	6	8.5 Å²	8.5	3%	0.032	4%	0.043	C	C	.	.	S	Bend	trans	-86.5	132.4	172.9	176	75.9	0	0	0	110.7	S233 L1123 L1152 C1157 F1158 G1159	S233-D1155 PolarHBondContact OG-OD1 2.98Å; L1123-D1155 HydrophobicContact CD1-CB 3.79Å; L1152-D1155 PolarHBondContact O-N 2.94Å; L1152-D1155 VanDerWaalsContact O-N 3.16Å; D1155-C1157 PolarHBondContact O-N 2.78Å; D1155-C1157 WeakPolarHBondContact OD2-CA 3.45Å; D1155-C1157 VanDerWaalsContact OD2-CB 3.28Å; D1155-C1157 WeakPolarHBondContact OD2-CB 3.39Å; D1155-C1157 PolarHBondContact OD2-N 3.08Å; D1155-F1158 HydrophobicContact CB-CB 4.23Å; D1155-F1158 HydrophobicContact CB-CD2 4.05Å; D1155-F1158 PolarHBondContact O-N 3.48Å; D1155-F1158 WeakPolarHBondContact OD2-CD2 3.36Å; D1155-F1158 PolarHBondContact OD2-N 3.2Å; D1155-G1159 PolarHBondContact O-N 3.26Å
1156	P	84.9	Confident	90.9	Very high	23 Å²	23	9 Å²	9	15%	0.149	5%	0.046	C	C	.	.	H	α-helix	trans	-59.3	-38.4	-179.2	-25.8	34.4	0	0	0	114.8	F203 Y235 A1160	F203-P1156 HydrophobicContact CD2-CB 4.42Å; F203-P1156 HydrophobicContact CD2-CG 4.18Å; F203-P1156 HydrophobicContact CE2-CB 4.06Å; F203-P1156 HydrophobicContact CE2-CG 3.58Å; F203-P1156 HydrophobicContact CZ-CG 4.08Å; Y235-P1156 HydrophobicContact CD2-CB 4.45Å; Y235-P1156 HydrophobicContact CE2-CB 3.94Å; P1156-A1160 WeakPolarHBondContact O-CB 3.39Å; P1156-A1160 PolarHBondContact O-N 2.63Å
1157	C	91.1	Very high	90.6	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-71.8	-45.9	-179.1	-66.7	0	0	0	0	111.3	S233 F1132 D1155 A1160 L1161	S233-C1157 PolarHBondContact OG-SG 2.88Å; S233-C1157 VanDerWaalsContact OG-SG 3.34Å; F1132-C1157 HydrophobicContact CB-CB 4.43Å; F1132-C1157 HydrophobicContact CD1-CB 3.61Å; F1132-C1157 HydrophobicContact CD2-CB 4.04Å; F1132-C1157 HydrophobicContact CE1-CB 3.72Å; F1132-C1157 HydrophobicContact CE2-CB 4.15Å; F1132-C1157 HydrophobicContact CG-CB 3.77Å; F1132-C1157 HydrophobicContact CZ-CB 4Å; F1132-C1157 WeakPolarHBondContact CZ-O 3.38Å; D1155-C1157 PolarHBondContact O-N 2.78Å; D1155-C1157 WeakPolarHBondContact OD2-CA 3.45Å; D1155-C1157 VanDerWaalsContact OD2-CB 3.28Å; D1155-C1157 WeakPolarHBondContact OD2-CB 3.39Å; D1155-C1157 PolarHBondContact OD2-N 3.08Å; C1157-A1160 PolarHBondContact O-N 3.3Å; C1157-L1161 PolarHBondContact O-N 3.48Å
1158	F	92.2	Very high	90.5	Very high	12 Å²	12	14.1 Å²	14.1	5%	0.053	8%	0.076	C	C	.	.	H	α-helix	trans	-67.8	-35.6	174.6	-78.3	-77.4	0	0	0	112.7	T1108 L1126 F1132 L1152 D1155 A1160 L1161 L1162	T1108-F1158 HydrophobicContact CG2-CE1 3.76Å; T1108-F1158 HydrophobicContact CG2-CZ 4.02Å; L1126-F1158 HydrophobicContact CB-CE2 4.09Å; L1126-F1158 HydrophobicContact CD2-CE2 4.06Å; L1126-F1158 HydrophobicContact CD2-CZ 3.9Å; F1132-F1158 HydrophobicContact CD2-CD1 4.17Å; F1132-F1158 HydrophobicContact CD2-CD2 4.06Å; F1132-F1158 AromaticContact CD2-CE1 3.97Å; F1132-F1158 HydrophobicContact CD2-CE1 3.97Å; F1132-F1158 AromaticContact CD2-CE2 3.85Å; F1132-F1158 HydrophobicContact CD2-CE2 3.85Å; F1132-F1158 HydrophobicContact CD2-CG 4.21Å; F1132-F1158 AromaticContact CD2-CZ 3.81Å; F1132-F1158 HydrophobicContact CD2-CZ 3.81Å; F1132-F1158 AromaticContact CE2-CD1 3.92Å; F1132-F1158 HydrophobicContact CE2-CD1 3.92Å; F1132-F1158 HydrophobicContact CE2-CD2 4.42Å; F1132-F1158 HydrophobicContact CE2-CE1 4.04Å; F1132-F1158 HydrophobicContact CE2-CG 4.12Å; F1132-F1158 HydrophobicContact CE2-CZ 4.35Å; L1152-F1158 HydrophobicContact CB-CB 4.03Å; L1152-F1158 HydrophobicContact CB-CG 4.38Å; L1152-F1158 HydrophobicContact CD1-CD1 4.24Å; L1152-F1158 HydrophobicContact CD2-CB 4.44Å; L1152-F1158 HydrophobicContact CD2-CD1 3.95Å; L1152-F1158 HydrophobicContact CD2-CD2 4.14Å; L1152-F1158 HydrophobicContact CD2-CE1 4.18Å; L1152-F1158 HydrophobicContact CD2-CE2 4.36Å; L1152-F1158 HydrophobicContact CD2-CG 3.93Å; L1152-F1158 HydrophobicContact CD2-CZ 4.38Å; L1152-F1158 HydrophobicContact CG-CD1 4.47Å; L1152-F1158 VanDerWaalsContact O-CB 3.28Å; L1152-F1158 WeakPolarHBondContact O-CB 3.46Å; D1155-F1158 HydrophobicContact CB-CB 4.23Å; D1155-F1158 HydrophobicContact CB-CD2 4.05Å; D1155-F1158 PolarHBondContact O-N 3.48Å; D1155-F1158 WeakPolarHBondContact OD2-CD2 3.36Å; D1155-F1158 PolarHBondContact OD2-N 3.2Å; F1158-A1160 VanDerWaalsContact C-N 3.33Å; F1158-A1160 PolarHBondContact O-N 2.93Å; F1158-L1161 HydrophobicContact CD1-CD2 4.4Å; F1158-L1161 WeakPolarHBondContact O-CB 3.47Å; F1158-L1161 PolarHBondContact O-N 3.31Å; F1158-L1162 WeakPolarHBondContact O-CB 3.33Å; F1158-L1162 WeakPolarHBondContact O-CG 3.33Å; F1158-L1162 PolarHBondContact O-N 2.89Å
1159	G	90.4	Very high	90.5	Very high	3 Å²	3	16.2 Å²	16.2	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-58.8	-43.6	171.5	0	0	0	0	0	112	D1155 L1162 E1163	D1155-G1159 PolarHBondContact O-N 3.26Å; G1159-L1162 PolarHBondContact O-N 2.94Å; G1159-E1163 PolarHBondContact O-N 3.23Å
1160	A	90.8	Very high	90.6	Very high	10 Å²	10	16.2 Å²	16.2	8%	0.083	10%	0.097	C	C	.	.	H	α-helix	trans	-66.2	-35.5	174.5	0	0	0	0	0	112.9	L981 L985 P1156 C1157 F1158 Y1164	L981-A1160 HydrophobicContact CD1-CB 4.21Å; L985-A1160 HydrophobicContact CD1-CB 4.19Å; L985-A1160 HydrophobicContact CD2-CB 4.01Å; P1156-A1160 WeakPolarHBondContact O-CB 3.39Å; P1156-A1160 PolarHBondContact O-N 2.63Å; C1157-A1160 PolarHBondContact O-N 3.3Å; F1158-A1160 VanDerWaalsContact C-N 3.33Å; F1158-A1160 PolarHBondContact O-N 2.93Å; A1160-Y1164 VanDerWaalsContact O-CB 3.25Å; A1160-Y1164 WeakPolarHBondContact O-CB 3.43Å; A1160-Y1164 PolarHBondContact O-N 3.04Å
1161	L	94.7	Very high	90.9	Very high	4 Å²	4	15.4 Å²	15.4	2%	0.021	9%	0.093	C	C	.	.	H	α-helix	trans	-66.8	-40.9	173.2	178	63.2	0	0	0	112.2	L981 L1016 F1018 F1132 V1145 C1157 F1158 Y1164 S1165	L981-L1161 HydrophobicContact CD2-CB 3.76Å; L981-L1161 HydrophobicContact CD2-CD1 3.55Å; L981-L1161 HydrophobicContact CD2-CG 4.25Å; L1016-L1161 HydrophobicContact CD2-CD1 4.31Å; F1018-L1161 HydrophobicContact CD2-CD2 4.19Å; F1018-L1161 HydrophobicContact CD2-CG 4.2Å; F1018-L1161 HydrophobicContact CE2-CD2 4.18Å; F1018-L1161 HydrophobicContact CE2-CG 4.44Å; F1132-L1161 HydrophobicContact CE2-CB 4.33Å; F1132-L1161 HydrophobicContact CE2-CD2 4.04Å; F1132-L1161 HydrophobicContact CZ-CB 4.09Å; F1132-L1161 HydrophobicContact CZ-CD2 4.34Å; V1145-L1161 HydrophobicContact CG1-CD2 4.24Å; V1145-L1161 HydrophobicContact CG2-CD2 4.16Å; C1157-L1161 PolarHBondContact O-N 3.48Å; F1158-L1161 HydrophobicContact CD1-CD2 4.4Å; F1158-L1161 WeakPolarHBondContact O-CB 3.47Å; F1158-L1161 PolarHBondContact O-N 3.31Å; L1161-Y1164 PolarHBondContact O-N 3.35Å; L1161-S1165 VanDerWaalsContact O-CB 3.31Å; L1161-S1165 WeakPolarHBondContact O-CB 3.43Å; L1161-S1165 PolarHBondContact O-N 2.78Å; L1161-S1165 PolarHBondContact O-OG 2.9Å
1162	L	94.1	Very high	91.1	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-63.2	-49.9	175.1	-78.6	165.8	0	0	0	111.1	F1018 P1149 L1152 V1153 F1158 G1159 Y1164 S1165 I1166 Y1171 L1180	F1018-L1162 HydrophobicContact CD1-CD2 3.89Å; F1018-L1162 HydrophobicContact CD2-CD2 4.15Å; F1018-L1162 HydrophobicContact CE1-CD2 3.45Å; F1018-L1162 VanDerWaalsContact CE1-CD2 3.45Å; F1018-L1162 HydrophobicContact CE2-CD2 3.71Å; F1018-L1162 HydrophobicContact CE2-CG 4.08Å; F1018-L1162 HydrophobicContact CG-CD2 4.23Å; F1018-L1162 HydrophobicContact CZ-CD2 3.35Å; F1018-L1162 HydrophobicContact CZ-CG 4.02Å; P1149-L1162 HydrophobicContact CB-CD1 4.29Å; P1149-L1162 HydrophobicContact CB-CD2 3.86Å; L1152-L1162 HydrophobicContact CB-CD1 4.16Å; V1153-L1162 HydrophobicContact CB-CD1 4.06Å; F1158-L1162 WeakPolarHBondContact O-CB 3.33Å; F1158-L1162 WeakPolarHBondContact O-CG 3.33Å; F1158-L1162 PolarHBondContact O-N 2.89Å; G1159-L1162 PolarHBondContact O-N 2.94Å; L1162-Y1164 VanDerWaalsContact C-N 3.29Å; L1162-Y1164 PolarHBondContact O-N 3.23Å; L1162-S1165 PolarHBondContact O-N 3.07Å; L1162-S1165 VanDerWaalsContact O-N 3.14Å; L1162-I1166 WeakPolarHBondContact O-CD1 3.45Å; L1162-I1166 VanDerWaalsContact O-CG1 3.24Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.39Å; L1162-I1166 PolarHBondContact O-N 2.86Å; L1162-Y1171 HydrophobicContact CD2-CD2 4.28Å; L1162-Y1171 HydrophobicContact CD2-CE2 4.19Å; L1162-L1180 HydrophobicContact CB-CD1 3.88Å; L1162-L1180 HydrophobicContact CD1-CD1 4.04Å; L1162-L1180 HydrophobicContact CG-CD1 4.41Å
1163	E	91.1	Very high	90.9	Very high	10 Å²	10	18.9 Å²	18.9	5%	0.047	11%	0.114	C	C	.	.	H	α-helix	trans	-56	-45.2	175.2	-178	-174.9	-174.2	0	0	111.1	R219 G1159 S1165 T1167 L1183	R219-E1163 IonicContact CZ-OE1 3.76Å; R219-E1163 IonicContact NH1-OE1 3.73Å; R219-E1163 PolarHBondContact NH1-OE1 3.05Å; G1159-E1163 PolarHBondContact O-N 3.23Å; E1163-S1165 PolarHBondContact O-N 2.98Å; E1163-T1167 VanDerWaalsContact O-CB 3.23Å; E1163-T1167 WeakPolarHBondContact O-CB 3.46Å; E1163-T1167 PolarHBondContact O-N 3.36Å; E1163-T1167 PolarHBondContact O-OG1 2.88Å; E1163-L1183 HydrophobicContact CB-CD1 4.32Å; E1163-L1183 HydrophobicContact CG-CD1 3.89Å
1164	Y	93.5	Very high	90.9	Very high	18 Å²	18	18.9 Å²	18.9	7%	0.071	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-42.8	177.4	-174.5	-114.5	0	0	0	112.2	A977 M980 L981 F1014 L1016 A1160 L1161 L1162 N1168	A977-Y1164 WeakPolarHBondContact O-CE1 3.46Å; A977-Y1164 PolarHBondContact O-OH 3.46Å; M980-Y1164 HydrophobicContact CE-CE2 4.31Å; M980-Y1164 HydrophobicContact SD-CD2 4.45Å; M980-Y1164 HydrophobicContact SD-CE2 3.4Å; M980-Y1164 WeakPolarHBondContact SD-CE2 3.43Å; L981-Y1164 HydrophobicContact CB-CD1 4.41Å; F1014-Y1164 HydrophobicContact CE1-CE1 4.19Å; F1014-Y1164 AromaticContact CZ-CE1 3.9Å; F1014-Y1164 HydrophobicContact CZ-CE1 3.9Å; F1014-Y1164 AromaticContact CZ-CZ 3.76Å; F1014-Y1164 WeakPolarHBondContact CZ-OH 3.36Å; L1016-Y1164 HydrophobicContact CD2-CD1 3.83Å; L1016-Y1164 HydrophobicContact CD2-CE1 3.96Å; A1160-Y1164 VanDerWaalsContact O-CB 3.25Å; A1160-Y1164 WeakPolarHBondContact O-CB 3.43Å; A1160-Y1164 PolarHBondContact O-N 3.04Å; L1161-Y1164 PolarHBondContact O-N 3.35Å; L1162-Y1164 VanDerWaalsContact C-N 3.29Å; L1162-Y1164 PolarHBondContact O-N 3.23Å; Y1164-N1168 WeakPolarHBondContact CD2-ND2 3.37Å; Y1164-N1168 WeakPolarHBondContact CE2-ND2 3.02Å; Y1164-N1168 WeakPolarHBondContact O-CB 3.22Å; Y1164-N1168 PolarHBondContact O-N 2.81Å; Y1164-N1168 PolarHBondContact O-ND2 3.33Å
1165	S	95.3	Very high	91	Very high	0 Å²	0	17.3 Å²	17.3	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-68.9	-40.7	-178.7	-58.2	0	0	0	0	112.3	L1161 L1162 E1163 G1169 V1170 Y1171	L1161-S1165 VanDerWaalsContact O-CB 3.31Å; L1161-S1165 WeakPolarHBondContact O-CB 3.43Å; L1161-S1165 PolarHBondContact O-N 2.78Å; L1161-S1165 PolarHBondContact O-OG 2.9Å; L1162-S1165 PolarHBondContact O-N 3.07Å; L1162-S1165 VanDerWaalsContact O-N 3.14Å; E1163-S1165 PolarHBondContact O-N 2.98Å; S1165-G1169 PolarHBondContact O-N 2.96Å; S1165-V1170 VanDerWaalsContact O-CG2 3.28Å; S1165-V1170 WeakPolarHBondContact O-CG2 3.29Å; S1165-V1170 PolarHBondContact O-N 3.38Å; S1165-Y1171 PolarHBondContact O-N 3.33Å
1166	I	93	Very high	91.1	Very high	11 Å²	11	17.4 Å²	17.4	6%	0.056	11%	0.11	C	C	.	.	H	α-helix	trans	-70.8	-48	179.8	-64.7	161.1	0	0	0	110.3	L1162 N1168 G1169 Y1171 L1176 L1180 L1183	L1162-I1166 WeakPolarHBondContact O-CD1 3.45Å; L1162-I1166 VanDerWaalsContact O-CG1 3.24Å; L1162-I1166 WeakPolarHBondContact O-CG1 3.39Å; L1162-I1166 PolarHBondContact O-N 2.86Å; I1166-N1168 PolarHBondContact O-N 3.41Å; I1166-G1169 PolarHBondContact O-N 2.95Å; I1166-Y1171 HydrophobicContact CG1-CD2 4.37Å; I1166-Y1171 HydrophobicContact CG1-CG 4.07Å; I1166-L1176 HydrophobicContact CD1-CD1 3.84Å; I1166-L1176 HydrophobicContact CD1-CD2 3.56Å; I1166-L1176 HydrophobicContact CD1-CG 4.37Å; I1166-L1176 HydrophobicContact CG1-CD1 4.15Å; I1166-L1176 HydrophobicContact CG1-CD2 4.1Å; I1166-L1176 HydrophobicContact CG2-CD1 4.37Å; I1166-L1180 HydrophobicContact CD1-CB 3.9Å; I1166-L1180 HydrophobicContact CD1-CD1 3.85Å; I1166-L1180 HydrophobicContact CD1-CD2 4.28Å; I1166-L1180 HydrophobicContact CD1-CG 4.25Å; I1166-L1183 HydrophobicContact CG2-CB 3.78Å
1167	T	90.8	Very high	91.1	Very high	73 Å²	73	16.6 Å²	16.6	45%	0.448	11%	0.105	S	C	.	.	H	α-helix	trans	-60.3	-31.9	-179.6	-58.2	0	0	0	0	112	E1163	E1163-T1167 VanDerWaalsContact O-CB 3.23Å; E1163-T1167 WeakPolarHBondContact O-CB 3.46Å; E1163-T1167 PolarHBondContact O-N 3.36Å; E1163-T1167 PolarHBondContact O-OG1 2.88Å
1168	N	93.4	Very high	90.5	Very high	34 Å²	34	20.5 Å²	20.5	18%	0.182	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.2	177.6	-72.8	-76.8	0	0	0	114.2	K1011 F1014 Y1164 I1166 V1170	K1011-N1168 WeakPolarHBondContact CD-O 3.47Å; K1011-N1168 PolarHBondContact NZ-O 3.34Å; F1014-N1168 HydrophobicContact CD2-CB 4.39Å; F1014-N1168 HydrophobicContact CE1-CB 4.18Å; F1014-N1168 HydrophobicContact CE2-CB 3.75Å; F1014-N1168 WeakPolarHBondContact CE2-OD1 3.36Å; F1014-N1168 HydrophobicContact CZ-CB 3.61Å; Y1164-N1168 WeakPolarHBondContact CD2-ND2 3.37Å; Y1164-N1168 WeakPolarHBondContact CE2-ND2 3.02Å; Y1164-N1168 WeakPolarHBondContact O-CB 3.22Å; Y1164-N1168 PolarHBondContact O-N 2.81Å; Y1164-N1168 PolarHBondContact O-ND2 3.33Å; I1166-N1168 PolarHBondContact O-N 3.41Å; N1168-V1170 HydrophobicContact CB-CG2 4.42Å
1169	G	92.3	Very high	89.6	Confident	44 Å²	44	21.7 Å²	21.7	45%	0.454	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	28.5	177.9	0	0	0	0	0	114.4	S1165 I1166	S1165-G1169 PolarHBondContact O-N 2.96Å; I1166-G1169 PolarHBondContact O-N 2.95Å
1170	V	94.7	Very high	89.2	Confident	0 Å²	0	21.6 Å²	21.6	0%	0	14%	0.141	C	C	.	.			trans	-111.3	7.5	-179.1	-63.9	0	0	0	0	114.5	K1011 F1014 L1016 F1018 S1165 N1168	K1011-V1170 HydrophobicContact CB-CG1 3.95Å; F1014-V1170 HydrophobicContact CB-CG1 3.96Å; F1014-V1170 HydrophobicContact CD1-CB 4.43Å; F1014-V1170 HydrophobicContact CD1-CG1 3.51Å; F1014-V1170 HydrophobicContact CD1-CG2 4.25Å; F1014-V1170 HydrophobicContact CE1-CG1 4.19Å; F1014-V1170 HydrophobicContact CE1-CG2 4.14Å; F1014-V1170 HydrophobicContact CG-CG1 3.86Å; L1016-V1170 HydrophobicContact CB-CG2 4.21Å; L1016-V1170 HydrophobicContact CD2-CG2 4.02Å; L1016-V1170 HydrophobicContact CG-CG2 4.04Å; L1016-V1170 VanDerWaalsContact O-CB 3.27Å; L1016-V1170 WeakPolarHBondContact O-CB 3.42Å; F1018-V1170 PolarHBondContact N-O 2.94Å; F1018-V1170 VanDerWaalsContact N-O 3.09Å; S1165-V1170 VanDerWaalsContact O-CG2 3.28Å; S1165-V1170 WeakPolarHBondContact O-CG2 3.29Å; S1165-V1170 PolarHBondContact O-N 3.38Å; N1168-V1170 HydrophobicContact CB-CG2 4.42Å
1171	Y	94.6	Very high	88.6	Confident	12 Å²	12	23.3 Å²	23.3	5%	0.047	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	129	171.2	178.3	-85.4	0	0	0	111.5	F1018 P1149 L1162 S1165 I1166 C1174 D1175 L1176	F1018-Y1171 HydrophobicContact CB-CD2 4.22Å; F1018-Y1171 AromaticContact CD1-CD2 3.52Å; F1018-Y1171 HydrophobicContact CD1-CD2 3.52Å; F1018-Y1171 AromaticContact CD1-CE2 3.57Å; F1018-Y1171 HydrophobicContact CD1-CE2 3.57Å; F1018-Y1171 HydrophobicContact CE1-CD2 4.27Å; F1018-Y1171 AromaticContact CE1-CE2 3.92Å; F1018-Y1171 HydrophobicContact CE1-CE2 3.92Å; F1018-Y1171 HydrophobicContact CG-CD2 4.13Å; F1018-Y1171 WeakPolarHBondContact O-CA 3.31Å; P1149-Y1171 HydrophobicContact CB-CE2 4.28Å; P1149-Y1171 HydrophobicContact CG-CE2 4.46Å; P1149-Y1171 WeakPolarHBondContact CG-OH 3.49Å; L1162-Y1171 HydrophobicContact CD2-CD2 4.28Å; L1162-Y1171 HydrophobicContact CD2-CE2 4.19Å; S1165-Y1171 PolarHBondContact O-N 3.33Å; I1166-Y1171 HydrophobicContact CG1-CD2 4.37Å; I1166-Y1171 HydrophobicContact CG1-CG 4.07Å; Y1171-C1174 WeakPolarHBondContact CE1-O 3.48Å; Y1171-C1174 PolarHBondContact OH-O 3.09Å; Y1171-D1175 PolarHBondContact OH-O 3.38Å; Y1171-L1176 HydrophobicContact CD1-CD2 3.86Å; Y1171-L1176 HydrophobicContact CD1-CG 4.27Å; Y1171-L1176 HydrophobicContact CD2-CD2 4.05Å; Y1171-L1176 HydrophobicContact CE1-CD2 3.49Å; Y1171-L1176 VanDerWaalsContact CE1-CD2 3.49Å; Y1171-L1176 HydrophobicContact CE1-CG 3.86Å; Y1171-L1176 HydrophobicContact CE2-CD2 3.68Å; Y1171-L1176 HydrophobicContact CG-CD2 4.14Å; Y1171-L1176 VanDerWaalsContact CZ-CD2 3.4Å
1172	M	91	Very high	87.6	Confident	60 Å²	60	26.9 Å²	26.9	30%	0.296	17%	0.172	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	178.4	172.7	-60.9	-161.1	-54.6	0	0	110.6	P1010 I1017 F1018 H1019 G1020	P1010-M1172 HydrophobicContact CB-CE 4.49Å; P1010-M1172 HydrophobicContact CB-CG 3.93Å; P1010-M1172 HydrophobicContact CB-SD 3.75Å; P1010-M1172 HydrophobicContact CG-CE 3.79Å; P1010-M1172 HydrophobicContact CG-CG 3.79Å; P1010-M1172 HydrophobicContact CG-SD 3.68Å; I1017-M1172 HydrophobicContact CG2-CE 4.37Å; F1018-M1172 PolarHBondContact O-N 2.78Å; H1019-M1172 CarbonylContact C-O 3.59Å; H1019-M1172 WeakPolarHBondContact CA-O 3.48Å; G1020-M1172 PolarHBondContact N-O 2.97Å
1173	G	87.2	Confident	86.5	Confident	14 Å²	14	28.4 Å²	28.4	14%	0.144	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	98.2	-138.7	179.6	0	0	0	0	0	112.4	G1020	G1020-G1173 CarbonylContact O-C 3.59Å; G1020-G1173 WeakPolarHBondContact O-CA 3.27Å
1174	C	86.8	Confident	85.3	Confident	17 Å²	17	31.3 Å²	31.3	12%	0.115	19%	0.194	C	C	.	.	S	Bend	trans	-67.7	175.5	-176.4	71	0	0	0	0	114.4	G1020 R1022 P1149 Y1171	G1020-C1174 PolarHBondContact O-N 3.14Å; R1022-C1174 HydrophobicContact CG-CB 3.92Å; P1149-C1174 WeakPolarHBondContact CD-SG 3.26Å; P1149-C1174 VanDerWaalsContact CG-SG 3.59Å; Y1171-C1174 WeakPolarHBondContact CE1-O 3.48Å; Y1171-C1174 PolarHBondContact OH-O 3.09Å
1175	D	83.6	Confident	83.4	Confident	12 Å²	12	37 Å²	37	6%	0.064	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-59.5	154.8	175.1	61.1	-59.8	0	0	0	112.8	W312 R1022 H1150 Y1171	W312-D1175 HydrophobicContact CB-CB 4.07Å; W312-D1175 HydrophobicContact CE3-CB 4.49Å; R1022-D1175 IonicContact CZ-OD1 3.98Å; R1022-D1175 IonicContact NH1-OD1 3.32Å; R1022-D1175 PolarHBondContact NH1-OD1 3.29Å; R1022-D1175 IonicContact NH1-OD2 2.82Å; R1022-D1175 PolarHBondContact NH1-OD2 3.01Å; H1150-D1175 IonicContact CE1-OD2 3.25Å; H1150-D1175 PolarHBondContact NE2-O 2.84Å; H1150-D1175 IonicContact NE2-OD1 3.79Å; H1150-D1175 IonicContact NE2-OD2 2.83Å; Y1171-D1175 PolarHBondContact OH-O 3.38Å
1176	L	87	Confident	80.9	Confident	8 Å²	8	42.3 Å²	42.3	4%	0.042	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-88.7	144.4	178	-73.1	175.2	0	0	0	111	I1166 Y1171 L1180 Q1181 Q1184	I1166-L1176 HydrophobicContact CD1-CD1 3.84Å; I1166-L1176 HydrophobicContact CD1-CD2 3.56Å; I1166-L1176 HydrophobicContact CD1-CG 4.37Å; I1166-L1176 HydrophobicContact CG1-CD1 4.15Å; I1166-L1176 HydrophobicContact CG1-CD2 4.1Å; I1166-L1176 HydrophobicContact CG2-CD1 4.37Å; Y1171-L1176 HydrophobicContact CD1-CD2 3.86Å; Y1171-L1176 HydrophobicContact CD1-CG 4.27Å; Y1171-L1176 HydrophobicContact CD2-CD2 4.05Å; Y1171-L1176 HydrophobicContact CE1-CD2 3.49Å; Y1171-L1176 VanDerWaalsContact CE1-CD2 3.49Å; Y1171-L1176 HydrophobicContact CE1-CG 3.86Å; Y1171-L1176 HydrophobicContact CE2-CD2 3.68Å; Y1171-L1176 HydrophobicContact CG-CD2 4.14Å; Y1171-L1176 VanDerWaalsContact CZ-CD2 3.4Å; L1176-L1180 HydrophobicContact CB-CB 4.44Å; L1176-Q1181 HydrophobicContact CB-CG 4.27Å; L1176-Q1181 PolarHBondContact O-NE2 2.87Å; L1176-Q1181 VanDerWaalsContact O-NE2 3.17Å; L1176-Q1184 HydrophobicContact CD1-CB 4.39Å
1177	P	84.7	Confident	78.1	Confident	7 Å²	7	44.3 Å²	44.3	5%	0.045	28%	0.284	C	S	.	.	P	Polyproline II helix	trans	-59.9	148.8	171.6	26	-33.9	0	0	0	110.5	V1153 A1179 L1180 Q1181	V1153-P1177 HydrophobicContact CB-CG 4.34Å; V1153-P1177 HydrophobicContact CG1-CB 4.46Å; V1153-P1177 HydrophobicContact CG1-CG 4.2Å; P1177-A1179 PolarHBondContact O-N 2.75Å; P1177-L1180 HydrophobicContact CG-CB 4.17Å; P1177-L1180 HydrophobicContact CG-CD1 3.68Å; P1177-L1180 HydrophobicContact CG-CG 3.99Å; P1177-L1180 PolarHBondContact O-N 3.28Å; P1177-Q1181 PolarHBondContact O-N 3.23Å
1178	P	78.5	Confident	75.2	Confident	82 Å²	82	48.9 Å²	48.9	53%	0.532	30%	0.301	S	S	.	.	H	α-helix	trans	-50.7	-34.2	-177.2	-29.4	35	0	0	0	114.3	L1180 Q1181	P1178-L1180 PolarHBondContact O-N 3.45Å; P1178-Q1181 PolarHBondContact O-N 3.44Å
1179	A	73.8	Confident	72	Confident	37 Å²	37	50.4 Å²	50.4	31%	0.306	32%	0.324	S	S	.	.	H	α-helix	trans	-56.5	-27.7	175	0	0	0	0	0	115.4	P1177	P1177-A1179 PolarHBondContact O-N 2.75Å
1180	L	82.8	Confident	68.9	Low	0 Å²	0	55.1 Å²	55.1	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-110.7	-9.2	-173.2	-68.6	178.5	0	0	0	113.1	C192 V1153 L1162 I1166 L1176 P1177 P1178 S1182 L1183	C192-L1180 WeakPolarHBondContact SG-CD2 3.4Å; V1153-L1180 HydrophobicContact CB-CD1 4.42Å; V1153-L1180 HydrophobicContact CG2-CD1 3.92Å; V1153-L1180 HydrophobicContact CG2-CD2 4.48Å; V1153-L1180 HydrophobicContact CG2-CG 4.09Å; L1162-L1180 HydrophobicContact CB-CD1 3.88Å; L1162-L1180 HydrophobicContact CD1-CD1 4.04Å; L1162-L1180 HydrophobicContact CG-CD1 4.41Å; I1166-L1180 HydrophobicContact CD1-CB 3.9Å; I1166-L1180 HydrophobicContact CD1-CD1 3.85Å; I1166-L1180 HydrophobicContact CD1-CD2 4.28Å; I1166-L1180 HydrophobicContact CD1-CG 4.25Å; L1176-L1180 HydrophobicContact CB-CB 4.44Å; P1177-L1180 HydrophobicContact CG-CB 4.17Å; P1177-L1180 HydrophobicContact CG-CD1 3.68Å; P1177-L1180 HydrophobicContact CG-CG 3.99Å; P1177-L1180 PolarHBondContact O-N 3.28Å; P1178-L1180 PolarHBondContact O-N 3.45Å; L1180-S1182 VanDerWaalsContact C-N 3.25Å; L1180-S1182 PolarHBondContact O-N 3.43Å; L1180-L1183 HydrophobicContact CD2-CD1 3.77Å; L1180-L1183 WeakPolarHBondContact O-CB 3.42Å; L1180-L1183 PolarHBondContact O-N 3.33Å; L1180-L1183 VanDerWaalsContact O-N 3.15Å
1181	Q	78.6	Confident	65.5	Low	47 Å²	47	59.5 Å²	59.5	22%	0.22	38%	0.38	C	S	.	.	H	α-helix	trans	-61.6	-33.1	-176.7	-71.1	178.1	-4.5	0	0	112.6	L1176 P1177 P1178 L1183 Q1184	L1176-Q1181 HydrophobicContact CB-CG 4.27Å; L1176-Q1181 PolarHBondContact O-NE2 2.87Å; L1176-Q1181 VanDerWaalsContact O-NE2 3.17Å; P1177-Q1181 PolarHBondContact O-N 3.23Å; P1178-Q1181 PolarHBondContact O-N 3.44Å; Q1181-L1183 PolarHBondContact O-N 3.15Å; Q1181-Q1184 WeakPolarHBondContact O-CB 3.37Å; Q1181-Q1184 PolarHBondContact O-N 3.31Å
1182	S	72.3	Confident	62.2	Low	79 Å²	79	65.3 Å²	65.3	55%	0.552	41%	0.412	S	S	*	.	H	α-helix	trans	-62.4	-28.6	177.8	55.2	0	0	0	0	113.7	L1180 Q1184	L1180-S1182 VanDerWaalsContact C-N 3.25Å; L1180-S1182 PolarHBondContact O-N 3.43Å; S1182-Q1184 VanDerWaalsContact C-N 3.32Å
1183	L	72.4	Confident	59.3	Low	31 Å²	31	68.5 Å²	68.5	16%	0.162	44%	0.437	C	S	.	.	H	α-helix	trans	-75.6	-21.7	-179.6	-67.6	167.4	0	0	0	112.6	E1163 I1166 L1180 Q1181 N1185 C1186	E1163-L1183 HydrophobicContact CB-CD1 4.32Å; E1163-L1183 HydrophobicContact CG-CD1 3.89Å; I1166-L1183 HydrophobicContact CG2-CB 3.78Å; L1180-L1183 HydrophobicContact CD2-CD1 3.77Å; L1180-L1183 WeakPolarHBondContact O-CB 3.42Å; L1180-L1183 PolarHBondContact O-N 3.33Å; L1180-L1183 VanDerWaalsContact O-N 3.15Å; Q1181-L1183 PolarHBondContact O-N 3.15Å; L1183-N1185 VanDerWaalsContact C-N 3.32Å; L1183-N1185 PolarHBondContact O-N 3.06Å; L1183-C1186 PolarHBondContact O-N 3.1Å
1184	Q	65.6	Low	56.4	Low	71 Å²	71	70.6 Å²	70.6	33%	0.332	45%	0.449	S	S	.	.	H	α-helix	trans	-67	-36	-179.8	-165.3	170.6	-9.6	0	0	111.5	L1176 Q1181 S1182 C1186 G1187	L1176-Q1184 HydrophobicContact CD1-CB 4.39Å; Q1181-Q1184 WeakPolarHBondContact O-CB 3.37Å; Q1181-Q1184 PolarHBondContact O-N 3.31Å; S1182-Q1184 VanDerWaalsContact C-N 3.32Å; Q1184-C1186 VanDerWaalsContact C-N 3.26Å; Q1184-C1186 PolarHBondContact O-N 3.27Å; Q1184-G1187 PolarHBondContact O-N 3.06Å
1185	N	53.3	Low	53.5	Low	139 Å²	139	79.9 Å²	79.9	74%	0.743	48%	0.484	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-15	-179.7	-66	-8.1	0	0	0	113.8	L1183	L1183-N1185 VanDerWaalsContact C-N 3.32Å; L1183-N1185 PolarHBondContact O-N 3.06Å
1186	C	42.7	Very low	50.8	Low	111 Å²	111	84.9 Å²	84.9	75%	0.75	52%	0.517	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-18.9	176.6	-74	0	0	0	0	113.6	L1183 Q1184	L1183-C1186 PolarHBondContact O-N 3.1Å; Q1184-C1186 VanDerWaalsContact C-N 3.26Å; Q1184-C1186 PolarHBondContact O-N 3.27Å
1187	G	33.7	Very low	47.8	Very low	52 Å²	52	91 Å²	91	54%	0.536	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-87.5	-21.8	-175.1	0	0	0	0	0	115.1	Q1184 G1189	Q1184-G1187 PolarHBondContact O-N 3.06Å; G1187-G1189 PolarHBondContact O-N 3.37Å
1188	E	30	Very low	45	Very low	170 Å²	170	96.5 Å²	96.5	79%	0.794	59%	0.588	S	S	*	*			trans	-101.6	46	-178.9	-68.1	-178.1	177.1	0	0	111.4	V1190	E1188-V1190 PolarHBondContact O-N 3.3Å
1189	G	27.1	Very low	42.5	Very low	65 Å²	65	97.9 Å²	97.9	67%	0.67	60%	0.596	S	S	*	*			trans	-83.4	98.2	164.1	0	0	0	0	0	109.7	G1187	G1187-G1189 PolarHBondContact O-N 3.37Å
1190	V	25.8	Very low	40.3	Very low	144 Å²	144	105.3 Å²	105.3	87%	0.873	63%	0.625	S	S	*	*	S	Bend	trans	141.3	120	150.7	171.6	0	0	0	0	111.4	E1188	E1188-V1190 PolarHBondContact O-N 3.3Å
1191	A	24.2	Very low	37.6	Very low	92 Å²	92	110.6 Å²	110.6	76%	0.76	66%	0.662	S	S	*	*			trans	87.4	69.8	164.6	0	0	0	0	0	118.5
1192	D	24.9	Very low	35.3	Very low	133 Å²	133	115 Å²	115	71%	0.711	69%	0.692	S	S	*	*			trans	-123.9	110.1	137	-156.3	-2.7	0	0	0	109.3	S1194	D1192-S1194 VanDerWaalsContact C-N 3.29Å; D1192-S1194 PolarHBondContact O-N 2.73Å; D1192-S1194 PolarHBondContact OD1-OG 3.18Å
1193	P	30.9	Very low	33.1	Very low	127 Å²	127	114.4 Å²	114.4	83%	0.825	70%	0.698	S	S	*	*			trans	-80.1	-0.6	-177	-5.3	21.9	0	0	0	114.4	Y1195	P1193-Y1195 PolarHBondContact O-N 3.02Å
1194	S	26.1	Very low	31.2	Very low	58 Å²	58	118.6 Å²	118.6	41%	0.406	73%	0.728	S	S	.	*			trans	-92.1	86.5	178.1	55.7	0	0	0	0	110.5	D1192	D1192-S1194 VanDerWaalsContact C-N 3.29Å; D1192-S1194 PolarHBondContact O-N 2.73Å; D1192-S1194 PolarHBondContact OD1-OG 3.18Å
1195	Y	24.9	Very low	29.5	Very low	212 Å²	212	123.5 Å²	123.5	83%	0.831	75%	0.75	S	S	*	*			trans	169.6	105.5	140.4	-87.9	-65.2	0	0	0	107.9	P1193 V1197	P1193-Y1195 PolarHBondContact O-N 3.02Å; Y1195-V1197 PolarHBondContact O-N 3.08Å
1196	P	26.7	Very low	28.5	Very low	118 Å²	118	126.2 Å²	126.2	77%	0.766	76%	0.755	S	S	*	*			trans	-69.3	120.1	171.2	16.1	-9.2	0	0	0	108.9	V1198	P1196-V1198 PolarHBondContact O-N 3.22Å
1197	V	25.4	Very low	28.1	Very low	136 Å²	136	129 Å²	129	82%	0.824	76%	0.757	S	S	*	*			trans	-60.5	106.3	166.2	177.9	0	0	0	0	107.3	Y1195 P1199	Y1195-V1197 PolarHBondContact O-N 3.08Å; V1197-P1199 WeakPolarHBondContact O-CD 3.43Å
1198	V	24.5	Very low	27.8	Very low	123 Å²	123	135.6 Å²	135.6	75%	0.745	77%	0.774	S	S	*	*			trans	-74.7	117.9	167.7	-179.8	0	0	0	0	106.6	P1196 E1200	P1196-V1198 PolarHBondContact O-N 3.22Å; V1198-E1200 PolarHBondContact O-N 3.31Å
1199	P	26.8	Very low	27.6	Very low	110 Å²	110	136.5 Å²	136.5	71%	0.714	78%	0.778	S	S	*	*			trans	-71.1	123.7	176.9	6.1	5.6	0	0	0	109.2	V1197 S1201	V1197-P1199 WeakPolarHBondContact O-CD 3.43Å; P1199-S1201 PolarHBondContact O-N 3.02Å
1200	E	26.8	Very low	27.8	Very low	193 Å²	193	139.1 Å²	139.1	90%	0.902	78%	0.784	S	S	*	*			trans	-58.7	107	167.1	-75.4	-179.9	153.9	0	0	109.1	V1198 T1202	V1198-E1200 PolarHBondContact O-N 3.31Å; E1200-T1202 PolarHBondContact O-N 2.79Å
1201	S	27.2	Very low	28	Very low	111 Å²	111	141.7 Å²	141.7	78%	0.776	81%	0.808	S	S	*	*			trans	-67.6	115.5	167.7	54.6	0	0	0	0	108.8	P1199 G1203	P1199-S1201 PolarHBondContact O-N 3.02Å; S1201-G1203 PolarHBondContact O-N 3.41Å; S1201-G1203 VanDerWaalsContact O-N 3.08Å
1202	T	29.6	Very low	28.2	Very low	141 Å²	141	144.2 Å²	144.2	87%	0.865	81%	0.81	S	S	*	*			trans	-51.7	108.3	165.3	45.7	0	0	0	0	110.2	E1200	E1200-T1202 PolarHBondContact O-N 2.79Å
1203	G	27.6	Very low	28.4	Very low	66 Å²	66	144.7 Å²	144.7	68%	0.68	82%	0.815	S	S	*	*			trans	-71	144	170.7	0	0	0	0	0	111.1	S1201	S1201-G1203 PolarHBondContact O-N 3.41Å; S1201-G1203 VanDerWaalsContact O-N 3.08Å
1204	P	31.8	Very low	28.3	Very low	119 Å²	119	145.7 Å²	145.7	77%	0.773	82%	0.815	S	S	*	*			trans	-84.4	138.8	-165.3	32.7	-33.1	0	0	0	112.9	K1206	P1204-K1206 PolarHBondContact O-N 3.08Å
1205	E	29.9	Very low	28.4	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.813	84%	0.839	S	S	*	*			trans	-55.8	113	165.1	-69.4	176	148.7	0	0	110.2
1206	K	32.3	Very low	28.6	Very low	195 Å²	195	147.1 Å²	147.1	85%	0.848	84%	0.839	S	S	*	*			trans	-94	97.2	163	-83.2	-174.5	175.3	-179.6	0	108.4	P1204 Q1208	P1204-K1206 PolarHBondContact O-N 3.08Å; K1206-Q1208 PolarHBondContact O-N 3.17Å
1207	H	34	Very low	28.8	Very low	171 Å²	171	149 Å²	149	79%	0.792	84%	0.844	S	S	*	*			trans	-58.6	118.5	159.4	-83.1	-81.3	0	0	0	109.5
1208	Q	26.4	Very low	29	Very low	190 Å²	190	149.9 Å²	149.9	89%	0.888	85%	0.846	S	S	*	*			trans	-90.6	114.2	162.3	-79.4	177.4	-22.1	0	0	107.7	K1206	K1206-Q1208 PolarHBondContact O-N 3.17Å
1209	E	26.7	Very low	29.3	Very low	188 Å²	188	152 Å²	152	88%	0.879	85%	0.853	S	S	*	*			trans	-126.7	141.4	152.1	-91.6	-170.7	162.9	0	0	108.4
1210	P	30.5	Very low	29.5	Very low	121 Å²	121	155.5 Å²	155.5	79%	0.786	87%	0.865	S	S	*	*			trans	-93.5	157.1	-169.9	36.7	-32.5	0	0	0	113.4
1211	S	32	Very low	29.8	Very low	197 Å²	197	152.1 Å²	152.1	100%	1.378	86%	0.862	S	S	*	*			trans	83.7	0	179	85.1	0	0	0	0	116.8

Retrieved 1,211 of 1,211 residues in 331.8 ms (Link to these results)

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