DDX17_HUMAN Loading...

Probable ATP-dependent RNA helicase DDX17

As an RNA helicase, unwinds RNA and alters RNA structures through ATP binding and hydrolysis. Involved in multiple cellular processes, including pre-mRNA splicing, alternative splicing, ribosomal RNA processing and miRNA processing, as well as transcription regulation. Regulates the alternative splicing of exons exhibiting specific features^1,2,3,4. For instance, promotes the inclusion of AC-rich alternative exons in CD44 transcripts⁵. This function requires the RNA helicase activity^6,7,8,9. Affects NFAT5 and histone macro-H2A.1/MACROH2A1 alternative splicing in a CDK9-dependent manner^10,11. In NFAT5, promotes the introduction of alternative exon 4, which contains 2 stop codons and may target NFAT5 exon 4-containing transcripts to nonsense-mediated mRNA decay, leading to the down-regulation of NFAT5 protein¹². Affects splicing of mediators of steroid hormone signaling pathway, including kinases that phosphorylates ESR1, such as CDK2, MAPK1 and GSK3B, and transcriptional regulators, such as CREBBP, MED1, NCOR1 and NCOR2. By affecting GSK3B splicing, participates in ESR1 and AR stabilization¹³. In myoblasts and epithelial cells, cooperates with HNRNPH1 to control the splicing of specific subsets of exons¹⁴. In addition to binding mature mRNAs, also interacts with certain pri-microRNAs, including MIR663/miR-663a, MIR99B/miR-99b, and MIR6087/miR-6087¹⁵. Binds pri-microRNAs on the 3' segment flanking the stem loop via the 5'-[ACG]CAUC[ACU]-3' consensus sequence¹⁶. Required for the production of subsets of microRNAs, including MIR21 and MIR125B1^17,18. May be involved not only in microRNA primary transcript processing, but also stabilization (By similarity). Participates in MYC down-regulation at high cell density through the production of MYC-targeting microRNAs¹⁹. Along with DDX5, may be involved in the processing of the 32S intermediate into the mature 28S ribosomal RNA²⁰. Promoter-specific transcription regulator, functioning as a coactivator or corepressor depending on the context of the promoter and the transcriptional complex in which it exists²¹. Enhances NFAT5 transcriptional activity²². Synergizes with TP53 in the activation of the MDM2 promoter; this activity requires acetylation on lysine residues^23,24,25. May also coactivate MDM2 transcription through a TP53-independent pathway²⁶. Coactivates MMP7 transcription²⁷. Along with CTNNB1, coactivates MYC, JUN, FOSL1 and cyclin D1/CCND1 transcription²⁸. Alone or in combination with DDX5 and/or SRA1 non-coding RNA, plays a critical role in promoting the assembly of proteins required for the formation of the transcription initiation complex and chromatin remodeling leading to coactivation of MYOD1-dependent transcription. This helicase-independent activity is required for skeletal muscle cells to properly differentiate into myotubes^29,30. During epithelial-to-mesenchymal transition, coregulates SMAD-dependent transcriptional activity, directly controlling key effectors of differentiation, including miRNAs which in turn directly repress its expression³¹. Plays a role in estrogen and testosterone signaling pathway at several levels. Mediates the use of alternative promoters in estrogen-responsive genes and regulates transcription and splicing of a large number of steroid hormone target genes^32,33,34,35. Contrary to splicing regulation activity, transcriptional coregulation of the estrogen receptor ESR1 is helicase-independent^36,37. Plays a role in innate immunity. Specifically restricts bunyavirus infection, including Rift Valley fever virus (RVFV) or La Crosse virus (LACV), but not vesicular stomatitis virus (VSV), in an interferon- and DROSHA-independent manner³⁸. Binds to RVFV RNA, likely via structured viral RNA elements³⁹. Promotes mRNA degradation mediated by the antiviral zinc-finger protein ZC3HAV1, in an ATPase-dependent manner⁴⁰.

AlphaFold DB , UniProt , Accession Q92841, Species HUMAN (Homo sapiens, Human), Gene DDX17, Length 729 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.8	Very low	36.4	Very low	228 Å²	228	141.4 Å²	141.4	100%	1.123	84%	0.841	S	S	*	*				0	119	0	-67.1	-85.5	-162.6	0	0	106.7
2	P	48.1	Very low	36.3	Very low	133 Å²	133	138.8 Å²	138.8	86%	0.864	83%	0.827	S	S	*	*			cis	-97.7	150	7.5	36	-28.3	0	0	0	113.2
3	T	33.8	Very low	36	Very low	126 Å²	126	141.2 Å²	141.2	77%	0.773	83%	0.831	S	S	*	*			trans	-91.3	131.3	175.6	39.8	0	0	0	0	109.6
4	G	41.5	Very low	36	Very low	77 Å²	77	142.1 Å²	142.1	79%	0.794	83%	0.83	S	S	*	*			trans	-116.6	103.7	174	0	0	0	0	0	110.7
5	F	33.7	Very low	35.8	Very low	202 Å²	202	140.5 Å²	140.5	89%	0.886	83%	0.825	S	S	*	*			trans	-59	134.3	175.2	-109.8	-113.1	0	0	0	112.2
6	V	41.8	Very low	35.9	Very low	143 Å²	143	138.9 Å²	138.9	87%	0.867	82%	0.824	S	S	*	*			trans	-114.6	117.6	160.7	-179.9	0	0	0	0	107.3
7	A	35.4	Very low	36.5	Very low	76 Å²	76	138.2 Å²	138.2	63%	0.628	82%	0.824	S	S	*	*			trans	-84.2	151	178.2	0	0	0	0	0	111.3
8	P	34.3	Very low	36.6	Very low	126 Å²	126	138.1 Å²	138.1	82%	0.818	83%	0.825	S	S	*	*			trans	-83.7	136.7	-176.2	33.4	-31.3	0	0	0	111.4	L10	P8-L10 PolarHBondContact O-N 3.35Å
9	I	37.7	Very low	36.9	Very low	167 Å²	167	144.2 Å²	144.2	86%	0.856	83%	0.832	S	S	*	*			trans	-80.4	111.6	169.6	-68.4	175.7	0	0	0	108.6	C11	I9-C11 PolarHBondContact O-N 3.35Å
10	L	29	Very low	36.9	Very low	154 Å²	154	146.3 Å²	146.3	81%	0.806	83%	0.834	S	S	*	*			trans	-68.9	111.4	169.3	-169	78.2	0	0	0	109.2	P8 V12	P8-L10 PolarHBondContact O-N 3.35Å; L10-V12 PolarHBondContact O-N 3.43Å
11	C	34	Very low	36.9	Very low	123 Å²	123	143.6 Å²	143.6	83%	0.831	83%	0.829	S	S	*	*			trans	-87.3	108.7	171.3	-151.1	0	0	0	0	109.1	I9 L13	I9-C11 PolarHBondContact O-N 3.35Å; C11-L13 PolarHBondContact O-N 3.32Å
12	V	35.5	Very low	37.3	Very low	111 Å²	111	137.9 Å²	137.9	67%	0.673	82%	0.818	S	S	*	*			trans	-70.3	122.4	175.8	172.7	0	0	0	0	109.4	L10 L14	L10-V12 PolarHBondContact O-N 3.43Å; V12-L14 PolarHBondContact O-N 3.43Å
13	L	32.6	Very low	36.7	Very low	169 Å²	169	137.6 Å²	137.6	89%	0.885	81%	0.814	S	S	*	*			trans	-59.7	124.1	167.5	-77.8	148.2	0	0	0	110.1	C11	C11-L13 PolarHBondContact O-N 3.32Å
14	L	35.8	Very low	37	Very low	155 Å²	155	138.7 Å²	138.7	81%	0.812	82%	0.82	S	S	*	*			trans	-108.4	138	162.1	-78.9	170.8	0	0	0	109.6	V12	V12-L14 PolarHBondContact O-N 3.43Å
15	P	33.8	Very low	36.8	Very low	118 Å²	118	139 Å²	139	77%	0.766	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-83.5	143.8	-169.3	33.8	-33.4	0	0	0	112.2
16	S	37.2	Very low	37	Very low	114 Å²	114	135.2 Å²	135.2	80%	0.797	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-62.7	138.7	172.5	-43.6	0	0	0	0	112.1
17	P	46.3	Very low	37	Very low	128 Å²	128	132.5 Å²	132.5	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-84.7	129.7	163.6	31.4	-27.8	0	0	0	110.8
18	T	37.1	Very low	37	Very low	136 Å²	136	136 Å²	136	83%	0.834	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-65	146.5	171.7	39.8	0	0	0	0	112.5
19	R	43.4	Very low	37.3	Very low	253 Å²	253	133.9 Å²	133.9	96%	0.955	82%	0.822	S	S	*	*			trans	-141.6	106	154.8	-108.4	-176.1	170.1	-177.8	-3.4	110.6
20	E	36.5	Very low	37.3	Very low	187 Å²	187	133.6 Å²	133.6	87%	0.874	82%	0.822	S	S	*	*			trans	-49.4	165.6	150.8	-75	174.4	137.2	0	0	111
21	A	36.1	Very low	37.8	Very low	89 Å²	89	132.2 Å²	132.2	74%	0.736	83%	0.825	S	S	*	*			cis	-178.7	144.9	-16	0	0	0	0	0	103.8
22	A	40.9	Very low	38	Very low	108 Å²	108	130.8 Å²	130.8	89%	0.893	82%	0.822	S	S	*	*			trans	-162.1	103.8	156.6	0	0	0	0	0	110.4
23	T	34.4	Very low	38.2	Very low	128 Å²	128	130.9 Å²	130.9	79%	0.785	83%	0.828	S	S	*	*			trans	-77	137.6	172.6	-45.1	0	0	0	0	110.5
24	V	41.2	Very low	38.3	Very low	148 Å²	148	131.6 Å²	131.6	90%	0.897	83%	0.827	S	S	*	*			trans	-142.9	128	144.5	-176	0	0	0	0	109.3
25	A	35.6	Very low	38.5	Very low	85 Å²	85	135.3 Å²	135.3	70%	0.702	83%	0.83	S	S	*	*			trans	-94.9	155.4	-177.9	0	0	0	0	0	112.9
26	S	39.7	Very low	38.6	Very low	122 Å²	122	137.3 Å²	137.3	85%	0.853	83%	0.829	S	S	*	*			trans	-179.4	155.2	142.1	58.4	0	0	0	0	108.3
27	A	40	Very low	38.7	Very low	85 Å²	85	137.3 Å²	137.3	70%	0.702	83%	0.829	S	S	*	*			cis	-166.9	130.7	-38.1	0	0	0	0	0	104.9
28	T	36.9	Very low	38.4	Very low	150 Å²	150	135.9 Å²	135.9	92%	0.92	83%	0.828	S	S	*	*			trans	31.4	133.9	145.6	56.8	0	0	0	0	122.6
29	G	40.2	Very low	38.5	Very low	82 Å²	82	133.8 Å²	133.8	85%	0.845	82%	0.824	S	S	*	*			trans	-177.2	94.9	155.7	0	0	0	0	0	113.8
30	D	36.5	Very low	38.8	Very low	161 Å²	161	127.7 Å²	127.7	86%	0.861	82%	0.818	S	S	*	*			trans	-53.7	152.7	173.6	-100.8	-43.4	0	0	0	115.9
31	S	40.6	Very low	39	Very low	124 Å²	124	123.6 Å²	123.6	87%	0.867	82%	0.815	S	S	*	*				169.8	150.4	111.4	44.6	0	0	0	0	114.2
32	A	36.9	Very low	39.1	Very low	93 Å²	93	124.1 Å²	124.1	77%	0.769	82%	0.82	S	S	*	*			trans	-104.1	166.8	-158.7	0	0	0	0	0	115.5
33	S	40.1	Very low	39.2	Very low	114 Å²	114	123.5 Å²	123.5	80%	0.797	82%	0.815	S	S	*	*			trans	161.9	106.7	139.4	43.5	0	0	0	0	108.6
34	E	35.1	Very low	39.6	Very low	184 Å²	184	123 Å²	123	86%	0.86	81%	0.813	S	S	*	*				61.3	117.6	73.9	-79	-162.3	151.6	0	0	117.1
35	R	39.5	Very low	39.3	Very low	232 Å²	232	122.4 Å²	122.4	88%	0.875	81%	0.811	S	S	*	*			trans	133.4	142.6	142	-75.9	-179.3	-178.7	-162.1	-1.3	112.4
36	E	35.8	Very low	39.5	Very low	161 Å²	161	123.4 Å²	123.4	75%	0.752	82%	0.819	S	S	*	*			cis	179	153	-18.5	-165.9	177.7	149.1	0	0	105.7
37	S	40.5	Very low	39.2	Very low	113 Å²	113	127 Å²	127	79%	0.79	82%	0.822	S	S	*	*			trans	75.3	145.5	158.7	80.1	0	0	0	0	118.4
38	A	40.2	Very low	39.4	Very low	98 Å²	98	127 Å²	127	81%	0.81	82%	0.822	S	S	*	*			cis	-168.5	151.6	-13.9	0	0	0	0	0	107.4
39	A	37.7	Very low	39.9	Very low	92 Å²	92	125.3 Å²	125.3	76%	0.76	81%	0.814	S	S	*	*			trans	-81.9	-155.1	-177.4	0	0	0	0	0	112.8
40	P	50.7	Low	40.3	Very low	126 Å²	126	126.6 Å²	126.6	82%	0.818	81%	0.807	S	S	*	*				-130.2	167.5	-51	26.4	-7.1	0	0	0	112.8
41	A	41.1	Very low	41.2	Very low	100 Å²	100	125.3 Å²	125.3	83%	0.826	81%	0.808	S	S	*	*			trans	-172.2	112	151.9	0	0	0	0	0	115.6
42	A	37	Very low	41.2	Very low	101 Å²	101	124.1 Å²	124.1	84%	0.835	80%	0.8	S	S	*	*			trans	27.9	130.2	133.4	0	0	0	0	0	125.2
43	A	42.8	Very low	41	Very low	95 Å²	95	126 Å²	126	79%	0.785	80%	0.801	S	S	*	*			trans	85.8	157.7	130.4	0	0	0	0	0	120.8
44	P	43.4	Very low	40.8	Very low	116 Å²	116	126.2 Å²	126.2	75%	0.753	80%	0.797	S	S	*	*			cis	-129.4	170.5	-22.3	27.5	-5.4	0	0	0	114.7
45	T	35.2	Very low	40.8	Very low	137 Å²	137	124 Å²	124	84%	0.84	80%	0.797	S	S	*	*			trans	-40.1	136.3	164.3	45.8	0	0	0	0	116.2
46	A	39.1	Very low	41	Very low	106 Å²	106	123.6 Å²	123.6	88%	0.876	80%	0.795	S	S	*	*			trans	-127.5	96.7	156.6	0	0	0	0	0	108.7
47	E	33.3	Very low	41.2	Very low	196 Å²	196	121.6 Å²	121.6	92%	0.916	80%	0.796	S	S	*	*			trans	-75.2	114.1	174.6	-167.8	172.9	-175.5	0	0	108.4
48	A	44.4	Very low	41.1	Very low	86 Å²	86	124.8 Å²	124.8	71%	0.711	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-85.3	136	174.9	0	0	0	0	0	109.6
49	P	47.6	Very low	41.5	Very low	114 Å²	114	126.1 Å²	126.1	74%	0.74	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-70.1	148.7	-173.6	29.5	-34.3	0	0	0	111.3
50	P	48.3	Very low	41.6	Very low	109 Å²	109	130.6 Å²	130.6	71%	0.708	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-68.1	140.9	174.1	29.3	-32.8	0	0	0	109.9	S52	P50-S52 PolarHBondContact O-N 3.28Å
51	P	56.7	Low	41	Very low	135 Å²	135	129.4 Å²	129.4	88%	0.877	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-65	121.7	171.2	26.9	-31.5	0	0	0	109
52	S	39.1	Very low	41.1	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-95.3	141	177.2	29.2	0	0	0	0	109.8	P50	P50-S52 PolarHBondContact O-N 3.28Å
53	V	34.3	Very low	41.1	Very low	133 Å²	133	132.9 Å²	132.9	81%	0.806	80%	0.8	S	S	*	*			trans	74.2	119.7	163.8	-155.1	0	0	0	0	113.7
54	V	36	Very low	41.1	Very low	117 Å²	117	133.9 Å²	133.9	71%	0.709	80%	0.802	S	S	*	*				-150.8	112.1	65.9	176.7	0	0	0	0	110.4	R56	V54-R56 HydrophobicContact CG1-CG 4.16Å; V54-R56 PolarHBondContact O-N 3.03Å
55	T	34.8	Very low	40.9	Very low	138 Å²	138	133.3 Å²	133.3	85%	0.847	80%	0.798	S	S	*	*			trans	-64.3	110.4	156.6	33.9	0	0	0	0	108.3
56	R	42	Very low	40.8	Very low	223 Å²	223	132 Å²	132	84%	0.842	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-80.6	141.6	169.6	-80	-174.4	174.6	-170	-0.6	109.6	V54 E58	V54-R56 HydrophobicContact CG1-CG 4.16Å; V54-R56 PolarHBondContact O-N 3.03Å; R56-E58 PolarHBondContact O-N 3.44Å
57	P	40.2	Very low	40.9	Very low	119 Å²	119	134 Å²	134	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-69.6	133.7	-176.8	29	-32.3	0	0	0	110.4	P59	P57-P59 WeakPolarHBondContact O-CD 3.38Å
58	E	38.3	Very low	41	Very low	181 Å²	181	136.6 Å²	136.6	85%	0.846	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-47.6	120.9	165	-128.6	178.7	166.9	0	0	110.3	R56 Q60	R56-E58 PolarHBondContact O-N 3.44Å; E58-Q60 PolarHBondContact O-N 3.45Å
59	P	50	Low	40.9	Very low	126 Å²	126	136.6 Å²	136.6	82%	0.818	80%	0.796	S	S	*	*			trans	-77.4	111.1	163.8	28.6	-26.3	0	0	0	108.1	P57 A61	P57-P59 WeakPolarHBondContact O-CD 3.38Å; P59-A61 PolarHBondContact O-N 2.63Å
60	Q	39.9	Very low	40.6	Very low	185 Å²	185	136.9 Å²	136.9	86%	0.864	80%	0.798	S	S	*	*			trans	-45	124.5	173.4	-66.4	174.8	-9	0	0	111.4	E58 L62	E58-Q60 PolarHBondContact O-N 3.45Å; Q60-L62 PolarHBondContact O-N 2.93Å; Q60-L62 VanDerWaalsContact O-N 3.15Å
61	A	37.6	Very low	40.3	Very low	101 Å²	101	139.5 Å²	139.5	84%	0.835	81%	0.806	S	S	*	*			trans	-62.8	109.7	171.1	0	0	0	0	0	109.8	P59	P59-A61 PolarHBondContact O-N 2.63Å
62	L	43.7	Very low	40	Very low	165 Å²	165	138.9 Å²	138.9	86%	0.864	80%	0.802	S	S	*	*			trans	-81.6	123.9	162.6	-75.5	169.6	0	0	0	108.6	Q60	Q60-L62 PolarHBondContact O-N 2.93Å; Q60-L62 VanDerWaalsContact O-N 3.15Å
63	P	36.5	Very low	40	Very low	109 Å²	109	140.5 Å²	140.5	71%	0.708	80%	0.803	S	S	*	*			trans	-82.9	135.3	170.5	33.4	-28.5	0	0	0	108.5
64	S	42.6	Very low	40.2	Very low	116 Å²	116	141 Å²	141	81%	0.811	80%	0.8	S	S	*	*			trans	157	157.7	151	-75.9	0	0	0	0	111.9
65	P	39.4	Very low	40.6	Very low	105 Å²	105	146.8 Å²	146.8	68%	0.682	81%	0.811	S	S	*	*			cis	-127.1	161.6	-45.1	33	-16.6	0	0	0	110.7	I67	P65-I67 PolarHBondContact O-N 3.09Å; P65-I67 VanDerWaalsContact O-N 3.14Å
66	A	33.2	Very low	40.8	Very low	108 Å²	108	144.8 Å²	144.8	89%	0.893	80%	0.8	S	S	*	*			trans	-57	114.9	170.9	0	0	0	0	0	111.1
67	I	41.7	Very low	40.8	Very low	148 Å²	148	143.3 Å²	143.3	76%	0.759	80%	0.8	S	S	*	*			trans	-122.4	100.1	161.1	-61.6	-178.3	0	0	0	108	P65 A69	P65-I67 PolarHBondContact O-N 3.09Å; P65-I67 VanDerWaalsContact O-N 3.14Å; I67-A69 PolarHBondContact O-N 3.24Å
68	R	34.8	Very low	40.6	Very low	252 Å²	252	141.2 Å²	141.2	95%	0.951	80%	0.8	S	S	*	*			trans	-69.9	106	168	-164.2	179.6	-170.8	-172.4	2.1	107.1
69	A	41.8	Very low	40.7	Very low	85 Å²	85	138.1 Å²	138.1	70%	0.702	79%	0.794	S	S	*	*			trans	-104.2	132.1	167.7	0	0	0	0	0	109.1	I67	I67-A69 PolarHBondContact O-N 3.24Å
70	P	41.1	Very low	40.4	Very low	120 Å²	120	141.7 Å²	141.7	78%	0.779	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-80.3	149.6	-171.6	33.8	-34.5	0	0	0	111.8
71	L	41.7	Very low	40.3	Very low	164 Å²	164	144.4 Å²	144.4	86%	0.859	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-52.6	134.3	161.9	-73.1	155	0	0	0	110
72	P	50.7	Low	40.3	Very low	123 Å²	123	143.7 Å²	143.7	80%	0.799	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-92	130.1	156.4	28.5	-19.7	0	0	0	110.4
73	D	40.1	Very low	40.1	Very low	133 Å²	133	139.7 Å²	139.7	71%	0.711	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-57.4	153.6	177.4	-73.9	-53.4	0	0	0	115.8
74	L	38.9	Very low	40.1	Very low	143 Å²	143	137.6 Å²	137.6	75%	0.749	80%	0.803	S	S	*	*			trans	34.6	113.4	133.9	-67.6	148.1	0	0	0	118.5
75	Y	43.9	Very low	40.2	Very low	239 Å²	239	142.8 Å²	142.8	94%	0.937	81%	0.812	S	S	*	*			trans	-103	118.9	143.6	-74.5	-84.8	0	0	0	109.5
76	P	39.5	Very low	40.2	Very low	95 Å²	95	141.6 Å²	141.6	62%	0.617	82%	0.818	S	S	*	*			trans	-122.9	155.2	150.5	37.6	-25.1	0	0	0	111.2
77	F	40.6	Very low	40.6	Very low	193 Å²	193	143.8 Å²	143.8	85%	0.846	82%	0.815	S	S	*	*			trans	77.1	123.6	165.6	-87.5	-89.2	0	0	0	120.2
78	G	35.9	Very low	40.7	Very low	75 Å²	75	148.2 Å²	148.2	77%	0.773	82%	0.822	S	S	*	*			trans	-162.6	64.1	165	0	0	0	0	0	109.9	M80	G78-M80 PolarHBondContact O-N 3.42Å
79	T	41.5	Very low	41	Very low	116 Å²	116	143.3 Å²	143.3	71%	0.712	82%	0.815	S	S	*	*			trans	-62.4	114.7	168	0	0	0	0	0	109.1
80	M	42.3	Very low	41.2	Very low	200 Å²	200	150 Å²	150	99%	0.985	82%	0.822	S	S	*	*			trans	-89.6	111.6	164.3	-76.9	-148.4	-175	0	0	109.7	G78	G78-M80 PolarHBondContact O-N 3.42Å
81	R	39.5	Very low	41.3	Very low	243 Å²	243	151.3 Å²	151.3	92%	0.917	82%	0.822	S	S	*	*			trans	-126.8	125.7	170.5	-156.3	-174.3	-162.8	-136.1	5.2	107.6
82	G	37.7	Very low	41.4	Very low	85 Å²	85	154.7 Å²	154.7	88%	0.876	82%	0.823	S	S	*	*			trans	72.2	108.7	147.6	0	0	0	0	0	118.4
83	G	38.3	Very low	41	Very low	81 Å²	81	157 Å²	157	84%	0.835	83%	0.829	S	S	*	*			trans	-164.9	89.5	159.6	0	0	0	0	0	109.3
84	G	37.3	Very low	41.2	Very low	65 Å²	65	162.5 Å²	162.5	67%	0.67	84%	0.84	S	S	*	*			trans	-75.5	168.6	172.2	0	0	0	0	0	112.1
85	F	43.7	Very low	41.2	Very low	226 Å²	226	159.6 Å²	159.6	99%	0.991	84%	0.844	S	S	*	*			trans	148.1	121.7	145.5	-80.6	-64.8	0	0	0	109.5
86	G	39.2	Very low	41	Very low	79 Å²	79	151.3 Å²	151.3	81%	0.814	83%	0.832	S	S	*	*			trans	140	64.1	156.8	0	0	0	0	0	116.5
87	D	42.5	Very low	41.1	Very low	154 Å²	154	157.1 Å²	157.1	82%	0.824	85%	0.848	S	S	*	*			trans	-56.9	127.8	153.3	-88.5	-56.6	0	0	0	110.3
88	R	43.7	Very low	41	Very low	241 Å²	241	151.2 Å²	151.2	91%	0.909	84%	0.841	S	S	*	*			trans	-148.4	95.8	149.4	-77.9	-163.4	-173.8	160.6	3.5	109.7
89	D	41.5	Very low	41.3	Very low	150 Å²	150	152.4 Å²	152.4	80%	0.802	84%	0.844	S	S	*	*			trans	-54.2	134.9	146.2	-74.3	-56.4	0	0	0	110
90	R	44.8	Very low	41.2	Very low	226 Å²	226	158.8 Å²	158.8	85%	0.853	86%	0.855	S	S	*	*			trans	-161	102.3	148.8	-108.6	-177.6	-158.8	-177.2	5	110.3
91	D	44.1	Very low	41	Very low	147 Å²	147	153.4 Å²	153.4	79%	0.786	85%	0.851	S	S	*	*				57.7	121.2	128.2	-62.4	-49.6	0	0	0	120.8
92	R	43.3	Very low	41	Very low	234 Å²	234	145.4 Å²	145.4	88%	0.883	84%	0.844	S	S	*	*			trans	-22	132.2	144.5	-72.1	172.1	179.9	166.8	1.6	112.9
93	D	43.6	Very low	40.9	Very low	172 Å²	172	145.1 Å²	145.1	92%	0.92	84%	0.841	S	S	*	*				-153.8	151.4	122.6	-104	-37	0	0	0	113.7
94	R	42.6	Very low	40.8	Very low	249 Å²	249	144.9 Å²	144.9	94%	0.94	84%	0.839	S	S	*	*			trans	-103.3	127.2	-161	-173.5	-172.1	-159.8	176.1	4.4	108.9
95	G	40.6	Very low	41.1	Very low	81 Å²	81	149.7 Å²	149.7	84%	0.835	85%	0.848	S	S	*	*			trans	154.6	124.2	168.7	0	0	0	0	0	109.7
96	G	39.4	Very low	41.2	Very low	66 Å²	66	143.9 Å²	143.9	68%	0.68	83%	0.833	S	S	*	*			cis	115.8	58.2	20.5	0	0	0	0	0	110.6
97	F	41.9	Very low	41.6	Very low	217 Å²	217	146.1 Å²	146.1	95%	0.952	83%	0.833	S	S	*	*			trans	-165.2	130.7	161.4	-84.1	-76.6	0	0	0	105.2
98	G	38.5	Very low	41.7	Very low	69 Å²	69	148 Å²	148	71%	0.711	83%	0.834	S	S	*	*			cis	117.1	100.3	32.6	0	0	0	0	0	108.2
99	A	41.7	Very low	41.7	Very low	100 Å²	100	146.2 Å²	146.2	83%	0.826	83%	0.833	S	S	*	*			trans	65.6	111	156.5	0	0	0	0	0	120.5
100	R	40.3	Very low	42	Very low	249 Å²	249	149 Å²	149	94%	0.94	84%	0.838	S	S	*	*				176.6	122.9	100.3	-101.4	-178.3	171.2	-178.9	-1.9	110.3
101	G	37.7	Very low	42.3	Very low	87 Å²	87	140.1 Å²	140.1	90%	0.897	82%	0.817	S	S	*	*			trans	-68.9	128.2	174.9	0	0	0	0	0	111.9
102	G	38.2	Very low	43.2	Very low	75 Å²	75	138.4 Å²	138.4	77%	0.773	81%	0.808	S	S	*	*			trans	-111.7	114.9	162.2	0	0	0	0	0	108	G104	G102-G104 PolarHBondContact O-N 3.49Å
103	G	36.6	Very low	43.9	Very low	79 Å²	79	131.1 Å²	131.1	81%	0.814	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-59.5	125.1	178.6	0	0	0	0	0	111.3	L105	G103-L105 PolarHBondContact O-N 3.47Å
104	G	36.5	Very low	44.8	Very low	77 Å²	77	123 Å²	123	79%	0.794	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-65.1	119.4	170.2	0	0	0	0	0	110	G102	G102-G104 PolarHBondContact O-N 3.49Å
105	L	41.9	Very low	45.9	Very low	165 Å²	165	117.1 Å²	117.1	86%	0.864	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-55.7	132.2	166.5	-80.6	140.9	0	0	0	108.9	G103	G103-L105 PolarHBondContact O-N 3.47Å
106	P	47.5	Very low	47.1	Very low	105 Å²	105	123.8 Å²	123.8	68%	0.682	73%	0.731	S	S	*	*	P	Polyproline II helix	trans	-59	145.2	170.5	25.6	-31.9	0	0	0	108.7	K108	P106-K108 PolarHBondContact O-N 3.01Å
107	P	47	Very low	48.7	Very low	125 Å²	125	122.2 Å²	122.2	81%	0.812	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-55.7	120.2	178.4	23.1	-31.1	0	0	0	108.1	K109	P107-K109 PolarHBondContact O-N 3.05Å
108	K	45.1	Very low	49.9	Very low	193 Å²	193	122.5 Å²	122.5	84%	0.839	70%	0.702	S	S	*	*			trans	-48	114.9	173.5	-83.2	177.3	173.9	174.2	0	107.3	P106 F110	P106-K108 PolarHBondContact O-N 3.01Å; K108-F110 PolarHBondContact O-N 3.47Å
109	K	43.3	Very low	51.5	Low	205 Å²	205	126.4 Å²	126.4	89%	0.891	70%	0.699	S	S	*	*			trans	-46.9	112.6	164.2	-102	179.5	172.3	179.6	0	105.9	P107 G111	P107-K109 PolarHBondContact O-N 3.05Å; K109-G111 PolarHBondContact O-N 2.92Å
110	F	47.4	Very low	53	Low	207 Å²	207	125.1 Å²	125.1	91%	0.908	68%	0.675	S	S	*	*			trans	-54.7	114.8	166.8	-85.8	-96	0	0	0	105.9	K108	K108-F110 PolarHBondContact O-N 3.47Å
111	G	51.8	Low	54.5	Low	40 Å²	40	123.1 Å²	123.1	41%	0.412	67%	0.673	S	S	.	*	P	Polyproline II helix	trans	-54.3	147.8	170.4	0	0	0	0	0	109.1	K109 E115	K109-G111 PolarHBondContact O-N 2.92Å; G111-E115 WeakPolarHBondContact CA-OE2 3.5Å
112	N	62.2	Low	56.4	Low	112 Å²	112	121.3 Å²	121.3	60%	0.599	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-55	131.6	-179.5	-78.8	-32.5	0	0	0	109.4	G114 E115	N112-G114 PolarHBondContact O-N 3.3Å; N112-E115 HydrophobicContact CB-CG 4.14Å; N112-E115 WeakPolarHBondContact CB-OE1 3.37Å; N112-E115 PolarHBondContact N-OE1 3.48Å; N112-E115 WeakPolarHBondContact O-CB 3.36Å; N112-E115 WeakPolarHBondContact O-CG 3.41Å; N112-E115 PolarHBondContact O-N 3.44Å
113	P	59.1	Low	58.1	Low	81 Å²	81	121.7 Å²	121.7	53%	0.526	62%	0.623	S	S	.	*	T	Hydrogen-bonded Turn	trans	-48.2	126.9	178.3	-27.7	33.6	0	0	0	110.9	I306 K341	P113-I306 HydrophobicContact CB-CG2 4.49Å; P113-K341 PolarHBondContact O-NZ 3.09Å
114	G	61.1	Low	60	Low	2 Å²	2	122.7 Å²	122.7	2%	0.021	61%	0.61	C	S	.	*	T	Hydrogen-bonded Turn	trans	92.4	3.4	-177.2	0	0	0	0	0	115.6	N112 R116 L117 I306 E310	N112-G114 PolarHBondContact O-N 3.3Å; G114-R116 PolarHBondContact O-N 2.94Å; G114-L117 PolarHBondContact O-N 3.25Å; G114-L117 VanDerWaalsContact O-N 3.13Å; G114-I306 VanDerWaalsContact CA-CG2 3.41Å; G114-E310 VanDerWaalsContact CA-CD 3.5Å; G114-E310 WeakPolarHBondContact CA-OE1 3.1Å; G114-E310 PolarHBondContact N-OE1 2.65Å; G114-E310 VanDerWaalsContact N-OE1 3.16Å
115	E	65.9	Low	61.6	Low	125 Å²	125	123.8 Å²	123.8	58%	0.584	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.2	-22.5	175.4	-92.8	175.1	-162.3	0	0	113.8	G111 N112 E310	G111-E115 WeakPolarHBondContact CA-OE2 3.5Å; N112-E115 HydrophobicContact CB-CG 4.14Å; N112-E115 WeakPolarHBondContact CB-OE1 3.37Å; N112-E115 PolarHBondContact N-OE1 3.48Å; N112-E115 WeakPolarHBondContact O-CB 3.36Å; N112-E115 WeakPolarHBondContact O-CG 3.41Å; N112-E115 PolarHBondContact O-N 3.44Å; E115-E310 PolarHBondContact N-OE1 3.11Å
116	R	66.9	Low	63.2	Low	220 Å²	220	123.7 Å²	123.7	83%	0.83	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-13.3	178.3	-62.9	178.6	175.8	173.3	-1.5	113	G114 R118 E310	G114-R116 PolarHBondContact O-N 2.94Å; R116-R118 PolarHBondContact O-N 3.15Å; R116-E310 HydrophobicContact CB-CG 4.42Å; R116-E310 WeakPolarHBondContact CB-OE1 3.27Å; R116-E310 PolarHBondContact N-OE1 3.25Å
117	L	71.6	Confident	64.6	Low	33 Å²	33	119.8 Å²	119.8	17%	0.173	57%	0.574	C	S	.	*			trans	-75.4	105.6	175.8	-70.2	171	0	0	0	109.7	G114 I306 L309 E310	G114-L117 PolarHBondContact O-N 3.25Å; G114-L117 VanDerWaalsContact O-N 3.13Å; L117-I306 HydrophobicContact CD1-CG2 3.93Å; L117-L309 HydrophobicContact CD1-CB 4.31Å; L117-L309 HydrophobicContact CD2-CB 4.1Å; L117-E310 HydrophobicContact CD1-CG 3.95Å; L117-E310 HydrophobicContact CD2-CG 3.91Å; L117-E310 HydrophobicContact CG-CG 3.5Å; L117-E310 VanDerWaalsContact CG-CG 3.5Å
118	R	67.9	Low	66.1	Low	224 Å²	224	118.2 Å²	118.2	85%	0.845	56%	0.563	S	S	*	*	P	Polyproline II helix	trans	-82.4	142.5	169	-64.7	-173.7	179	-168.3	-0.4	109.7	R116 K120 Q345	R116-R118 PolarHBondContact O-N 3.15Å; R118-K120 PolarHBondContact O-N 2.94Å; R118-Q345 PolarHBondContact O-NE2 2.95Å
119	K	71.8	Confident	67.8	Low	151 Å²	151	118.7 Å²	118.7	66%	0.657	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-56.1	124.8	171.8	-175.7	165.3	-174.9	143.5	0	109.6	D344	K119-D344 VanDerWaalsContact CE-OD1 3.32Å; K119-D344 WeakPolarHBondContact CE-OD1 3.47Å; K119-D344 HydrophobicContact CG-CB 4.35Å; K119-D344 IonicContact NZ-OD1 3.59Å; K119-D344 PolarHBondContact NZ-OD1 2.92Å
120	K	74.2	Confident	69.7	Low	73 Å²	73	110.4 Å²	110.4	32%	0.317	53%	0.53	S	S	.	.	P	Polyproline II helix	trans	-81.1	130.5	177.5	-166.8	175.7	175.1	-158.6	0	109	R118 W122	R118-K120 PolarHBondContact O-N 2.94Å; K120-W122 HydrophobicContact CB-CZ2 4.37Å; K120-W122 HydrophobicContact CD-CD2 4.41Å; K120-W122 HydrophobicContact CD-CE3 4.39Å; K120-W122 HydrophobicContact CD-CH2 3.83Å; K120-W122 HydrophobicContact CD-CZ2 3.75Å; K120-W122 HydrophobicContact CD-CZ3 4.14Å; K120-W122 HydrophobicContact CG-CZ2 4.45Å; K120-W122 VanDerWaalsContact NZ-CZ3 3.3Å; K120-W122 PolarHBondContact O-N 3.22Å
121	K	70.7	Confident	71.3	Confident	206 Å²	206	106.2 Å²	106.2	90%	0.896	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-77	120.8	166.6	-69.4	-173.6	179.1	-177.1	0	107.5
122	W	77.6	Confident	72.8	Confident	50 Å²	50	107.5 Å²	107.5	19%	0.189	51%	0.507	C	S	.	.	P	Polyproline II helix	trans	-96.1	120.5	178.7	-66	101	0	0	0	109.4	K120 L127 R317 Q345 I346 R347 P348	K120-W122 HydrophobicContact CB-CZ2 4.37Å; K120-W122 HydrophobicContact CD-CD2 4.41Å; K120-W122 HydrophobicContact CD-CE3 4.39Å; K120-W122 HydrophobicContact CD-CH2 3.83Å; K120-W122 HydrophobicContact CD-CZ2 3.75Å; K120-W122 HydrophobicContact CD-CZ3 4.14Å; K120-W122 HydrophobicContact CG-CZ2 4.45Å; K120-W122 VanDerWaalsContact NZ-CZ3 3.3Å; K120-W122 PolarHBondContact O-N 3.22Å; W122-L127 HydrophobicContact CE3-CD1 3.91Å; W122-L127 HydrophobicContact CE3-CD2 3.87Å; W122-L127 HydrophobicContact CE3-CG 4.34Å; W122-L127 HydrophobicContact CZ3-CD2 3.78Å; W122-R317 HydrophobicContact CH2-CG 4.45Å; W122-Q345 VanDerWaalsContact CZ2-O 3.23Å; W122-Q345 WeakPolarHBondContact CZ2-O 3.44Å; W122-I346 PolarHBondContact NE1-O 2.85Å; W122-R347 HydrophobicContact CE3-CB 4.49Å; W122-P348 HydrophobicContact CB-CG 4.45Å
123	D	74.4	Confident	73.9	Confident	82 Å²	82	106.7 Å²	106.7	44%	0.439	50%	0.503	S	S	.	.			trans	-91.5	112.7	163.2	-163.9	-29.6	0	0	0	108.2	S125 E126 L127	D123-S125 VanDerWaalsContact CG-OG 3.27Å; D123-S125 PolarHBondContact O-N 2.67Å; D123-S125 WeakPolarHBondContact OD1-CB 3.34Å; D123-S125 PolarHBondContact OD1-N 3.42Å; D123-S125 PolarHBondContact OD1-OG 3.16Å; D123-E126 HydrophobicContact CB-CB 4.44Å; D123-E126 HydrophobicContact CB-CG 4.11Å; D123-E126 PolarHBondContact O-N 2.71Å; D123-L127 WeakPolarHBondContact O-CG 3.28Å
124	L	75.4	Confident	75	Confident	101 Å²	101	104 Å²	104	53%	0.529	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-23.2	-179.1	-77.6	155	0	0	0	112.4	P348 D349	L124-P348 HydrophobicContact CD2-CG 4.27Å; L124-D349 HydrophobicContact CD2-CB 4.06Å
125	S	71.2	Confident	76.2	Confident	99 Å²	99	105.4 Å²	105.4	69%	0.692	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-30.3	-178.9	68.4	0	0	0	0	113	D123	D123-S125 VanDerWaalsContact CG-OG 3.27Å; D123-S125 PolarHBondContact O-N 2.67Å; D123-S125 WeakPolarHBondContact OD1-CB 3.34Å; D123-S125 PolarHBondContact OD1-N 3.42Å; D123-S125 PolarHBondContact OD1-OG 3.16Å
126	E	75.9	Confident	77.4	Confident	163 Å²	163	104.3 Å²	104.3	76%	0.762	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.6	-14.8	178.9	-62.4	-173.6	161.7	0	0	113	D123	D123-E126 HydrophobicContact CB-CB 4.44Å; D123-E126 HydrophobicContact CB-CG 4.11Å; D123-E126 PolarHBondContact O-N 2.71Å
127	L	76.4	Confident	78.6	Confident	24 Å²	24	97.1 Å²	97.1	13%	0.126	47%	0.465	C	S	.	.	S	Bend	trans	-78.7	141.7	-175.9	-74.5	169.9	0	0	0	111.6	W122 D123 K129 R347	W122-L127 HydrophobicContact CE3-CD1 3.91Å; W122-L127 HydrophobicContact CE3-CD2 3.87Å; W122-L127 HydrophobicContact CE3-CG 4.34Å; W122-L127 HydrophobicContact CZ3-CD2 3.78Å; D123-L127 WeakPolarHBondContact O-CG 3.28Å; L127-K129 PolarHBondContact O-N 3.45Å; L127-K129 VanDerWaalsContact O-N 3.17Å; L127-R347 HydrophobicContact CD1-CB 4.02Å
128	P	78.9	Confident	79.7	Confident	92 Å²	92	97.8 Å²	97.8	60%	0.597	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-54.8	125.6	169.7	-24.5	33.8	0	0	0	110.1	R347	P128-R347 PolarHBondContact O-NH1 3.14Å; P128-R347 PolarHBondContact O-NH2 2.8Å
129	K	80.4	Confident	80.9	Confident	203 Å²	203	91.7 Å²	91.7	88%	0.883	46%	0.456	S	S	*	.	P	Polyproline II helix	trans	-64.5	141.7	169.9	-67.9	-175.6	-179.7	180	0	108.5	L127	L127-K129 PolarHBondContact O-N 3.45Å; L127-K129 VanDerWaalsContact O-N 3.17Å
130	F	82.8	Confident	82	Confident	31 Å²	31	87.5 Å²	87.5	14%	0.136	44%	0.439	C	S	.	.			trans	-135.6	147.5	174.2	73.9	-78	0	0	0	109.4	K132 H232 T320 D349	F130-K132 HydrophobicContact CD2-CG 4.03Å; F130-K132 HydrophobicContact CE2-CD 4.25Å; F130-K132 HydrophobicContact CE2-CG 3.4Å; F130-K132 VanDerWaalsContact CE2-CG 3.4Å; F130-K132 HydrophobicContact CZ-CD 4.22Å; F130-K132 HydrophobicContact CZ-CG 3.84Å; F130-H232 AromaticContact CE2-CE1 3.97Å; F130-T320 HydrophobicContact CB-CG2 4.45Å; F130-T320 HydrophobicContact CD1-CG2 3.75Å; F130-T320 HydrophobicContact CD2-CG2 3.7Å; F130-T320 HydrophobicContact CE1-CG2 3.73Å; F130-T320 HydrophobicContact CE2-CG2 3.69Å; F130-T320 HydrophobicContact CG-CG2 3.72Å; F130-T320 HydrophobicContact CZ-CG2 3.67Å; F130-D349 WeakPolarHBondContact CE1-OD2 3.33Å; F130-D349 WeakPolarHBondContact CZ-O 3.36Å
131	E	82.2	Confident	83	Confident	118 Å²	118	84 Å²	84	55%	0.551	42%	0.424	S	S	*	.			trans	-78.7	143.4	173.2	-173.7	173.6	-160.3	0	0	109.2	F134 Q236	E131-F134 HydrophobicContact CB-CD1 4.41Å; E131-F134 HydrophobicContact CB-CE1 3.42Å; E131-F134 VanDerWaalsContact CB-CE1 3.42Å; E131-F134 HydrophobicContact CB-CZ 3.78Å; E131-F134 HydrophobicContact CG-CD1 3.82Å; E131-F134 HydrophobicContact CG-CE1 3.3Å; E131-F134 HydrophobicContact CG-CZ 3.98Å; E131-F134 WeakPolarHBondContact O-CE2 3.29Å; E131-F134 WeakPolarHBondContact O-CZ 3.42Å; E131-F134 WeakPolarHBondContact OE2-CE1 3.42Å; E131-Q236 PolarHBondContact O-NE2 3.44Å
132	K	82	Confident	84.1	Confident	68 Å²	68	76.2 Å²	76.2	30%	0.296	40%	0.398	S	S	.	.			trans	-114.5	-37.9	-176.3	-80.6	-171.2	171.7	-160.2	0	113.2	F130 G208 D349 R350	F130-K132 HydrophobicContact CD2-CG 4.03Å; F130-K132 HydrophobicContact CE2-CD 4.25Å; F130-K132 HydrophobicContact CE2-CG 3.4Å; F130-K132 VanDerWaalsContact CE2-CG 3.4Å; F130-K132 HydrophobicContact CZ-CD 4.22Å; F130-K132 HydrophobicContact CZ-CG 3.84Å; K132-G208 WeakPolarHBondContact O-CA 3.38Å; K132-G208 PolarHBondContact O-N 3.37Å; K132-D349 WeakPolarHBondContact CE-O 3.41Å; K132-D349 PolarHBondContact NZ-O 2.85Å; K132-R350 PolarHBondContact NZ-O 3.48Å
133	N	85.7	Confident	84.9	Confident	95 Å²	95	82 Å²	82	51%	0.508	42%	0.42	S	S	.	.			trans	-106.8	100.9	-172.1	-176.2	8.3	0	0	0	109.1	Y135 S207	N133-Y135 PolarHBondContact OD1-N 2.94Å; N133-S207 WeakPolarHBondContact CB-O 3.34Å; N133-S207 WeakPolarHBondContact OD1-CA 3Å
134	F	82.4	Confident	85.8	Confident	25 Å²	25	79.2 Å²	79.2	11%	0.11	41%	0.405	C	S	.	.			trans	-105.9	3	178.6	-48	-74.2	0	0	0	111.7	E131 V136 L206 H232 H235	E131-F134 HydrophobicContact CB-CD1 4.41Å; E131-F134 HydrophobicContact CB-CE1 3.42Å; E131-F134 VanDerWaalsContact CB-CE1 3.42Å; E131-F134 HydrophobicContact CB-CZ 3.78Å; E131-F134 HydrophobicContact CG-CD1 3.82Å; E131-F134 HydrophobicContact CG-CE1 3.3Å; E131-F134 HydrophobicContact CG-CZ 3.98Å; E131-F134 WeakPolarHBondContact O-CE2 3.29Å; E131-F134 WeakPolarHBondContact O-CZ 3.42Å; E131-F134 WeakPolarHBondContact OE2-CE1 3.42Å; F134-V136 PolarHBondContact O-N 3.16Å; F134-L206 PolarHBondContact N-O 2.67Å; F134-H232 AromaticContact CE2-ND1 3.65Å; F134-H235 HydrophobicContact CD1-CB 3.61Å; F134-H235 AromaticContact CD1-CD2 3.53Å; F134-H235 AromaticContact CD1-CG 3.45Å; F134-H235 VanDerWaalsContact CD1-CG 3.45Å; F134-H235 HydrophobicContact CE1-CB 3.13Å; F134-H235 AromaticContact CE1-CD2 3.92Å; F134-H235 AromaticContact CE1-CG 3.57Å; F134-H235 HydrophobicContact CE2-CB 4.22Å; F134-H235 HydrophobicContact CG-CB 4.28Å; F134-H235 AromaticContact CG-CG 3.96Å; F134-H235 HydrophobicContact CZ-CB 3.46Å; F134-H235 VanDerWaalsContact CZ-CB 3.46Å
135	Y	86.5	Confident	86.8	Confident	31 Å²	31	77.5 Å²	77.5	12%	0.122	40%	0.399	C	S	.	.			trans	-79	110.9	-172.1	-177.1	-115.3	0	0	0	110.8	N133 E137 P167 P203 L206	N133-Y135 PolarHBondContact OD1-N 2.94Å; Y135-E137 HydrophobicContact CE1-CB 4Å; Y135-E137 HydrophobicContact CE1-CG 4.31Å; Y135-P167 HydrophobicContact CE1-CB 4.15Å; Y135-P203 HydrophobicContact CD2-CB 4.35Å; Y135-P203 HydrophobicContact CE1-CB 4Å; Y135-P203 HydrophobicContact CE2-CB 3.77Å; Y135-L206 HydrophobicContact CD2-CB 3.98Å; Y135-L206 HydrophobicContact CD2-CD1 4.13Å; Y135-L206 HydrophobicContact CG-CB 4.3Å; Y135-L206 PolarHBondContact N-O 3.44Å
136	V	91.2	Very high	87.8	Confident	102 Å²	102	77.8 Å²	77.8	62%	0.618	40%	0.398	S	S	*	.			trans	-99.2	114.3	167.3	-178.1	0	0	0	0	108	F134 H138 N177	F134-V136 PolarHBondContact O-N 3.16Å; V136-H138 PolarHBondContact O-N 3.5Å; V136-N177 PolarHBondContact O-ND2 3.13Å
137	E	91.7	Very high	88.7	Confident	69 Å²	69	78 Å²	78	32%	0.322	39%	0.393	S	S	.	.			trans	-64.3	125.9	-179	-168.7	174.1	-148.1	0	0	110.7	Y135 V141 A142 K168	Y135-E137 HydrophobicContact CE1-CB 4Å; Y135-E137 HydrophobicContact CE1-CG 4.31Å; E137-V141 HydrophobicContact CG-CB 4.07Å; E137-V141 HydrophobicContact CG-CG1 4.04Å; E137-A142 HydrophobicContact CG-CB 4.04Å; E137-K168 WeakPolarHBondContact OE1-CD 3.37Å; E137-K168 WeakPolarHBondContact OE1-CG 3.46Å
138	H	94.3	Very high	89.6	Confident	46 Å²	46	81 Å²	81	21%	0.213	41%	0.407	C	S	.	.			trans	-66.4	142.5	178.9	-171.7	-96.7	0	0	0	110.6	V136 E140 V141 A142 H174 H175	V136-H138 PolarHBondContact O-N 3.5Å; H138-E140 PolarHBondContact ND1-N 3.37Å; H138-E140 PolarHBondContact O-N 2.66Å; H138-V141 HydrophobicContact CB-CG2 4.37Å; H138-V141 WeakPolarHBondContact O-CA 3.25Å; H138-V141 PolarHBondContact O-N 2.98Å; H138-A142 PolarHBondContact O-N 3.13Å; H138-H174 AromaticContact CE1-CD2 3.98Å; H138-H174 AromaticContact NE2-CD2 3.92Å; H138-H175 HydrophobicContact CB-CB 3.98Å; H138-H175 AromaticContact CE1-CD2 3.69Å; H138-H175 AromaticContact CG-CD2 3.54Å; H138-H175 AromaticContact ND1-CD2 3.2Å; H138-H175 PolarHBondContact ND1-CD2 3.44Å; H138-H175 AromaticContact ND1-NE2 3.69Å
139	P	94.4	Very high	90.3	Very high	96 Å²	96	77 Å²	77	62%	0.623	38%	0.38	S	S	*	.	H	α-helix	trans	-52.9	-34.3	-176.9	-29.8	36	0	0	0	114.6	V141 R143	P139-V141 VanDerWaalsContact C-N 3.31Å; P139-V141 PolarHBondContact O-N 3.22Å; P139-R143 WeakPolarHBondContact O-CG 3.35Å; P139-R143 PolarHBondContact O-N 3.45Å; P139-R143 VanDerWaalsContact O-N 3.08Å
140	E	94.3	Very high	90.9	Very high	63 Å²	63	71.7 Å²	71.7	29%	0.294	36%	0.362	S	S	.	.	H	α-helix	trans	-70.3	-24.6	177.9	-64.4	-172.1	162.4	0	0	114.6	H138 R143 F171 H174 H175	H138-E140 PolarHBondContact ND1-N 3.37Å; H138-E140 PolarHBondContact O-N 2.66Å; E140-R143 VanDerWaalsContact O-CG 3.24Å; E140-R143 WeakPolarHBondContact O-CG 3.12Å; E140-R143 PolarHBondContact O-NE 3.27Å; E140-F171 HydrophobicContact CB-CZ 4Å; E140-H174 IonicContact OE2-NE2 2.65Å; E140-H175 IonicContact OE2-CD2 3.43Å; E140-H175 IonicContact OE2-CE1 2.6Å; E140-H175 IonicContact OE2-NE2 3.57Å; E140-H175 PolarHBondContact OE2-NE2 2.82Å
141	V	94.4	Very high	91.5	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-89.1	-41.3	175.7	-178.5	0	0	0	0	109.2	E137 H138 P139 R143 L144 K168 V170 F171 H175	E137-V141 HydrophobicContact CG-CB 4.07Å; E137-V141 HydrophobicContact CG-CG1 4.04Å; H138-V141 HydrophobicContact CB-CG2 4.37Å; H138-V141 WeakPolarHBondContact O-CA 3.25Å; H138-V141 PolarHBondContact O-N 2.98Å; P139-V141 VanDerWaalsContact C-N 3.31Å; P139-V141 PolarHBondContact O-N 3.22Å; V141-R143 VanDerWaalsContact C-N 3.28Å; V141-R143 PolarHBondContact O-N 3.31Å; V141-L144 WeakPolarHBondContact O-CB 3.17Å; V141-L144 WeakPolarHBondContact O-CG 3.25Å; V141-L144 PolarHBondContact O-N 2.93Å; V141-K168 HydrophobicContact CG1-CB 3.59Å; V141-K168 HydrophobicContact CG1-CD 4.35Å; V141-K168 WeakPolarHBondContact O-CD 3.49Å; V141-K168 PolarHBondContact O-NZ 3.35Å; V141-V170 HydrophobicContact CG2-CG1 4.4Å; V141-F171 HydrophobicContact CG2-CD1 4.39Å; V141-F171 HydrophobicContact CG2-CE1 4.05Å; V141-H175 HydrophobicContact CG2-CB 4.05Å
142	A	94	Very high	92.1	Very high	42 Å²	42	68.9 Å²	68.9	35%	0.347	35%	0.35	S	S	.	.	H	α-helix	trans	-57.7	-38.9	177.1	0	0	0	0	0	112.4	E137 H138 L144 K168	E137-A142 HydrophobicContact CG-CB 4.04Å; H138-A142 PolarHBondContact O-N 3.13Å; A142-L144 VanDerWaalsContact C-N 3.25Å; A142-L144 PolarHBondContact O-N 2.86Å; A142-K168 PolarHBondContact O-NZ 3.12Å
143	R	94.8	Very high	92.7	Very high	171 Å²	171	67.7 Å²	67.7	65%	0.645	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-17.4	177.7	69.6	178.6	178.8	-170.9	-3.7	115	P139 E140 V141 T145	P139-R143 WeakPolarHBondContact O-CG 3.35Å; P139-R143 PolarHBondContact O-N 3.45Å; P139-R143 VanDerWaalsContact O-N 3.08Å; E140-R143 VanDerWaalsContact O-CG 3.24Å; E140-R143 WeakPolarHBondContact O-CG 3.12Å; E140-R143 PolarHBondContact O-NE 3.27Å; V141-R143 VanDerWaalsContact C-N 3.28Å; V141-R143 PolarHBondContact O-N 3.31Å; R143-T145 PolarHBondContact O-N 2.57Å
144	L	93.9	Very high	93.1	Very high	25 Å²	25	71.1 Å²	71.1	13%	0.131	35%	0.349	C	S	.	.			trans	-66.6	126.4	-177.4	-62.6	175.9	0	0	0	110.3	V141 A142 E148 V149 L152 K168 F171	V141-L144 WeakPolarHBondContact O-CB 3.17Å; V141-L144 WeakPolarHBondContact O-CG 3.25Å; V141-L144 PolarHBondContact O-N 2.93Å; A142-L144 VanDerWaalsContact C-N 3.25Å; A142-L144 PolarHBondContact O-N 2.86Å; L144-E148 WeakPolarHBondContact CA-OE2 3.46Å; L144-E148 HydrophobicContact CB-CB 4.45Å; L144-E148 HydrophobicContact CD2-CB 4.22Å; L144-V149 HydrophobicContact CB-CG2 3.85Å; L144-V149 HydrophobicContact CD1-CG2 4.45Å; L144-L152 HydrophobicContact CD1-CD2 4.28Å; L144-K168 HydrophobicContact CB-CD 4.43Å; L144-K168 PolarHBondContact O-NZ 3.48Å; L144-F171 HydrophobicContact CD1-CD1 4.34Å; L144-F171 HydrophobicContact CD1-CE1 4.03Å
145	T	95.2	Very high	93.7	Very high	65 Å²	65	78.6 Å²	78.6	40%	0.399	38%	0.382	S	S	.	.			trans	-68.7	158	171.6	62.7	0	0	0	0	110.6	R143 Y147 E148 V149	R143-T145 PolarHBondContact O-N 2.57Å; T145-Y147 PolarHBondContact O-N 2.98Å; T145-E148 PolarHBondContact N-OE2 3.25Å; T145-E148 PolarHBondContact O-N 2.83Å; T145-E148 VanDerWaalsContact O-N 3.1Å; T145-E148 VanDerWaalsContact OG1-CG 3.28Å; T145-E148 WeakPolarHBondContact OG1-CG 3.37Å; T145-E148 PolarHBondContact OG1-N 3.17Å; T145-E148 PolarHBondContact OG1-OE2 3.23Å; T145-V149 WeakPolarHBondContact O-CG2 3.48Å; T145-V149 PolarHBondContact O-N 3.09Å
146	P	92.6	Very high	94	Very high	105 Å²	105	78.3 Å²	78.3	68%	0.682	38%	0.381	S	S	*	.	H	α-helix	trans	-53.5	-37.7	175.8	-27.7	35.8	0	0	0	113.3	V149 D150	P146-V149 PolarHBondContact O-N 3.49Å; P146-D150 PolarHBondContact O-N 3.48Å
147	Y	94.3	Very high	94.1	Very high	166 Å²	166	79.1 Å²	79.1	65%	0.651	38%	0.378	S	S	*	.	H	α-helix	trans	-63.2	-46.4	176.1	177.8	-96.8	0	0	0	112.4	T145 V149 D150 E151	T145-Y147 PolarHBondContact O-N 2.98Å; Y147-V149 VanDerWaalsContact C-N 3.29Å; Y147-V149 PolarHBondContact O-N 3.18Å; Y147-D150 PolarHBondContact O-N 2.66Å; Y147-E151 HydrophobicContact CD1-CG 4.29Å; Y147-E151 HydrophobicContact CE1-CG 3.82Å; Y147-E151 HydrophobicContact CE2-CG 4.36Å; Y147-E151 WeakPolarHBondContact O-CB 3.12Å; Y147-E151 WeakPolarHBondContact O-CG 3.36Å; Y147-E151 PolarHBondContact O-N 3.07Å
148	E	95.1	Very high	94.3	Very high	89 Å²	89	76.3 Å²	76.3	42%	0.416	37%	0.365	S	S	.	.	H	α-helix	trans	-65.6	-33.6	177.7	-69.9	165.4	140.3	0	0	112.2	L144 T145 L152	L144-E148 WeakPolarHBondContact CA-OE2 3.46Å; L144-E148 HydrophobicContact CB-CB 4.45Å; L144-E148 HydrophobicContact CD2-CB 4.22Å; T145-E148 PolarHBondContact N-OE2 3.25Å; T145-E148 PolarHBondContact O-N 2.83Å; T145-E148 VanDerWaalsContact O-N 3.1Å; T145-E148 VanDerWaalsContact OG1-CG 3.28Å; T145-E148 WeakPolarHBondContact OG1-CG 3.37Å; T145-E148 PolarHBondContact OG1-N 3.17Å; T145-E148 PolarHBondContact OG1-OE2 3.23Å; E148-L152 VanDerWaalsContact O-CB 3.3Å; E148-L152 WeakPolarHBondContact O-CB 3.26Å; E148-L152 PolarHBondContact O-N 3.17Å
149	V	94.4	Very high	94.2	Very high	6 Å²	6	76.9 Å²	76.9	4%	0.036	37%	0.372	C	S	.	.	H	α-helix	trans	-63.9	-45.6	173.7	170.7	0	0	0	0	110.8	L144 T145 P146 Y147 L152 R153 K168 P169	L144-V149 HydrophobicContact CB-CG2 3.85Å; L144-V149 HydrophobicContact CD1-CG2 4.45Å; T145-V149 WeakPolarHBondContact O-CG2 3.48Å; T145-V149 PolarHBondContact O-N 3.09Å; P146-V149 PolarHBondContact O-N 3.49Å; Y147-V149 VanDerWaalsContact C-N 3.29Å; Y147-V149 PolarHBondContact O-N 3.18Å; V149-L152 PolarHBondContact O-N 3.21Å; V149-R153 WeakPolarHBondContact O-CB 3.31Å; V149-R153 WeakPolarHBondContact O-CG 3.17Å; V149-R153 PolarHBondContact O-N 3.46Å; V149-K168 HydrophobicContact CG2-CB 4.24Å; V149-K168 HydrophobicContact CG2-CD 3.71Å; V149-K168 HydrophobicContact CG2-CG 3.89Å; V149-P169 HydrophobicContact CG1-CG 4.48Å
150	D	93.6	Very high	94.2	Very high	92 Å²	92	73.8 Å²	73.8	49%	0.492	35%	0.351	S	S	.	.	H	α-helix	trans	-68.1	-36.8	179.2	-71	-18.6	0	0	0	111.6	P146 Y147 R153 R154	P146-D150 PolarHBondContact O-N 3.48Å; Y147-D150 PolarHBondContact O-N 2.66Å; D150-R153 PolarHBondContact O-N 3.06Å; D150-R153 IonicContact OD1-NH1 3.6Å; D150-R153 PolarHBondContact OD1-NH1 3.42Å; D150-R154 VanDerWaalsContact O-CB 3.3Å; D150-R154 WeakPolarHBondContact O-CB 3.4Å; D150-R154 PolarHBondContact O-N 2.74Å
151	E	95.1	Very high	94	Very high	62 Å²	62	76.2 Å²	76.2	29%	0.29	36%	0.358	S	S	.	.	H	α-helix	trans	-64.3	-42	171.6	-78.9	-65.5	117.9	0	0	112.6	Y147 R154 K155	Y147-E151 HydrophobicContact CD1-CG 4.29Å; Y147-E151 HydrophobicContact CE1-CG 3.82Å; Y147-E151 HydrophobicContact CE2-CG 4.36Å; Y147-E151 WeakPolarHBondContact O-CB 3.12Å; Y147-E151 WeakPolarHBondContact O-CG 3.36Å; Y147-E151 PolarHBondContact O-N 3.07Å; E151-R154 PolarHBondContact O-N 3.08Å; E151-R154 IonicContact OE1-CZ 3.04Å; E151-R154 IonicContact OE1-NE 2.97Å; E151-R154 PolarHBondContact OE1-NE 2.92Å; E151-R154 IonicContact OE1-NH2 2.6Å; E151-R154 PolarHBondContact OE1-NH2 2.89Å; E151-R154 IonicContact OE2-CZ 3.19Å; E151-R154 IonicContact OE2-NE 3.06Å; E151-R154 IonicContact OE2-NH2 3.21Å; E151-R154 PolarHBondContact OE2-NH2 3.39Å; E151-K155 WeakPolarHBondContact O-CB 3.46Å; E151-K155 PolarHBondContact O-N 3.02Å
152	L	94.4	Very high	93.3	Very high	29 Å²	29	79.7 Å²	79.7	15%	0.152	39%	0.393	C	S	.	.	H	α-helix	trans	-64.4	-42	175.6	179.4	58.6	0	0	0	111.4	L144 E148 V149 K155 K156 P169 F171	L144-L152 HydrophobicContact CD1-CD2 4.28Å; E148-L152 VanDerWaalsContact O-CB 3.3Å; E148-L152 WeakPolarHBondContact O-CB 3.26Å; E148-L152 PolarHBondContact O-N 3.17Å; V149-L152 PolarHBondContact O-N 3.21Å; L152-K155 PolarHBondContact O-N 3.28Å; L152-K156 HydrophobicContact CD1-CD 4.19Å; L152-K156 PolarHBondContact O-N 2.81Å; L152-K156 VanDerWaalsContact O-N 3.09Å; L152-P169 HydrophobicContact CD2-CG 3.89Å; L152-P169 HydrophobicContact CG-CG 4.26Å; L152-F171 HydrophobicContact CD1-CB 4.46Å; L152-F171 HydrophobicContact CD2-CB 4.2Å; L152-F171 HydrophobicContact CD2-CD1 4.09Å
153	R	95	Very high	92.7	Very high	42 Å²	42	81.6 Å²	81.6	16%	0.158	42%	0.417	C	S	.	.	H	α-helix	trans	-61.3	-47.5	173.3	-77.5	176.8	178.4	150.1	-1.3	111.1	V149 D150 K155 K156 E157 I158 P169	V149-R153 WeakPolarHBondContact O-CB 3.31Å; V149-R153 WeakPolarHBondContact O-CG 3.17Å; V149-R153 PolarHBondContact O-N 3.46Å; D150-R153 PolarHBondContact O-N 3.06Å; D150-R153 IonicContact OD1-NH1 3.6Å; D150-R153 PolarHBondContact OD1-NH1 3.42Å; R153-K155 PolarHBondContact O-N 3.45Å; R153-K156 CarbonylContact O-C 3.52Å; R153-K156 PolarHBondContact O-N 3.09Å; R153-E157 PolarHBondContact O-N 3.02Å; R153-I158 HydrophobicContact CB-CB 4.2Å; R153-I158 HydrophobicContact CG-CB 4.2Å; R153-I158 HydrophobicContact CG-CG2 4.23Å; R153-I158 PolarHBondContact O-N 3.09Å; R153-P169 HydrophobicContact CG-CG 4.17Å
154	R	93.9	Very high	92.1	Very high	168 Å²	168	75.4 Å²	75.4	63%	0.634	40%	0.397	S	S	*	.	H	α-helix	trans	-59	-46	176.8	-175	172.9	68.6	96.4	-8.8	111.9	D150 E151 K156 E157	D150-R154 VanDerWaalsContact O-CB 3.3Å; D150-R154 WeakPolarHBondContact O-CB 3.4Å; D150-R154 PolarHBondContact O-N 2.74Å; E151-R154 PolarHBondContact O-N 3.08Å; E151-R154 IonicContact OE1-CZ 3.04Å; E151-R154 IonicContact OE1-NE 2.97Å; E151-R154 PolarHBondContact OE1-NE 2.92Å; E151-R154 IonicContact OE1-NH2 2.6Å; E151-R154 PolarHBondContact OE1-NH2 2.89Å; E151-R154 IonicContact OE2-CZ 3.19Å; E151-R154 IonicContact OE2-NE 3.06Å; E151-R154 IonicContact OE2-NH2 3.21Å; E151-R154 PolarHBondContact OE2-NH2 3.39Å; R154-K156 VanDerWaalsContact C-N 3.29Å; R154-K156 PolarHBondContact O-N 3.18Å; R154-E157 PolarHBondContact O-N 3.3Å; R154-E157 VanDerWaalsContact O-N 3.16Å
155	K	94.8	Very high	91.8	Very high	182 Å²	182	78.8 Å²	78.8	79%	0.791	42%	0.418	S	S	*	.	H	α-helix	trans	-61.9	-35.4	178.5	-177	-179.6	177	-174.9	0	112.9	E151 L152 R153	E151-K155 WeakPolarHBondContact O-CB 3.46Å; E151-K155 PolarHBondContact O-N 3.02Å; L152-K155 PolarHBondContact O-N 3.28Å; R153-K155 PolarHBondContact O-N 3.45Å
156	K	93.4	Very high	91.5	Very high	25 Å²	25	77 Å²	77	11%	0.109	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	8.1	178.7	-73	-177	177.7	-82.6	0	113.1	L152 R153 R154 I158 E193 P196 C199	L152-K156 HydrophobicContact CD1-CD 4.19Å; L152-K156 PolarHBondContact O-N 2.81Å; L152-K156 VanDerWaalsContact O-N 3.09Å; R153-K156 CarbonylContact O-C 3.52Å; R153-K156 PolarHBondContact O-N 3.09Å; R154-K156 VanDerWaalsContact C-N 3.29Å; R154-K156 PolarHBondContact O-N 3.18Å; K156-I158 HydrophobicContact CB-CD1 3.59Å; K156-I158 HydrophobicContact CB-CG1 3.92Å; K156-I158 HydrophobicContact CD-CD1 4.18Å; K156-I158 PolarHBondContact O-N 2.75Å; K156-E193 IonicContact NZ-OE1 2.81Å; K156-E193 PolarHBondContact NZ-OE1 3.33Å; K156-P196 HydrophobicContact CB-CB 4.06Å; K156-P196 HydrophobicContact CB-CG 4.24Å; K156-P196 WeakPolarHBondContact O-CB 3.4Å; K156-C199 HydrophobicContact CD-CB 4.07Å; K156-C199 WeakPolarHBondContact CE-SG 3.11Å; K156-C199 PolarHBondContact NZ-SG 2.84Å; K156-C199 VanDerWaalsContact NZ-SG 3.36Å
157	E	93.4	Very high	91.6	Very high	119 Å²	119	73.2 Å²	73.2	56%	0.556	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.6	34.4	-178.2	-55.8	178.1	177.3	0	0	113.7	R153 R154 V379 G380	R153-E157 PolarHBondContact O-N 3.02Å; R154-E157 PolarHBondContact O-N 3.3Å; R154-E157 VanDerWaalsContact O-N 3.16Å; E157-V379 CarbonylContact O-C 3.58Å; E157-V379 WeakPolarHBondContact O-CA 3.3Å; E157-G380 PolarHBondContact O-N 2.93Å
158	I	94.5	Very high	91.6	Very high	9 Å²	9	67.9 Å²	67.9	5%	0.046	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	123.6	179.7	-60.8	160.6	0	0	0	109	R153 K156 V160 P196 C199 Q200 N378 V379	R153-I158 HydrophobicContact CB-CB 4.2Å; R153-I158 HydrophobicContact CG-CB 4.2Å; R153-I158 HydrophobicContact CG-CG2 4.23Å; R153-I158 PolarHBondContact O-N 3.09Å; K156-I158 HydrophobicContact CB-CD1 3.59Å; K156-I158 HydrophobicContact CB-CG1 3.92Å; K156-I158 HydrophobicContact CD-CD1 4.18Å; K156-I158 PolarHBondContact O-N 2.75Å; I158-V160 HydrophobicContact CG2-CG2 4.46Å; I158-P196 HydrophobicContact CD1-CB 4.49Å; I158-P196 WeakPolarHBondContact CD1-O 3.27Å; I158-P196 HydrophobicContact CG1-CB 4.29Å; I158-C199 HydrophobicContact CD1-CB 4.31Å; I158-Q200 HydrophobicContact CD1-CB 4.17Å; I158-Q200 HydrophobicContact CG2-CB 3.89Å; I158-Q200 HydrophobicContact CG2-CG 3.88Å; I158-N378 CarbonylContact C-O 3.59Å; I158-N378 WeakPolarHBondContact CA-O 3.43Å; I158-V379 HydrophobicContact CG1-CG2 4.21Å
159	T	93.7	Very high	91.6	Very high	59 Å²	59	63.6 Å²	63.6	36%	0.362	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	128.4	170.1	-56.4	0	0	0	0	109.4	I377 N378 L382	T159-I377 WeakPolarHBondContact O-CA 3.33Å; T159-N378 PolarHBondContact N-O 3.21Å; T159-N378 PolarHBondContact O-N 3.44Å; T159-L382 HydrophobicContact CG2-CD2 4.1Å
160	V	93.9	Very high	91.7	Very high	30 Å²	30	63.4 Å²	63.4	18%	0.182	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.1	171	-178	0	0	0	0	107.6	I158 G162 C166 Q200 T375 I377	I158-V160 HydrophobicContact CG2-CG2 4.46Å; V160-G162 PolarHBondContact O-N 2.69Å; V160-C166 HydrophobicContact CG1-CB 3.68Å; V160-Q200 HydrophobicContact CG2-CG 4.42Å; V160-T375 HydrophobicContact CG1-CG2 4.19Å; V160-I377 HydrophobicContact CG2-CG2 4.34Å
161	R	89.8	Confident	91.7	Very high	114 Å²	114	61.7 Å²	61.7	43%	0.43	33%	0.331	S	S	.	.			trans	-60.8	127.9	177.5	179	-175.8	-176.6	-178.7	0.4	109.9	G163 D164 Y374 Q376	R161-G163 PolarHBondContact O-N 3.14Å; R161-D164 WeakPolarHBondContact CB-OD2 3.45Å; R161-D164 PolarHBondContact O-N 2.93Å; R161-Y374 PolarHBondContact NH1-OH 3.43Å; R161-Q376 HydrophobicContact CB-CB 3.96Å; R161-Q376 PolarHBondContact N-O 2.81Å
162	G	79.6	Confident	91.7	Very high	73 Å²	73	59.7 Å²	59.7	75%	0.753	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	132.2	-176	0	0	0	0	0	112.4	V160	V160-G162 PolarHBondContact O-N 2.69Å
163	G	80.5	Confident	91.6	Very high	82 Å²	82	59 Å²	59	85%	0.845	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	99.1	-17.1	-178.7	0	0	0	0	0	114.5	R161	R161-G163 PolarHBondContact O-N 3.14Å
164	D	82.4	Confident	91.5	Very high	42 Å²	42	61.4 Å²	61.4	23%	0.225	33%	0.333	C	S	.	.			trans	-78.7	136.4	-179.3	-62.8	-8.4	0	0	0	110.9	R161 C166 T375 Q376	R161-D164 WeakPolarHBondContact CB-OD2 3.45Å; R161-D164 PolarHBondContact O-N 2.93Å; D164-C166 PolarHBondContact O-N 2.96Å; D164-T375 HydrophobicContact CB-CG2 3.73Å; D164-T375 WeakPolarHBondContact OD2-CA 3.29Å; D164-Q376 PolarHBondContact OD2-N 3.44Å
165	V	87.7	Confident	91.4	Very high	95 Å²	95	53.4 Å²	53.4	58%	0.576	30%	0.303	S	S	*	.			trans	-72.3	118.4	172.2	-177.3	0	0	0	0	108.1	R209 T375	V165-R209 VanDerWaalsContact CB-CZ 3.48Å; V165-R209 PolarHBondContact O-NH1 2.84Å; V165-R209 VanDerWaalsContact O-NH1 3.13Å; V165-T375 PolarHBondContact O-OG1 2.57Å
166	C	90.5	Very high	91.2	Very high	27 Å²	27	44.8 Å²	44.8	18%	0.182	27%	0.266	C	S	.	.			trans	-138.3	127.5	-174.3	-168.2	0	0	0	0	110.2	V160 D164 Q200 T375	V160-C166 HydrophobicContact CG1-CB 3.68Å; D164-C166 PolarHBondContact O-N 2.96Å; C166-Q200 PolarHBondContact SG-NE2 3.18Å; C166-T375 HydrophobicContact CB-CG2 4.01Å
167	P	93	Very high	90.8	Very high	27 Å²	27	47 Å²	47	18%	0.175	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-66.3	162	174.8	28.6	-32.7	0	0	0	111.1	Y135 Q200 P203 L204	Y135-P167 HydrophobicContact CE1-CB 4.15Å; P167-Q200 PolarHBondContact O-NE2 2.98Å; P167-P203 HydrophobicContact CB-CB 4.08Å; P167-P203 VanDerWaalsContact CG-C 3.48Å; P167-P203 HydrophobicContact CG-CB 3.82Å; P167-P203 HydrophobicContact CG-CG 4.33Å; P167-L204 HydrophobicContact CG-CB 4.26Å
168	K	95	Very high	90.6	Very high	53 Å²	53	42.2 Å²	42.2	23%	0.23	26%	0.256	C	S	.	.	P	Polyproline II helix	trans	-64.1	144.5	176.2	-58	-175.2	-160.9	178.2	0	109.9	E137 V141 A142 L144 V149 P203	E137-K168 WeakPolarHBondContact OE1-CD 3.37Å; E137-K168 WeakPolarHBondContact OE1-CG 3.46Å; V141-K168 HydrophobicContact CG1-CB 3.59Å; V141-K168 HydrophobicContact CG1-CD 4.35Å; V141-K168 WeakPolarHBondContact O-CD 3.49Å; V141-K168 PolarHBondContact O-NZ 3.35Å; A142-K168 PolarHBondContact O-NZ 3.12Å; L144-K168 HydrophobicContact CB-CD 4.43Å; L144-K168 PolarHBondContact O-NZ 3.48Å; V149-K168 HydrophobicContact CG2-CB 4.24Å; V149-K168 HydrophobicContact CG2-CD 3.71Å; V149-K168 HydrophobicContact CG2-CG 3.89Å; K168-P203 WeakPolarHBondContact O-CG 3.21Å
169	P	95.2	Very high	90.3	Very high	0 Å²	0	43.2 Å²	43.2	0%	0	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-69.4	138.3	177.4	28.6	-32.7	0	0	0	110.7	V149 L152 R153 C199 Q200	V149-P169 HydrophobicContact CG1-CG 4.48Å; L152-P169 HydrophobicContact CD2-CG 3.89Å; L152-P169 HydrophobicContact CG-CG 4.26Å; R153-P169 HydrophobicContact CG-CG 4.17Å; P169-C199 CarbonylContact C-O 3.58Å; P169-C199 WeakPolarHBondContact CA-O 3.19Å; P169-Q200 HydrophobicContact CB-CB 4.4Å
170	V	95.6	Very high	90.2	Very high	1 Å²	1	46.4 Å²	46.4	1%	0.006	27%	0.274	C	S	.	.	P	Polyproline II helix	trans	-77.9	150.1	168.3	-60.1	0	0	0	0	110.1	V141 H175 C199 F202 P203	V141-V170 HydrophobicContact CG2-CG1 4.4Å; V170-H175 HydrophobicContact CB-CB 3.76Å; V170-H175 HydrophobicContact CG1-CB 3.64Å; V170-C199 WeakPolarHBondContact CG2-O 3.46Å; V170-C199 PolarHBondContact N-O 3.11Å; V170-C199 VanDerWaalsContact O-CA 3.23Å; V170-C199 WeakPolarHBondContact O-CA 3.36Å; V170-C199 WeakPolarHBondContact O-CB 3.28Å; V170-C199 PolarHBondContact O-SG 3.3Å; V170-F202 HydrophobicContact CG2-CB 4.39Å; V170-F202 HydrophobicContact CG2-CD2 4.24Å; V170-P203 HydrophobicContact CG1-CB 4.31Å; V170-P203 HydrophobicContact CG1-CG 4.19Å
171	F	94.2	Very high	90	Very high	57 Å²	57	47.2 Å²	47.2	25%	0.25	28%	0.275	C	S	.	.			trans	-121.7	-1.7	178.6	56.6	-88.1	0	0	0	113.4	E140 V141 L144 L152 H175	E140-F171 HydrophobicContact CB-CZ 4Å; V141-F171 HydrophobicContact CG2-CD1 4.39Å; V141-F171 HydrophobicContact CG2-CE1 4.05Å; L144-F171 HydrophobicContact CD1-CD1 4.34Å; L144-F171 HydrophobicContact CD1-CE1 4.03Å; L152-F171 HydrophobicContact CD1-CB 4.46Å; L152-F171 HydrophobicContact CD2-CB 4.2Å; L152-F171 HydrophobicContact CD2-CD1 4.09Å; F171-H175 AromaticContact CD1-CE1 3.77Å; F171-H175 AromaticContact CD1-ND1 3.93Å; F171-H175 AromaticContact CD2-CE1 3.59Å; F171-H175 AromaticContact CE1-CE1 3.55Å; F171-H175 AromaticContact CE2-CE1 3.39Å; F171-H175 WeakPolarHBondContact CE2-CE1 3.43Å; F171-H175 AromaticContact CG-CE1 3.79Å; F171-H175 AromaticContact CZ-CE1 3.36Å; F171-H175 WeakPolarHBondContact CZ-CE1 3.18Å; F171-H175 PolarHBondContact N-ND1 3.33Å
172	A	94.6	Very high	90.1	Very high	19 Å²	19	41.8 Å²	41.8	16%	0.157	25%	0.254	C	S	.	.	S	Bend	trans	-141.6	154	171.4	0	0	0	0	0	111.2	H174 H175	A172-H174 VanDerWaalsContact C-N 3.29Å; A172-H174 WeakPolarHBondContact CB-CE1 3.47Å; A172-H174 WeakPolarHBondContact CB-ND1 3.35Å; A172-H174 PolarHBondContact O-N 3.21Å; A172-H175 PolarHBondContact N-ND1 3.37Å; A172-H175 WeakPolarHBondContact O-CB 3.36Å; A172-H175 PolarHBondContact O-N 3.07Å
173	F	93.6	Very high	90.6	Very high	14 Å²	14	39.3 Å²	39.3	6%	0.061	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-60.8	-35.4	-177.5	-73.5	-66.1	0	0	0	113.7	H175 A176 M183 L186 F191 P194 F202	F173-H175 PolarHBondContact O-N 3Å; F173-A176 PolarHBondContact O-N 3.48Å; F173-M183 HydrophobicContact CB-CE 3.81Å; F173-M183 HydrophobicContact CB-SD 4.06Å; F173-L186 HydrophobicContact CB-CD1 4.32Å; F173-L186 HydrophobicContact CD1-CD1 3.77Å; F173-L186 HydrophobicContact CE1-CD1 4.22Å; F173-L186 HydrophobicContact CE1-CD2 4.3Å; F173-L186 HydrophobicContact CG-CD1 4.04Å; F173-F191 HydrophobicContact CE2-CB 3.95Å; F173-F191 WeakPolarHBondContact CE2-O 3.02Å; F173-F191 HydrophobicContact CZ-CB 4.05Å; F173-P194 HydrophobicContact CD1-CB 4.21Å; F173-P194 HydrophobicContact CE1-CB 3.86Å; F173-P194 HydrophobicContact CZ-CB 4.16Å; F173-F202 HydrophobicContact CD1-CE2 4.15Å; F173-F202 HydrophobicContact CE1-CE2 4.12Å; F173-F202 HydrophobicContact CE1-CZ 4.5Å
174	H	93.1	Very high	91.2	Very high	93 Å²	93	38.8 Å²	38.8	43%	0.431	20%	0.201	S	C	.	.	G	3₁₀ helix	trans	-68.1	-17	-179	63.2	-91.9	0	0	0	113.4	H138 E140 A172 A176 M183	H138-H174 AromaticContact CE1-CD2 3.98Å; H138-H174 AromaticContact NE2-CD2 3.92Å; E140-H174 IonicContact OE2-NE2 2.65Å; A172-H174 VanDerWaalsContact C-N 3.29Å; A172-H174 WeakPolarHBondContact CB-CE1 3.47Å; A172-H174 WeakPolarHBondContact CB-ND1 3.35Å; A172-H174 PolarHBondContact O-N 3.21Å; H174-A176 VanDerWaalsContact C-N 3.26Å; H174-A176 PolarHBondContact O-N 2.89Å; H174-M183 HydrophobicContact CB-CE 4.15Å
175	H	92	Very high	91.7	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	20%	0.195	C	C	.	.	G	3₁₀ helix	trans	-73.5	-16.9	175.6	-58.1	157.5	0	0	0	113.8	H138 E140 V141 V170 F171 A172 F173 N177	H138-H175 HydrophobicContact CB-CB 3.98Å; H138-H175 AromaticContact CE1-CD2 3.69Å; H138-H175 AromaticContact CG-CD2 3.54Å; H138-H175 AromaticContact ND1-CD2 3.2Å; H138-H175 PolarHBondContact ND1-CD2 3.44Å; H138-H175 AromaticContact ND1-NE2 3.69Å; E140-H175 IonicContact OE2-CD2 3.43Å; E140-H175 IonicContact OE2-CE1 2.6Å; E140-H175 IonicContact OE2-NE2 3.57Å; E140-H175 PolarHBondContact OE2-NE2 2.82Å; V141-H175 HydrophobicContact CG2-CB 4.05Å; V170-H175 HydrophobicContact CB-CB 3.76Å; V170-H175 HydrophobicContact CG1-CB 3.64Å; F171-H175 AromaticContact CD1-CE1 3.77Å; F171-H175 AromaticContact CD1-ND1 3.93Å; F171-H175 AromaticContact CD2-CE1 3.59Å; F171-H175 AromaticContact CE1-CE1 3.55Å; F171-H175 AromaticContact CE2-CE1 3.39Å; F171-H175 WeakPolarHBondContact CE2-CE1 3.43Å; F171-H175 AromaticContact CG-CE1 3.79Å; F171-H175 AromaticContact CZ-CE1 3.36Å; F171-H175 WeakPolarHBondContact CZ-CE1 3.18Å; F171-H175 PolarHBondContact N-ND1 3.33Å; A172-H175 PolarHBondContact N-ND1 3.37Å; A172-H175 WeakPolarHBondContact O-CB 3.36Å; A172-H175 PolarHBondContact O-N 3.07Å; F173-H175 PolarHBondContact O-N 3Å; H175-N177 VanDerWaalsContact C-N 3.29Å; H175-N177 PolarHBondContact O-N 2.66Å
176	A	88.8	Confident	91.9	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.008	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-86.7	4.4	-175.6	0	0	0	0	0	113.4	F173 H174 F178 F202 L206	F173-A176 PolarHBondContact O-N 3.48Å; H174-A176 VanDerWaalsContact C-N 3.26Å; H174-A176 PolarHBondContact O-N 2.89Å; A176-F178 HydrophobicContact CB-CD1 4.33Å; A176-F178 HydrophobicContact CB-CD2 3.75Å; A176-F178 HydrophobicContact CB-CE1 3.98Å; A176-F178 HydrophobicContact CB-CE2 3.37Å; A176-F178 HydrophobicContact CB-CG 4.21Å; A176-F178 HydrophobicContact CB-CZ 3.48Å; A176-F178 VanDerWaalsContact CB-CZ 3.48Å; A176-F178 PolarHBondContact O-N 2.98Å; A176-F202 HydrophobicContact CB-CB 4.3Å; A176-F202 HydrophobicContact CB-CD2 4.24Å; A176-L206 HydrophobicContact CB-CD1 4.31Å; A176-L206 WeakPolarHBondContact O-CD1 3.42Å
177	N	86	Confident	91.9	Very high	73 Å²	73	37.7 Å²	37.7	39%	0.39	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.7	38.1	-177.8	-60.1	-48.4	0	0	0	113.6	V136 H175	V136-N177 PolarHBondContact O-ND2 3.13Å; H175-N177 VanDerWaalsContact C-N 3.29Å; H175-N177 PolarHBondContact O-N 2.66Å
178	F	89.1	Confident	91.9	Very high	17 Å²	17	42.4 Å²	42.4	8%	0.075	21%	0.212	C	C	.	.			trans	-68.5	144.3	174.6	-64	-45.4	0	0	0	110.6	A176 V182 M183 L186 F202 L227 V231	A176-F178 HydrophobicContact CB-CD1 4.33Å; A176-F178 HydrophobicContact CB-CD2 3.75Å; A176-F178 HydrophobicContact CB-CE1 3.98Å; A176-F178 HydrophobicContact CB-CE2 3.37Å; A176-F178 HydrophobicContact CB-CG 4.21Å; A176-F178 HydrophobicContact CB-CZ 3.48Å; A176-F178 VanDerWaalsContact CB-CZ 3.48Å; A176-F178 PolarHBondContact O-N 2.98Å; F178-V182 HydrophobicContact CB-CB 4.06Å; F178-V182 HydrophobicContact CB-CG1 3.96Å; F178-V182 HydrophobicContact CD2-CG1 4.44Å; F178-V182 HydrophobicContact CG-CG1 4.14Å; F178-M183 HydrophobicContact CB-CG 4.31Å; F178-M183 HydrophobicContact CB-SD 4.11Å; F178-M183 HydrophobicContact CD2-SD 4.29Å; F178-L186 HydrophobicContact CD2-CD1 4.39Å; F178-F202 HydrophobicContact CE2-CD2 4.01Å; F178-F202 HydrophobicContact CE2-CE1 4.38Å; F178-F202 AromaticContact CE2-CE2 3.79Å; F178-F202 HydrophobicContact CE2-CE2 3.79Å; F178-F202 HydrophobicContact CE2-CG 4.41Å; F178-F202 HydrophobicContact CE2-CZ 4.01Å; F178-F202 HydrophobicContact CZ-CB 4.45Å; F178-F202 AromaticContact CZ-CD1 3.77Å; F178-F202 HydrophobicContact CZ-CD1 3.77Å; F178-F202 AromaticContact CZ-CD2 3.87Å; F178-F202 HydrophobicContact CZ-CD2 3.87Å; F178-F202 AromaticContact CZ-CE1 3.79Å; F178-F202 HydrophobicContact CZ-CE1 3.79Å; F178-F202 AromaticContact CZ-CE2 3.92Å; F178-F202 HydrophobicContact CZ-CE2 3.92Å; F178-F202 AromaticContact CZ-CG 3.8Å; F178-F202 HydrophobicContact CZ-CG 3.8Å; F178-F202 AromaticContact CZ-CZ 3.9Å; F178-F202 HydrophobicContact CZ-CZ 3.9Å; F178-L227 HydrophobicContact CD1-CB 4.12Å; F178-L227 HydrophobicContact CD2-CD1 4.29Å; F178-L227 HydrophobicContact CE1-CB 3.47Å; F178-L227 VanDerWaalsContact CE1-CB 3.47Å; F178-L227 HydrophobicContact CE1-CD1 4.48Å; F178-L227 HydrophobicContact CE2-CB 4.24Å; F178-L227 HydrophobicContact CE2-CD1 3.74Å; F178-L227 HydrophobicContact CZ-CB 3.53Å; F178-L227 HydrophobicContact CZ-CD1 3.86Å; F178-L227 HydrophobicContact CZ-CG 4.37Å; F178-V231 HydrophobicContact CD1-CG2 3.76Å; F178-V231 HydrophobicContact CE1-CG2 4.25Å
179	P	88.5	Confident	91.6	Very high	31 Å²	31	43.3 Å²	43.3	20%	0.201	22%	0.217	C	C	.	.			trans	-55.8	148.6	172.1	-25.4	34.5	0	0	0	111.5	Y181 V182 M183	P179-Y181 HydrophobicContact CB-CD1 3.63Å; P179-Y181 HydrophobicContact CB-CD2 4.5Å; P179-Y181 HydrophobicContact CB-CE1 3.14Å; P179-Y181 HydrophobicContact CB-CE2 4.1Å; P179-Y181 HydrophobicContact CB-CG 4.28Å; P179-Y181 HydrophobicContact CG-CE1 3.88Å; P179-Y181 HydrophobicContact CG-CE2 4.46Å; P179-Y181 WeakPolarHBondContact CG-OH 3.39Å; P179-Y181 PolarHBondContact O-N 3.29Å; P179-Y181 VanDerWaalsContact O-N 3.11Å; P179-V182 HydrophobicContact CB-CG2 4.4Å; P179-V182 HydrophobicContact CG-CG2 4.41Å; P179-V182 WeakPolarHBondContact O-CB 3.34Å; P179-V182 PolarHBondContact O-N 3.11Å; P179-M183 PolarHBondContact O-N 2.98Å
180	Q	91	Very high	91.4	Very high	125 Å²	125	51.1 Å²	51.1	58%	0.584	25%	0.253	S	S	*	.	H	α-helix	trans	-53.1	-40.7	-175.6	-174.2	58.9	37	0	0	112.7	V182 M183 D184	Q180-V182 PolarHBondContact O-N 2.94Å; Q180-M183 CarbonylContact O-C 3.56Å; Q180-M183 WeakPolarHBondContact O-CA 3.36Å; Q180-M183 WeakPolarHBondContact O-CB 3.34Å; Q180-M183 PolarHBondContact O-N 3Å; Q180-D184 PolarHBondContact NE2-OD1 3.45Å; Q180-D184 PolarHBondContact O-N 3.49Å
181	Y	90.3	Very high	91.2	Very high	48 Å²	48	55.4 Å²	55.4	19%	0.188	27%	0.272	C	S	.	.	H	α-helix	trans	-64.3	-26.8	179.4	63.5	-102.7	0	0	0	114.1	P179 V185 I230 N234 C270 S271	P179-Y181 HydrophobicContact CB-CD1 3.63Å; P179-Y181 HydrophobicContact CB-CD2 4.5Å; P179-Y181 HydrophobicContact CB-CE1 3.14Å; P179-Y181 HydrophobicContact CB-CE2 4.1Å; P179-Y181 HydrophobicContact CB-CG 4.28Å; P179-Y181 HydrophobicContact CG-CE1 3.88Å; P179-Y181 HydrophobicContact CG-CE2 4.46Å; P179-Y181 WeakPolarHBondContact CG-OH 3.39Å; P179-Y181 PolarHBondContact O-N 3.29Å; P179-Y181 VanDerWaalsContact O-N 3.11Å; Y181-V185 WeakPolarHBondContact O-CG2 3.17Å; Y181-V185 PolarHBondContact O-N 2.98Å; Y181-I230 HydrophobicContact CE2-CG2 4.26Å; Y181-I230 WeakPolarHBondContact OH-CG2 3.29Å; Y181-N234 PolarHBondContact OH-ND2 2.74Å; Y181-C270 HydrophobicContact CD2-CB 3.63Å; Y181-C270 HydrophobicContact CG-CB 3.82Å; Y181-S271 VanDerWaalsContact CZ-CB 3.42Å; Y181-S271 VanDerWaalsContact OH-CB 3.29Å; Y181-S271 WeakPolarHBondContact OH-CB 3.4Å; Y181-S271 PolarHBondContact OH-OG 3.41Å
182	V	91	Very high	91	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.7	-42.4	172.9	174.3	0	0	0	0	109	F178 P179 Q180 D184 V185 L186 L227 I230 Y267	F178-V182 HydrophobicContact CB-CB 4.06Å; F178-V182 HydrophobicContact CB-CG1 3.96Å; F178-V182 HydrophobicContact CD2-CG1 4.44Å; F178-V182 HydrophobicContact CG-CG1 4.14Å; P179-V182 HydrophobicContact CB-CG2 4.4Å; P179-V182 HydrophobicContact CG-CG2 4.41Å; P179-V182 WeakPolarHBondContact O-CB 3.34Å; P179-V182 PolarHBondContact O-N 3.11Å; Q180-V182 PolarHBondContact O-N 2.94Å; V182-D184 VanDerWaalsContact C-N 3.31Å; V182-D184 PolarHBondContact O-N 2.8Å; V182-V185 PolarHBondContact O-N 3.4Å; V182-L186 HydrophobicContact CG1-CD1 4.18Å; V182-L186 HydrophobicContact CG1-CG 4.47Å; V182-L186 WeakPolarHBondContact O-CG 3.25Å; V182-L186 PolarHBondContact O-N 2.98Å; V182-L227 HydrophobicContact CG1-CD1 4.26Å; V182-L227 HydrophobicContact CG1-CD2 3.78Å; V182-I230 HydrophobicContact CG2-CG2 4.36Å; V182-Y267 HydrophobicContact CG1-CD1 4.16Å
183	M	91.6	Very high	90.9	Very high	21 Å²	21	63.5 Å²	63.5	10%	0.103	32%	0.317	C	S	.	.	H	α-helix	trans	-61.5	-40.9	176.7	-63.5	-64	-64.1	0	0	111.5	F173 H174 F178 P179 Q180 V185 L186 M187	F173-M183 HydrophobicContact CB-CE 3.81Å; F173-M183 HydrophobicContact CB-SD 4.06Å; H174-M183 HydrophobicContact CB-CE 4.15Å; F178-M183 HydrophobicContact CB-CG 4.31Å; F178-M183 HydrophobicContact CB-SD 4.11Å; F178-M183 HydrophobicContact CD2-SD 4.29Å; P179-M183 PolarHBondContact O-N 2.98Å; Q180-M183 CarbonylContact O-C 3.56Å; Q180-M183 WeakPolarHBondContact O-CA 3.36Å; Q180-M183 WeakPolarHBondContact O-CB 3.34Å; Q180-M183 PolarHBondContact O-N 3Å; M183-V185 PolarHBondContact O-N 3.29Å; M183-L186 WeakPolarHBondContact O-CB 3.3Å; M183-L186 PolarHBondContact O-N 3.37Å; M183-L186 HydrophobicContact SD-CD1 4.15Å; M183-M187 WeakPolarHBondContact O-CG 3.38Å; M183-M187 PolarHBondContact O-N 3.44Å
184	D	92.4	Very high	91	Very high	70 Å²	70	63 Å²	63	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-45.6	177.1	-58.9	-24.6	0	0	0	110.9	Q180 V182 L186 M187 D188	Q180-D184 PolarHBondContact NE2-OD1 3.45Å; Q180-D184 PolarHBondContact O-N 3.49Å; V182-D184 VanDerWaalsContact C-N 3.31Å; V182-D184 PolarHBondContact O-N 2.8Å; D184-L186 PolarHBondContact O-N 2.79Å; D184-M187 WeakPolarHBondContact O-CB 3.45Å; D184-M187 PolarHBondContact O-N 2.94Å; D184-D188 PolarHBondContact O-N 2.84Å
185	V	91.8	Very high	91	Very high	17 Å²	17	60.5 Å²	60.5	10%	0.103	31%	0.306	C	S	.	.	H	α-helix	trans	-65	-38.5	176.4	176	0	0	0	0	111.9	Y181 V182 M183 M187 D188 Q189 Y267	Y181-V185 WeakPolarHBondContact O-CG2 3.17Å; Y181-V185 PolarHBondContact O-N 2.98Å; V182-V185 PolarHBondContact O-N 3.4Å; M183-V185 PolarHBondContact O-N 3.29Å; V185-M187 VanDerWaalsContact C-N 3.3Å; V185-M187 PolarHBondContact O-N 3.23Å; V185-D188 PolarHBondContact O-N 3.31Å; V185-Q189 WeakPolarHBondContact O-CG 3.32Å; V185-Q189 PolarHBondContact O-N 3.23Å; V185-Y267 HydrophobicContact CB-CD1 4.23Å; V185-Y267 HydrophobicContact CB-CE1 4.25Å; V185-Y267 HydrophobicContact CG1-CD1 3.86Å; V185-Y267 HydrophobicContact CG1-CE1 3.73Å; V185-Y267 HydrophobicContact CG1-CE2 4.47Å; V185-Y267 HydrophobicContact CG1-CG 4.36Å
186	L	91.9	Very high	91.2	Very high	3 Å²	3	62.5 Å²	62.5	2%	0.016	32%	0.319	C	S	.	.	H	α-helix	trans	-62.1	-39.3	174.3	-71.4	171.3	0	0	0	111.6	F173 F178 V182 M183 D184 H190 F191 L227 Y267	F173-L186 HydrophobicContact CB-CD1 4.32Å; F173-L186 HydrophobicContact CD1-CD1 3.77Å; F173-L186 HydrophobicContact CE1-CD1 4.22Å; F173-L186 HydrophobicContact CE1-CD2 4.3Å; F173-L186 HydrophobicContact CG-CD1 4.04Å; F178-L186 HydrophobicContact CD2-CD1 4.39Å; V182-L186 HydrophobicContact CG1-CD1 4.18Å; V182-L186 HydrophobicContact CG1-CG 4.47Å; V182-L186 WeakPolarHBondContact O-CG 3.25Å; V182-L186 PolarHBondContact O-N 2.98Å; M183-L186 WeakPolarHBondContact O-CB 3.3Å; M183-L186 PolarHBondContact O-N 3.37Å; M183-L186 HydrophobicContact SD-CD1 4.15Å; D184-L186 PolarHBondContact O-N 2.79Å; L186-H190 PolarHBondContact O-N 3.4Å; L186-F191 HydrophobicContact CD2-CD2 3.81Å; L186-F191 PolarHBondContact O-N 3.5Å; L186-L227 HydrophobicContact CD1-CD1 4.29Å; L186-L227 HydrophobicContact CD2-CD1 4.3Å; L186-Y267 HydrophobicContact CD2-CE1 3.77Å; L186-Y267 HydrophobicContact CG-CE1 4.06Å
187	M	91.5	Very high	91.5	Very high	121 Å²	121	62.5 Å²	62.5	60%	0.596	32%	0.319	S	S	*	.	H	α-helix	trans	-68.6	-41.7	175.6	-70.1	-176.5	-170.4	0	0	111.8	M183 D184 V185 Q189 H190	M183-M187 WeakPolarHBondContact O-CG 3.38Å; M183-M187 PolarHBondContact O-N 3.44Å; D184-M187 WeakPolarHBondContact O-CB 3.45Å; D184-M187 PolarHBondContact O-N 2.94Å; V185-M187 VanDerWaalsContact C-N 3.3Å; V185-M187 PolarHBondContact O-N 3.23Å; M187-Q189 VanDerWaalsContact C-N 3.27Å; M187-Q189 PolarHBondContact O-N 2.95Å; M187-H190 WeakPolarHBondContact O-CA 3.3Å; M187-H190 PolarHBondContact O-N 3.45Å
188	D	92.1	Very high	92	Very high	126 Å²	126	59.4 Å²	59.4	67%	0.674	30%	0.302	S	S	*	.	H	α-helix	trans	-62.3	-35.5	176.3	-73.6	-16.9	0	0	0	111.9	D184 V185 H190	D184-D188 PolarHBondContact O-N 2.84Å; V185-D188 PolarHBondContact O-N 3.31Å; D188-H190 PolarHBondContact O-CE1 2.89Å; D188-H190 PolarHBondContact O-N 3.46Å; D188-H190 PolarHBondContact O-ND1 3.02Å
189	Q	89.1	Confident	92.3	Very high	73 Å²	73	58.6 Å²	58.6	34%	0.341	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	1.4	173.5	-67.4	-174.7	8.1	0	0	113.5	V185 M187 F191 Y267	V185-Q189 WeakPolarHBondContact O-CG 3.32Å; V185-Q189 PolarHBondContact O-N 3.23Å; M187-Q189 VanDerWaalsContact C-N 3.27Å; M187-Q189 PolarHBondContact O-N 2.95Å; Q189-F191 HydrophobicContact CB-CD1 4.4Å; Q189-F191 HydrophobicContact CB-CD2 4.21Å; Q189-F191 HydrophobicContact CB-CE1 4.34Å; Q189-F191 HydrophobicContact CB-CE2 4.12Å; Q189-F191 HydrophobicContact CB-CG 4.34Å; Q189-F191 HydrophobicContact CB-CZ 4.2Å; Q189-F191 PolarHBondContact O-N 2.91Å; Q189-Y267 PolarHBondContact OE1-OH 3.38Å
190	H	91.3	Very high	92.6	Very high	163 Å²	163	57.1 Å²	57.1	76%	0.755	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.5	31	-179.9	-58.5	67.8	0	0	0	113.6	L186 M187 D188 T192	L186-H190 PolarHBondContact O-N 3.4Å; M187-H190 WeakPolarHBondContact O-CA 3.3Å; M187-H190 PolarHBondContact O-N 3.45Å; D188-H190 PolarHBondContact O-CE1 2.89Å; D188-H190 PolarHBondContact O-N 3.46Å; D188-H190 PolarHBondContact O-ND1 3.02Å; H190-T192 PolarHBondContact O-N 3.47Å
191	F	90.9	Very high	92.9	Very high	92 Å²	92	51.1 Å²	51.1	40%	0.404	26%	0.261	S	S	.	.			trans	-80.4	112.1	173.8	-66.6	-16.6	0	0	0	110.4	F173 L186 Q189 L223	F173-F191 HydrophobicContact CE2-CB 3.95Å; F173-F191 WeakPolarHBondContact CE2-O 3.02Å; F173-F191 HydrophobicContact CZ-CB 4.05Å; L186-F191 HydrophobicContact CD2-CD2 3.81Å; L186-F191 PolarHBondContact O-N 3.5Å; Q189-F191 HydrophobicContact CB-CD1 4.4Å; Q189-F191 HydrophobicContact CB-CD2 4.21Å; Q189-F191 HydrophobicContact CB-CE1 4.34Å; Q189-F191 HydrophobicContact CB-CE2 4.12Å; Q189-F191 HydrophobicContact CB-CG 4.34Å; Q189-F191 HydrophobicContact CB-CZ 4.2Å; Q189-F191 PolarHBondContact O-N 2.91Å; F191-L223 HydrophobicContact CD2-CD1 4.17Å; F191-L223 HydrophobicContact CE2-CD1 3.68Å
192	T	90.8	Very high	93.2	Very high	138 Å²	138	48.9 Å²	48.9	85%	0.847	25%	0.252	S	S	*	.			trans	-89.4	-40.9	-173.6	52.6	0	0	0	0	113.3	H190	H190-T192 PolarHBondContact O-N 3.47Å
193	E	92.8	Very high	93.4	Very high	108 Å²	108	48.9 Å²	48.9	51%	0.505	25%	0.252	S	S	.	.	S	Bend	trans	-136.3	141.5	-176.7	-166.4	-176.1	164.3	0	0	111	K156	K156-E193 IonicContact NZ-OE1 2.81Å; K156-E193 PolarHBondContact NZ-OE1 3.33Å
194	P	94.9	Very high	93.6	Very high	3 Å²	3	47.9 Å²	47.9	2%	0.019	25%	0.247	C	C	.	.			trans	-63.4	140.6	170.4	25.2	-33.7	0	0	0	111.6	F173 Q198 C199 F202	F173-P194 HydrophobicContact CD1-CB 4.21Å; F173-P194 HydrophobicContact CE1-CB 3.86Å; F173-P194 HydrophobicContact CZ-CB 4.16Å; P194-Q198 HydrophobicContact CB-CB 3.86Å; P194-C199 PolarHBondContact O-SG 3.36Å; P194-C199 VanDerWaalsContact O-SG 3.4Å; P194-F202 HydrophobicContact CB-CE2 4.17Å
195	T	94.1	Very high	93.7	Very high	40 Å²	40	44.6 Å²	44.6	25%	0.245	23%	0.23	C	C	.	.			trans	-66.2	160.2	174.1	68.1	0	0	0	0	111	I197 Q198 C199 S219	T195-I197 PolarHBondContact O-N 3.01Å; T195-I197 VanDerWaalsContact O-N 3.12Å; T195-I197 WeakPolarHBondContact OG1-CG2 3.29Å; T195-Q198 CarbonylContact O-C 3.57Å; T195-Q198 WeakPolarHBondContact O-CA 3.31Å; T195-Q198 WeakPolarHBondContact O-CB 3.21Å; T195-Q198 PolarHBondContact O-N 3.34Å; T195-Q198 VanDerWaalsContact OG1-CD 3.25Å; T195-Q198 VanDerWaalsContact OG1-CG 3.27Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.38Å; T195-C199 PolarHBondContact O-N 2.8Å; T195-C199 PolarHBondContact O-SG 3.25Å; T195-C199 VanDerWaalsContact O-SG 3.37Å; T195-S219 VanDerWaalsContact CB-O 3.22Å; T195-S219 WeakPolarHBondContact CB-O 3.31Å; T195-S219 WeakPolarHBondContact CG2-O 3.3Å; T195-S219 PolarHBondContact OG1-O 2.72Å
196	P	94.8	Very high	93.9	Very high	43 Å²	43	44.2 Å²	44.2	28%	0.279	23%	0.228	S	C	.	.	H	α-helix	trans	-51	-39.8	-180	-32.7	38.5	0	0	0	115.1	K156 I158 Q198 C199 Q200 V379	K156-P196 HydrophobicContact CB-CB 4.06Å; K156-P196 HydrophobicContact CB-CG 4.24Å; K156-P196 WeakPolarHBondContact O-CB 3.4Å; I158-P196 HydrophobicContact CD1-CB 4.49Å; I158-P196 WeakPolarHBondContact CD1-O 3.27Å; I158-P196 HydrophobicContact CG1-CB 4.29Å; P196-Q198 VanDerWaalsContact C-N 3.35Å; P196-C199 WeakPolarHBondContact O-CB 3.17Å; P196-C199 PolarHBondContact O-N 3.19Å; P196-Q200 PolarHBondContact O-N 3.32Å; P196-V379 HydrophobicContact CB-CG1 3.68Å; P196-V379 HydrophobicContact CB-CG2 4.14Å; P196-V379 HydrophobicContact CG-CG1 4.42Å
197	I	94.8	Very high	93.9	Very high	0 Å²	0	45 Å²	45	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-71.5	-31.9	178.4	-169.6	59	0	0	0	112	T195 G201 A215 S219 K221 W355 I377 V379	T195-I197 PolarHBondContact O-N 3.01Å; T195-I197 VanDerWaalsContact O-N 3.12Å; T195-I197 WeakPolarHBondContact OG1-CG2 3.29Å; I197-G201 WeakPolarHBondContact O-CA 3.47Å; I197-G201 PolarHBondContact O-N 3.33Å; I197-A215 HydrophobicContact CB-CB 3.69Å; I197-A215 HydrophobicContact CD1-CB 3.96Å; I197-A215 HydrophobicContact CG1-CB 3.71Å; I197-A215 HydrophobicContact CG2-CB 4.17Å; I197-S219 WeakPolarHBondContact CG2-O 3.33Å; I197-K221 HydrophobicContact CG1-CG 4.37Å; I197-K221 HydrophobicContact CG2-CG 4.32Å; I197-W355 HydrophobicContact CD1-CZ3 3.9Å; I197-W355 HydrophobicContact CG1-CE3 4.3Å; I197-W355 HydrophobicContact CG1-CZ3 3.7Å; I197-I377 HydrophobicContact CD1-CD1 3.67Å; I197-I377 HydrophobicContact CD1-CG1 4.02Å; I197-V379 HydrophobicContact CB-CG2 3.94Å; I197-V379 HydrophobicContact CD1-CG2 3.92Å; I197-V379 HydrophobicContact CG1-CG2 4.5Å
198	Q	96.4	Very high	94	Very high	8 Å²	8	39.6 Å²	39.6	4%	0.037	21%	0.209	C	C	.	.	H	α-helix	trans	-71.6	-40.9	173.5	-71.3	169	1.8	0	0	111.3	P194 T195 P196 Q200 G201 F202 G220 A224	P194-Q198 HydrophobicContact CB-CB 3.86Å; T195-Q198 CarbonylContact O-C 3.57Å; T195-Q198 WeakPolarHBondContact O-CA 3.31Å; T195-Q198 WeakPolarHBondContact O-CB 3.21Å; T195-Q198 PolarHBondContact O-N 3.34Å; T195-Q198 VanDerWaalsContact OG1-CD 3.25Å; T195-Q198 VanDerWaalsContact OG1-CG 3.27Å; T195-Q198 WeakPolarHBondContact OG1-CG 3.38Å; P196-Q198 VanDerWaalsContact C-N 3.35Å; Q198-Q200 VanDerWaalsContact C-N 3.32Å; Q198-Q200 PolarHBondContact O-N 3.24Å; Q198-G201 PolarHBondContact O-N 3.18Å; Q198-F202 HydrophobicContact CB-CD2 4.04Å; Q198-F202 HydrophobicContact CB-CE1 4.23Å; Q198-F202 HydrophobicContact CB-CE2 3.57Å; Q198-F202 HydrophobicContact CB-CZ 3.67Å; Q198-F202 HydrophobicContact CG-CE1 4.13Å; Q198-F202 HydrophobicContact CG-CE2 4.12Å; Q198-F202 HydrophobicContact CG-CZ 3.68Å; Q198-F202 WeakPolarHBondContact O-CB 3.31Å; Q198-F202 VanDerWaalsContact O-CD2 3.23Å; Q198-F202 WeakPolarHBondContact O-CD2 3.47Å; Q198-F202 WeakPolarHBondContact O-CG 3.45Å; Q198-F202 PolarHBondContact O-N 3.5Å; Q198-G220 PolarHBondContact NE2-O 3.07Å; Q198-A224 HydrophobicContact CG-CB 4Å
199	C	96.2	Very high	94	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-51.7	-47.7	176.2	-73.8	0	0	0	0	112.6	K156 I158 P169 V170 P194 T195 P196 P203	K156-C199 HydrophobicContact CD-CB 4.07Å; K156-C199 WeakPolarHBondContact CE-SG 3.11Å; K156-C199 PolarHBondContact NZ-SG 2.84Å; K156-C199 VanDerWaalsContact NZ-SG 3.36Å; I158-C199 HydrophobicContact CD1-CB 4.31Å; P169-C199 CarbonylContact C-O 3.58Å; P169-C199 WeakPolarHBondContact CA-O 3.19Å; V170-C199 WeakPolarHBondContact CG2-O 3.46Å; V170-C199 PolarHBondContact N-O 3.11Å; V170-C199 VanDerWaalsContact O-CA 3.23Å; V170-C199 WeakPolarHBondContact O-CA 3.36Å; V170-C199 WeakPolarHBondContact O-CB 3.28Å; V170-C199 PolarHBondContact O-SG 3.3Å; P194-C199 PolarHBondContact O-SG 3.36Å; P194-C199 VanDerWaalsContact O-SG 3.4Å; T195-C199 PolarHBondContact O-N 2.8Å; T195-C199 PolarHBondContact O-SG 3.25Å; T195-C199 VanDerWaalsContact O-SG 3.37Å; P196-C199 WeakPolarHBondContact O-CB 3.17Å; P196-C199 PolarHBondContact O-N 3.19Å; C199-P203 VanDerWaalsContact O-CD 3.26Å; C199-P203 WeakPolarHBondContact O-CD 3.38Å; C199-P203 WeakPolarHBondContact O-CG 3.27Å
200	Q	96	Very high	94.4	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-91.1	-31.5	178.9	-171.2	61.4	85	0	0	112.9	I158 V160 C166 P167 P169 P196 Q198 P203 L204 I377	I158-Q200 HydrophobicContact CD1-CB 4.17Å; I158-Q200 HydrophobicContact CG2-CB 3.89Å; I158-Q200 HydrophobicContact CG2-CG 3.88Å; V160-Q200 HydrophobicContact CG2-CG 4.42Å; C166-Q200 PolarHBondContact SG-NE2 3.18Å; P167-Q200 PolarHBondContact O-NE2 2.98Å; P169-Q200 HydrophobicContact CB-CB 4.4Å; P196-Q200 PolarHBondContact O-N 3.32Å; Q198-Q200 VanDerWaalsContact C-N 3.32Å; Q198-Q200 PolarHBondContact O-N 3.24Å; Q200-P203 WeakPolarHBondContact O-CD 3.49Å; Q200-P203 WeakPolarHBondContact O-CG 3.41Å; Q200-L204 WeakPolarHBondContact O-CB 3.44Å; Q200-L204 PolarHBondContact O-N 2.93Å; Q200-I377 HydrophobicContact CB-CD1 4.23Å; Q200-I377 HydrophobicContact CG-CB 4.36Å; Q200-I377 HydrophobicContact CG-CD1 4.13Å; Q200-I377 HydrophobicContact CG-CG2 3.89Å
201	G	95.8	Very high	94.6	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-73.1	-38.8	-175.4	0	0	0	0	0	114	I197 Q198 L204 A205	I197-G201 WeakPolarHBondContact O-CA 3.47Å; I197-G201 PolarHBondContact O-N 3.33Å; Q198-G201 PolarHBondContact O-N 3.18Å; G201-L204 PolarHBondContact O-N 3.22Å; G201-A205 VanDerWaalsContact O-CB 3.25Å; G201-A205 WeakPolarHBondContact O-CB 3.47Å; G201-A205 PolarHBondContact O-N 2.91Å
202	F	96.3	Very high	94.8	Very high	0 Å²	0	21.9 Å²	21.9	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-58.5	-57.4	177.6	-67.5	-31	0	0	0	113.3	V170 F173 A176 F178 P194 Q198 L204 A205 L206 L223 L227 P228	V170-F202 HydrophobicContact CG2-CB 4.39Å; V170-F202 HydrophobicContact CG2-CD2 4.24Å; F173-F202 HydrophobicContact CD1-CE2 4.15Å; F173-F202 HydrophobicContact CE1-CE2 4.12Å; F173-F202 HydrophobicContact CE1-CZ 4.5Å; A176-F202 HydrophobicContact CB-CB 4.3Å; A176-F202 HydrophobicContact CB-CD2 4.24Å; F178-F202 HydrophobicContact CE2-CD2 4.01Å; F178-F202 HydrophobicContact CE2-CE1 4.38Å; F178-F202 AromaticContact CE2-CE2 3.79Å; F178-F202 HydrophobicContact CE2-CE2 3.79Å; F178-F202 HydrophobicContact CE2-CG 4.41Å; F178-F202 HydrophobicContact CE2-CZ 4.01Å; F178-F202 HydrophobicContact CZ-CB 4.45Å; F178-F202 AromaticContact CZ-CD1 3.77Å; F178-F202 HydrophobicContact CZ-CD1 3.77Å; F178-F202 AromaticContact CZ-CD2 3.87Å; F178-F202 HydrophobicContact CZ-CD2 3.87Å; F178-F202 AromaticContact CZ-CE1 3.79Å; F178-F202 HydrophobicContact CZ-CE1 3.79Å; F178-F202 AromaticContact CZ-CE2 3.92Å; F178-F202 HydrophobicContact CZ-CE2 3.92Å; F178-F202 AromaticContact CZ-CG 3.8Å; F178-F202 HydrophobicContact CZ-CG 3.8Å; F178-F202 AromaticContact CZ-CZ 3.9Å; F178-F202 HydrophobicContact CZ-CZ 3.9Å; P194-F202 HydrophobicContact CB-CE2 4.17Å; Q198-F202 HydrophobicContact CB-CD2 4.04Å; Q198-F202 HydrophobicContact CB-CE1 4.23Å; Q198-F202 HydrophobicContact CB-CE2 3.57Å; Q198-F202 HydrophobicContact CB-CZ 3.67Å; Q198-F202 HydrophobicContact CG-CE1 4.13Å; Q198-F202 HydrophobicContact CG-CE2 4.12Å; Q198-F202 HydrophobicContact CG-CZ 3.68Å; Q198-F202 WeakPolarHBondContact O-CB 3.31Å; Q198-F202 VanDerWaalsContact O-CD2 3.23Å; Q198-F202 WeakPolarHBondContact O-CD2 3.47Å; Q198-F202 WeakPolarHBondContact O-CG 3.45Å; Q198-F202 PolarHBondContact O-N 3.5Å; F202-L204 VanDerWaalsContact C-N 3.25Å; F202-L204 PolarHBondContact O-N 3.42Å; F202-A205 PolarHBondContact O-N 3.11Å; F202-L206 WeakPolarHBondContact O-CB 3.39Å; F202-L206 WeakPolarHBondContact O-CG 3.3Å; F202-L206 PolarHBondContact O-N 3.04Å; F202-L223 WeakPolarHBondContact CE1-O 3.48Å; F202-L227 HydrophobicContact CE1-CB 4.19Å; F202-L227 HydrophobicContact CE1-CD1 4.11Å; F202-L227 HydrophobicContact CE1-CG 4.44Å; F202-L227 HydrophobicContact CZ-CD1 3.82Å; F202-P228 HydrophobicContact CD1-CG 3.83Å
203	P	95.6	Very high	95	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-63.6	-35	-178.7	26.7	-36.1	0	0	0	111.4	Y135 P167 K168 V170 C199 Q200 S207	Y135-P203 HydrophobicContact CD2-CB 4.35Å; Y135-P203 HydrophobicContact CE1-CB 4Å; Y135-P203 HydrophobicContact CE2-CB 3.77Å; P167-P203 HydrophobicContact CB-CB 4.08Å; P167-P203 VanDerWaalsContact CG-C 3.48Å; P167-P203 HydrophobicContact CG-CB 3.82Å; P167-P203 HydrophobicContact CG-CG 4.33Å; K168-P203 WeakPolarHBondContact O-CG 3.21Å; V170-P203 HydrophobicContact CG1-CB 4.31Å; V170-P203 HydrophobicContact CG1-CG 4.19Å; C199-P203 VanDerWaalsContact O-CD 3.26Å; C199-P203 WeakPolarHBondContact O-CD 3.38Å; C199-P203 WeakPolarHBondContact O-CG 3.27Å; Q200-P203 WeakPolarHBondContact O-CD 3.49Å; Q200-P203 WeakPolarHBondContact O-CG 3.41Å; P203-S207 WeakPolarHBondContact O-CB 3.31Å; P203-S207 PolarHBondContact O-N 2.76Å
204	L	95.4	Very high	95	Very high	0 Å²	0	10.8 Å²	10.8	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-66.4	-46.3	177.8	-177.7	58.8	0	0	0	111.9	P167 Q200 G201 F202 S207 R209 M211 T375 I377	P167-L204 HydrophobicContact CG-CB 4.26Å; Q200-L204 WeakPolarHBondContact O-CB 3.44Å; Q200-L204 PolarHBondContact O-N 2.93Å; G201-L204 PolarHBondContact O-N 3.22Å; F202-L204 VanDerWaalsContact C-N 3.25Å; F202-L204 PolarHBondContact O-N 3.42Å; L204-S207 PolarHBondContact O-N 2.87Å; L204-S207 PolarHBondContact O-OG 2.61Å; L204-R209 HydrophobicContact CD1-CB 4.12Å; L204-M211 HydrophobicContact CB-SD 4.09Å; L204-M211 HydrophobicContact CD2-CB 3.61Å; L204-M211 HydrophobicContact CD2-CE 3.84Å; L204-M211 HydrophobicContact CD2-CG 4.33Å; L204-M211 HydrophobicContact CD2-SD 3.81Å; L204-M211 HydrophobicContact CG-CB 3.96Å; L204-M211 HydrophobicContact CG-CE 4.4Å; L204-M211 HydrophobicContact CG-CG 4.42Å; L204-M211 HydrophobicContact CG-SD 3.75Å; L204-T375 HydrophobicContact CD1-CG2 4.09Å; L204-T375 HydrophobicContact CD2-CG2 3.78Å; L204-I377 HydrophobicContact CD2-CD1 4.4Å; L204-I377 HydrophobicContact CD2-CG2 3.72Å
205	A	95.6	Very high	94.9	Very high	2 Å²	2	10.7 Å²	10.7	2%	0.017	6%	0.059	C	C	.	.	H	α-helix	trans	-65.5	-41.5	176.4	0	0	0	0	0	112.1	G201 F202 S207 G208 M211 P228 Q351 L353	G201-A205 VanDerWaalsContact O-CB 3.25Å; G201-A205 WeakPolarHBondContact O-CB 3.47Å; G201-A205 PolarHBondContact O-N 2.91Å; F202-A205 PolarHBondContact O-N 3.11Å; A205-S207 PolarHBondContact O-N 2.73Å; A205-G208 PolarHBondContact O-N 2.97Å; A205-M211 HydrophobicContact CB-SD 4.06Å; A205-P228 HydrophobicContact CB-CB 3.57Å; A205-P228 HydrophobicContact CB-CG 3.7Å; A205-Q351 PolarHBondContact O-NE2 2.87Å; A205-L353 HydrophobicContact CB-CD2 3.71Å
206	L	94.7	Very high	94.5	Very high	9 Å²	9	12.2 Å²	12.2	5%	0.047	6%	0.063	C	C	.	.	H	α-helix	trans	-67.5	-24.1	177.7	-69.7	169.1	0	0	0	113.3	F134 Y135 A176 F202 G208 P228 V231	F134-L206 PolarHBondContact N-O 2.67Å; Y135-L206 HydrophobicContact CD2-CB 3.98Å; Y135-L206 HydrophobicContact CD2-CD1 4.13Å; Y135-L206 HydrophobicContact CG-CB 4.3Å; Y135-L206 PolarHBondContact N-O 3.44Å; A176-L206 HydrophobicContact CB-CD1 4.31Å; A176-L206 WeakPolarHBondContact O-CD1 3.42Å; F202-L206 WeakPolarHBondContact O-CB 3.39Å; F202-L206 WeakPolarHBondContact O-CG 3.3Å; F202-L206 PolarHBondContact O-N 3.04Å; L206-G208 PolarHBondContact O-N 3.17Å; L206-P228 HydrophobicContact CD2-CB 4.01Å; L206-P228 HydrophobicContact CG-CB 4.15Å; L206-P228 HydrophobicContact CG-CG 4.41Å; L206-V231 HydrophobicContact CD2-CB 3.67Å; L206-V231 HydrophobicContact CD2-CG1 3.69Å; L206-V231 HydrophobicContact CD2-CG2 4.01Å
207	S	93.5	Very high	93.9	Very high	19 Å²	19	10.4 Å²	10.4	13%	0.133	5%	0.052	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-9.3	175.4	77.5	0	0	0	0	113.9	N133 P203 L204 A205 R209	N133-S207 WeakPolarHBondContact CB-O 3.34Å; N133-S207 WeakPolarHBondContact OD1-CA 3Å; P203-S207 WeakPolarHBondContact O-CB 3.31Å; P203-S207 PolarHBondContact O-N 2.76Å; L204-S207 PolarHBondContact O-N 2.87Å; L204-S207 PolarHBondContact O-OG 2.61Å; A205-S207 PolarHBondContact O-N 2.73Å; S207-R209 VanDerWaalsContact C-N 3.32Å; S207-R209 PolarHBondContact O-N 2.96Å
208	G	92.2	Very high	93.1	Very high	8 Å²	8	11.7 Å²	11.7	8%	0.082	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	79.3	8.9	179	0	0	0	0	0	115.1	K132 A205 L206	K132-G208 WeakPolarHBondContact O-CA 3.38Å; K132-G208 PolarHBondContact O-N 3.37Å; A205-G208 PolarHBondContact O-N 2.97Å; L206-G208 PolarHBondContact O-N 3.17Å
209	R	93.5	Very high	92.6	Very high	71 Å²	71	11.9 Å²	11.9	27%	0.268	7%	0.067	S	C	.	.			trans	-80.7	147.8	176.4	-71.2	-173.1	131.5	-110.6	-13.2	111.8	V165 L204 S207 Q351 D373 T375	V165-R209 VanDerWaalsContact CB-CZ 3.48Å; V165-R209 PolarHBondContact O-NH1 2.84Å; V165-R209 VanDerWaalsContact O-NH1 3.13Å; L204-R209 HydrophobicContact CD1-CB 4.12Å; S207-R209 VanDerWaalsContact C-N 3.32Å; S207-R209 PolarHBondContact O-N 2.96Å; R209-Q351 WeakPolarHBondContact O-CG 3.21Å; R209-Q351 PolarHBondContact O-NE2 2.84Å; R209-D373 PolarHBondContact NH1-O 3.13Å; R209-T375 PolarHBondContact NH1-OG1 3.09Å
210	D	95.8	Very high	92.2	Very high	9 Å²	9	13 Å²	13	5%	0.048	8%	0.079	C	C	.	.			trans	-66.5	144.7	167.2	-76.3	14.5	0	0	0	109.2	Q351 T352 L371 R372 Y374 T375	D210-Q351 VanDerWaalsContact OD1-CA 3.29Å; D210-Q351 WeakPolarHBondContact OD1-CA 3.32Å; D210-T352 VanDerWaalsContact CA-O 3.23Å; D210-T352 WeakPolarHBondContact CA-O 3.31Å; D210-T352 WeakPolarHBondContact CB-O 3.28Å; D210-T352 PolarHBondContact OD1-N 3.25Å; D210-L371 HydrophobicContact CB-CD2 4.12Å; D210-R372 WeakPolarHBondContact CB-O 3.24Å; D210-R372 PolarHBondContact OD2-N 2.92Å; D210-Y374 CarbonylContact O-C 3.44Å; D210-Y374 VanDerWaalsContact O-CA 3.23Å; D210-Y374 WeakPolarHBondContact O-CA 3.45Å; D210-T375 PolarHBondContact O-N 2.93Å
211	M	95.4	Very high	92	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	8%	0.082	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	154.8	-176.9	63.5	172.8	-72.4	0	0	114.2	L204 A205 T352 L353 M354 W355 T375 I377	L204-M211 HydrophobicContact CB-SD 4.09Å; L204-M211 HydrophobicContact CD2-CB 3.61Å; L204-M211 HydrophobicContact CD2-CE 3.84Å; L204-M211 HydrophobicContact CD2-CG 4.33Å; L204-M211 HydrophobicContact CD2-SD 3.81Å; L204-M211 HydrophobicContact CG-CB 3.96Å; L204-M211 HydrophobicContact CG-CE 4.4Å; L204-M211 HydrophobicContact CG-CG 4.42Å; L204-M211 HydrophobicContact CG-SD 3.75Å; A205-M211 HydrophobicContact CB-SD 4.06Å; M211-T352 PolarHBondContact N-O 3.48Å; M211-L353 HydrophobicContact CG-CB 4.1Å; M211-L353 HydrophobicContact CG-CD2 3.77Å; M211-L353 HydrophobicContact CG-CG 3.9Å; M211-L353 CarbonylContact O-C 3.58Å; M211-L353 WeakPolarHBondContact O-CA 3.35Å; M211-L353 HydrophobicContact SD-CD2 3.82Å; M211-M354 PolarHBondContact O-N 3.18Å; M211-W355 HydrophobicContact CE-CH2 3.26Å; M211-W355 HydrophobicContact CE-CZ2 3.57Å; M211-W355 HydrophobicContact CE-CZ3 3.86Å; M211-W355 HydrophobicContact SD-CH2 4.12Å; M211-W355 HydrophobicContact SD-CZ2 3.94Å; M211-T375 CarbonylContact C-O 3.58Å; M211-T375 WeakPolarHBondContact CA-O 3.44Å; M211-T375 WeakPolarHBondContact CB-O 3.03Å; M211-I377 HydrophobicContact CE-CD1 3.56Å; M211-I377 HydrophobicContact CE-CG1 4.09Å
212	V	96	Very high	91.9	Very high	1 Å²	1	15.4 Å²	15.4	1%	0.006	9%	0.092	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	114.6	168.9	178.6	0	0	0	0	107.8	I214 M354 W359 L371 Y374 T375 Q376 I377	V212-I214 HydrophobicContact CG1-CD1 4.09Å; V212-I214 HydrophobicContact CG1-CG1 4.02Å; V212-M354 CarbonylContact C-O 3.35Å; V212-M354 WeakPolarHBondContact CA-O 3.23Å; V212-M354 HydrophobicContact CG2-CB 4.28Å; V212-W359 HydrophobicContact CG1-CD2 4.01Å; V212-W359 HydrophobicContact CG1-CE3 4.44Å; V212-W359 HydrophobicContact CG1-CH2 4.16Å; V212-W359 HydrophobicContact CG1-CZ2 3.66Å; V212-W359 HydrophobicContact CG2-CZ2 4.06Å; V212-L371 HydrophobicContact CG2-CD1 3.6Å; V212-Y374 HydrophobicContact CB-CD2 4.47Å; V212-Y374 HydrophobicContact CG2-CD2 3.7Å; V212-Y374 HydrophobicContact CG2-CE2 3.79Å; V212-T375 PolarHBondContact N-O 2.98Å; V212-Q376 HydrophobicContact CB-CB 4.43Å; V212-Q376 HydrophobicContact CB-CG 4.21Å; V212-Q376 HydrophobicContact CG1-CG 4.34Å; V212-I377 PolarHBondContact O-N 2.91Å
213	G	95	Very high	91.8	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	111.1	179.3	0	0	0	0	0	112.4	M354 W355 S356	G213-M354 PolarHBondContact N-O 3.08Å; G213-W355 WeakPolarHBondContact O-CA 3.42Å; G213-S356 PolarHBondContact O-N 2.93Å
214	I	93.9	Very high	91.8	Very high	13 Å²	13	16.2 Å²	16.2	7%	0.067	10%	0.096	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	118.8	-178.2	-56.7	155.9	0	0	0	108.6	V212 S356 W359 Q376 I377 N378 V379	V212-I214 HydrophobicContact CG1-CD1 4.09Å; V212-I214 HydrophobicContact CG1-CG1 4.02Å; I214-S356 WeakPolarHBondContact CA-O 3.47Å; I214-W359 HydrophobicContact CD1-CB 3.35Å; I214-W359 VanDerWaalsContact CD1-CD1 3.46Å; I214-W359 HydrophobicContact CD1-CD2 4.24Å; I214-W359 HydrophobicContact CD1-CG 3.41Å; I214-W359 VanDerWaalsContact CD1-CG 3.41Å; I214-W359 HydrophobicContact CG1-CB 3.76Å; I214-W359 HydrophobicContact CG1-CD2 4.46Å; I214-W359 HydrophobicContact CG1-CG 3.98Å; I214-W359 HydrophobicContact CG2-CB 4.37Å; I214-Q376 HydrophobicContact CD1-CG 4.1Å; I214-I377 PolarHBondContact N-O 3.01Å; I214-N378 VanDerWaalsContact CD1-ND2 3.29Å; I214-N378 WeakPolarHBondContact CD1-ND2 3.37Å; I214-N378 CarbonylContact O-C 3.57Å; I214-N378 WeakPolarHBondContact O-CA 3.23Å; I214-V379 PolarHBondContact O-N 3.39Å
215	A	91.3	Very high	91.9	Very high	1 Å²	1	16.2 Å²	16.2	1%	0.008	10%	0.096	C	C	.	.			trans	-155.9	151.4	176.3	0	0	0	0	0	111.3	I197 S219 K221 S356 A357 V379	I197-A215 HydrophobicContact CB-CB 3.69Å; I197-A215 HydrophobicContact CD1-CB 3.96Å; I197-A215 HydrophobicContact CG1-CB 3.71Å; I197-A215 HydrophobicContact CG2-CB 4.17Å; A215-S219 WeakPolarHBondContact CB-OG 3.3Å; A215-K221 HydrophobicContact CB-CD 4.27Å; A215-K221 HydrophobicContact CB-CG 4.35Å; A215-K221 PolarHBondContact O-NZ 3.17Å; A215-S356 PolarHBondContact N-O 3.48Å; A215-A357 VanDerWaalsContact O-CA 3.26Å; A215-A357 WeakPolarHBondContact O-CA 3.48Å; A215-V379 HydrophobicContact CB-CB 3.89Å; A215-V379 HydrophobicContact CB-CG2 4.24Å
216	Q	86.4	Confident	91.9	Very high	72 Å²	72	16.2 Å²	16.2	34%	0.336	10%	0.096	S	C	.	.			trans	-49.6	156.5	-180	62.7	175.4	-16.8	0	0	114.2	G218 S219 N387	Q216-G218 PolarHBondContact O-N 3.05Å; Q216-S219 VanDerWaalsContact O-CB 3.29Å; Q216-S219 WeakPolarHBondContact O-CB 3.33Å; Q216-S219 PolarHBondContact O-N 3.5Å; Q216-S219 PolarHBondContact O-OG 2.99Å; Q216-N387 VanDerWaalsContact OE1-CG 3.27Å; Q216-N387 PolarHBondContact OE1-OD1 3.11Å
217	T	82	Confident	91.9	Very high	6 Å²	6	15.9 Å²	15.9	4%	0.037	9%	0.094	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	136.7	176.3	53.2	0	0	0	0	111.3	S219 A357 G507	T217-S219 VanDerWaalsContact C-N 3.32Å; T217-A357 HydrophobicContact CG2-CB 3.91Å; T217-G507 VanDerWaalsContact OG1-CA 3.26Å; T217-G507 WeakPolarHBondContact OG1-CA 3.2Å
218	G	78.6	Confident	91.9	Very high	26 Å²	26	15 Å²	15	27%	0.268	9%	0.088	S	C	.	.	T	Hydrogen-bonded Turn	trans	80.1	7.1	179.8	0	0	0	0	0	115.1	Q216 G220	Q216-G218 PolarHBondContact O-N 3.05Å; G218-G220 VanDerWaalsContact C-N 3.25Å; G218-G220 PolarHBondContact O-N 3.13Å
219	S	84.3	Confident	92	Very high	12 Å²	12	14.6 Å²	14.6	8%	0.084	8%	0.084	C	C	.	.	S	Bend	trans	-80	9.1	177.8	57.7	0	0	0	0	115.2	T195 I197 A215 Q216 T217	T195-S219 VanDerWaalsContact CB-O 3.22Å; T195-S219 WeakPolarHBondContact CB-O 3.31Å; T195-S219 WeakPolarHBondContact CG2-O 3.3Å; T195-S219 PolarHBondContact OG1-O 2.72Å; I197-S219 WeakPolarHBondContact CG2-O 3.33Å; A215-S219 WeakPolarHBondContact CB-OG 3.3Å; Q216-S219 VanDerWaalsContact O-CB 3.29Å; Q216-S219 WeakPolarHBondContact O-CB 3.33Å; Q216-S219 PolarHBondContact O-N 3.5Å; Q216-S219 PolarHBondContact O-OG 2.99Å; T217-S219 VanDerWaalsContact C-N 3.32Å
220	G	88.3	Confident	92	Very high	24 Å²	24	11.3 Å²	11.3	25%	0.247	7%	0.071	C	C	.	.			trans	80.9	25.3	177.1	0	0	0	0	0	115.9	Q198 G218 T222 L223 A224	Q198-G220 PolarHBondContact NE2-O 3.07Å; G218-G220 VanDerWaalsContact C-N 3.25Å; G218-G220 PolarHBondContact O-N 3.13Å; G220-T222 PolarHBondContact O-N 2.76Å; G220-L223 PolarHBondContact O-N 2.97Å; G220-A224 PolarHBondContact O-N 2.79Å
221	K	92.6	Very high	91.9	Very high	17 Å²	17	11.3 Å²	11.3	7%	0.074	7%	0.072	C	C	.	.	H	α-helix	trans	-54.8	-35.8	177.1	-67.3	-176.4	-64.9	-149.1	0	113.7	I197 A215 L223 A224 Y225 W355 S356	I197-K221 HydrophobicContact CG1-CG 4.37Å; I197-K221 HydrophobicContact CG2-CG 4.32Å; A215-K221 HydrophobicContact CB-CD 4.27Å; A215-K221 HydrophobicContact CB-CG 4.35Å; A215-K221 PolarHBondContact O-NZ 3.17Å; K221-L223 PolarHBondContact O-N 2.96Å; K221-A224 WeakPolarHBondContact O-CA 3.4Å; K221-A224 VanDerWaalsContact O-CB 3.23Å; K221-A224 WeakPolarHBondContact O-CB 3.35Å; K221-A224 PolarHBondContact O-N 3.49Å; K221-Y225 WeakPolarHBondContact O-CD1 3.4Å; K221-Y225 WeakPolarHBondContact O-CE1 3.36Å; K221-Y225 PolarHBondContact O-N 2.92Å; K221-W355 HydrophobicContact CB-CE3 4.46Å; K221-W355 HydrophobicContact CG-CE3 4.42Å; K221-S356 PolarHBondContact NZ-O 3.02Å
222	T	93.7	Very high	91.8	Very high	34 Å²	34	11.5 Å²	11.5	21%	0.209	7%	0.073	C	C	.	.	H	α-helix	trans	-58.3	-47.2	-179.4	-54.2	0	0	0	0	112.3	G220 A224 Y225 L226 V260 V263	G220-T222 PolarHBondContact O-N 2.76Å; T222-A224 VanDerWaalsContact C-N 3.32Å; T222-A224 PolarHBondContact O-N 2.78Å; T222-Y225 HydrophobicContact CG2-CE2 4.46Å; T222-Y225 PolarHBondContact O-N 3.28Å; T222-L226 HydrophobicContact CG2-CD1 3.7Å; T222-L226 HydrophobicContact CG2-CG 4.34Å; T222-L226 WeakPolarHBondContact O-CB 3.28Å; T222-L226 VanDerWaalsContact O-CG 3.31Å; T222-L226 WeakPolarHBondContact O-CG 3.43Å; T222-L226 PolarHBondContact O-N 2.85Å; T222-V260 HydrophobicContact CG2-CG1 4.34Å; T222-V260 HydrophobicContact CG2-CG2 4.29Å; T222-V263 HydrophobicContact CG2-CB 4.3Å; T222-V263 HydrophobicContact CG2-CG1 4.11Å; T222-V263 HydrophobicContact CG2-CG2 4.46Å
223	L	94.5	Very high	91.7	Very high	17 Å²	17	11.9 Å²	11.9	9%	0.089	8%	0.075	C	C	.	.	H	α-helix	trans	-69.9	-32.3	175.6	-63.8	178	0	0	0	111.9	F191 F202 G220 K221 Y225 L226 L227 V263 Y267	F191-L223 HydrophobicContact CD2-CD1 4.17Å; F191-L223 HydrophobicContact CE2-CD1 3.68Å; F202-L223 WeakPolarHBondContact CE1-O 3.48Å; G220-L223 PolarHBondContact O-N 2.97Å; K221-L223 PolarHBondContact O-N 2.96Å; L223-Y225 PolarHBondContact O-N 3.31Å; L223-Y225 VanDerWaalsContact O-N 3.15Å; L223-L226 PolarHBondContact O-N 2.98Å; L223-L227 HydrophobicContact CB-CD1 4.37Å; L223-L227 HydrophobicContact CB-CG 4.28Å; L223-L227 HydrophobicContact CD2-CD2 4.28Å; L223-L227 HydrophobicContact CD2-CG 4.42Å; L223-L227 WeakPolarHBondContact O-CG 3.42Å; L223-L227 PolarHBondContact O-N 3.03Å; L223-V263 HydrophobicContact CD2-CG1 3.76Å; L223-Y267 HydrophobicContact CD2-CD2 3.95Å; L223-Y267 HydrophobicContact CD2-CE1 4.32Å; L223-Y267 HydrophobicContact CD2-CE2 3.37Å
224	A	95.8	Very high	91.5	Very high	0 Å²	0	15 Å²	15	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-55.6	-31.4	178.7	0	0	0	0	0	113.1	Q198 G220 K221 T222 P228 W355	Q198-A224 HydrophobicContact CG-CB 4Å; G220-A224 PolarHBondContact O-N 2.79Å; K221-A224 WeakPolarHBondContact O-CA 3.4Å; K221-A224 VanDerWaalsContact O-CB 3.23Å; K221-A224 WeakPolarHBondContact O-CB 3.35Å; K221-A224 PolarHBondContact O-N 3.49Å; T222-A224 VanDerWaalsContact C-N 3.32Å; T222-A224 PolarHBondContact O-N 2.78Å; A224-P228 VanDerWaalsContact O-CD 3.29Å; A224-P228 WeakPolarHBondContact O-CD 3.23Å; A224-P228 VanDerWaalsContact O-CG 3.28Å; A224-P228 WeakPolarHBondContact O-CG 3.41Å; A224-W355 HydrophobicContact CB-CH2 3.65Å; A224-W355 HydrophobicContact CB-CZ2 4.31Å; A224-W355 HydrophobicContact CB-CZ3 3.84Å
225	Y	96.1	Very high	91.3	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-103.1	-30	173.5	62.3	-108.9	0	0	0	114.7	K221 T222 L223 A229 V249 V260 Y321 V323 D325 W355	K221-Y225 WeakPolarHBondContact O-CD1 3.4Å; K221-Y225 WeakPolarHBondContact O-CE1 3.36Å; K221-Y225 PolarHBondContact O-N 2.92Å; T222-Y225 HydrophobicContact CG2-CE2 4.46Å; T222-Y225 PolarHBondContact O-N 3.28Å; L223-Y225 PolarHBondContact O-N 3.31Å; L223-Y225 VanDerWaalsContact O-N 3.15Å; Y225-A229 VanDerWaalsContact O-CB 3.3Å; Y225-A229 WeakPolarHBondContact O-CB 3.46Å; Y225-A229 PolarHBondContact O-N 3.41Å; Y225-A229 VanDerWaalsContact O-N 3.12Å; Y225-V249 HydrophobicContact CE2-CG1 4.17Å; Y225-V249 HydrophobicContact CE2-CG2 4.31Å; Y225-V260 HydrophobicContact CE2-CG1 4.07Å; Y225-V260 WeakPolarHBondContact OH-CG1 3.45Å; Y225-V260 WeakPolarHBondContact OH-CG2 3.42Å; Y225-Y321 PolarHBondContact O-OH 2.79Å; Y225-Y321 VanDerWaalsContact O-OH 3.05Å; Y225-V323 HydrophobicContact CD1-CG1 3.95Å; Y225-V323 HydrophobicContact CD2-CB 4.5Å; Y225-V323 HydrophobicContact CD2-CG1 3.89Å; Y225-V323 HydrophobicContact CD2-CG2 4.13Å; Y225-V323 HydrophobicContact CE1-CG1 4.22Å; Y225-V323 HydrophobicContact CE2-CG1 4.21Å; Y225-V323 HydrophobicContact CG-CG1 3.77Å; Y225-V323 HydrophobicContact CG-CG2 4.3Å; Y225-D325 HydrophobicContact CE1-CB 4.5Å; Y225-D325 PolarHBondContact OH-OD2 2.6Å; Y225-W355 AromaticContact CD1-CD1 3.62Å; Y225-W355 HydrophobicContact CD1-CD2 4.18Å; Y225-W355 AromaticContact CD1-CG 3.91Å; Y225-W355 HydrophobicContact CD1-CG 3.91Å; Y225-W355 AromaticContact CD1-NE1 3.7Å; Y225-W355 AromaticContact CG-NE1 3.95Å
226	L	95.5	Very high	91.2	Very high	2 Å²	2	19.9 Å²	19.9	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-71.8	-41.1	-178.4	-74.6	-178.5	0	0	0	113	T222 L223 A229 I230 V260 V263 A264	T222-L226 HydrophobicContact CG2-CD1 3.7Å; T222-L226 HydrophobicContact CG2-CG 4.34Å; T222-L226 WeakPolarHBondContact O-CB 3.28Å; T222-L226 VanDerWaalsContact O-CG 3.31Å; T222-L226 WeakPolarHBondContact O-CG 3.43Å; T222-L226 PolarHBondContact O-N 2.85Å; L223-L226 PolarHBondContact O-N 2.98Å; L226-A229 WeakPolarHBondContact O-CB 3.39Å; L226-A229 PolarHBondContact O-N 2.8Å; L226-I230 WeakPolarHBondContact O-CG1 3.26Å; L226-I230 PolarHBondContact O-N 3.49Å; L226-V260 HydrophobicContact CD1-CG1 4.23Å; L226-V260 HydrophobicContact CD2-CG1 4.34Å; L226-V263 HydrophobicContact CD1-CB 4.04Å; L226-V263 HydrophobicContact CD1-CG1 3.7Å; L226-A264 HydrophobicContact CD1-CB 4.1Å; L226-A264 HydrophobicContact CD2-CB 4.13Å
227	L	94.4	Very high	91.4	Very high	1 Å²	1	20.7 Å²	20.7	1%	0.005	13%	0.125	C	C	.	.	H	α-helix	trans	-67.4	-45.4	-178.1	-54.9	-174.9	0	0	0	111.7	F178 V182 L186 F202 L223 A229 I230 V231 Y267	F178-L227 HydrophobicContact CD1-CB 4.12Å; F178-L227 HydrophobicContact CD2-CD1 4.29Å; F178-L227 HydrophobicContact CE1-CB 3.47Å; F178-L227 VanDerWaalsContact CE1-CB 3.47Å; F178-L227 HydrophobicContact CE1-CD1 4.48Å; F178-L227 HydrophobicContact CE2-CB 4.24Å; F178-L227 HydrophobicContact CE2-CD1 3.74Å; F178-L227 HydrophobicContact CZ-CB 3.53Å; F178-L227 HydrophobicContact CZ-CD1 3.86Å; F178-L227 HydrophobicContact CZ-CG 4.37Å; V182-L227 HydrophobicContact CG1-CD1 4.26Å; V182-L227 HydrophobicContact CG1-CD2 3.78Å; L186-L227 HydrophobicContact CD1-CD1 4.29Å; L186-L227 HydrophobicContact CD2-CD1 4.3Å; F202-L227 HydrophobicContact CE1-CB 4.19Å; F202-L227 HydrophobicContact CE1-CD1 4.11Å; F202-L227 HydrophobicContact CE1-CG 4.44Å; F202-L227 HydrophobicContact CZ-CD1 3.82Å; L223-L227 HydrophobicContact CB-CD1 4.37Å; L223-L227 HydrophobicContact CB-CG 4.28Å; L223-L227 HydrophobicContact CD2-CD2 4.28Å; L223-L227 HydrophobicContact CD2-CG 4.42Å; L223-L227 WeakPolarHBondContact O-CG 3.42Å; L223-L227 PolarHBondContact O-N 3.03Å; L227-A229 VanDerWaalsContact C-N 3.26Å; L227-A229 PolarHBondContact O-N 2.76Å; L227-I230 HydrophobicContact CD2-CD1 4.43Å; L227-I230 PolarHBondContact O-N 3.15Å; L227-V231 PolarHBondContact O-N 3.02Å; L227-Y267 HydrophobicContact CD2-CD1 3.52Å; L227-Y267 HydrophobicContact CD2-CE1 3.87Å; L227-Y267 HydrophobicContact CD2-CG 3.91Å
228	P	94.9	Very high	91.9	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	16%	0.164	C	C	.	.	H	α-helix	trans	-60.8	-33.5	170.1	-26.1	38.2	0	0	0	113.2	F202 A205 L206 A224 I230 V231 H232	F202-P228 HydrophobicContact CD1-CG 3.83Å; A205-P228 HydrophobicContact CB-CB 3.57Å; A205-P228 HydrophobicContact CB-CG 3.7Å; L206-P228 HydrophobicContact CD2-CB 4.01Å; L206-P228 HydrophobicContact CG-CB 4.15Å; L206-P228 HydrophobicContact CG-CG 4.41Å; A224-P228 VanDerWaalsContact O-CD 3.29Å; A224-P228 WeakPolarHBondContact O-CD 3.23Å; A224-P228 VanDerWaalsContact O-CG 3.28Å; A224-P228 WeakPolarHBondContact O-CG 3.41Å; P228-I230 PolarHBondContact O-N 3.21Å; P228-V231 PolarHBondContact O-N 2.96Å; P228-H232 WeakPolarHBondContact O-CB 3.27Å; P228-H232 PolarHBondContact O-N 2.86Å
229	A	95	Very high	92.5	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62.5	-40	175.1	0	0	0	0	0	112.6	Y225 L226 L227 H232 I233 C247 Y321	Y225-A229 VanDerWaalsContact O-CB 3.3Å; Y225-A229 WeakPolarHBondContact O-CB 3.46Å; Y225-A229 PolarHBondContact O-N 3.41Å; Y225-A229 VanDerWaalsContact O-N 3.12Å; L226-A229 WeakPolarHBondContact O-CB 3.39Å; L226-A229 PolarHBondContact O-N 2.8Å; L227-A229 VanDerWaalsContact C-N 3.26Å; L227-A229 PolarHBondContact O-N 2.76Å; A229-H232 WeakPolarHBondContact O-CB 3.24Å; A229-H232 PolarHBondContact O-N 3.06Å; A229-I233 WeakPolarHBondContact O-CB 3.45Å; A229-I233 WeakPolarHBondContact O-CD1 3.2Å; A229-I233 WeakPolarHBondContact O-CG1 3.37Å; A229-I233 PolarHBondContact O-N 3.33Å; A229-C247 HydrophobicContact CB-CB 4.4Å; A229-Y321 HydrophobicContact CB-CD1 3.88Å; A229-Y321 HydrophobicContact CB-CE1 3.61Å
230	I	93.4	Very high	92.8	Very high	1 Å²	1	37.7 Å²	37.7	1%	0.005	19%	0.189	C	C	.	.	H	α-helix	trans	-62.3	-46	175.6	-68.2	168.7	0	0	0	110.3	Y181 V182 L226 L227 P228 H232 I233 N234 L273	Y181-I230 HydrophobicContact CE2-CG2 4.26Å; Y181-I230 WeakPolarHBondContact OH-CG2 3.29Å; V182-I230 HydrophobicContact CG2-CG2 4.36Å; L226-I230 WeakPolarHBondContact O-CG1 3.26Å; L226-I230 PolarHBondContact O-N 3.49Å; L227-I230 HydrophobicContact CD2-CD1 4.43Å; L227-I230 PolarHBondContact O-N 3.15Å; P228-I230 PolarHBondContact O-N 3.21Å; I230-H232 VanDerWaalsContact C-N 3.34Å; I230-H232 PolarHBondContact O-N 3.32Å; I230-I233 PolarHBondContact O-N 3.22Å; I230-N234 VanDerWaalsContact O-CG 3.22Å; I230-N234 PolarHBondContact O-N 2.87Å; I230-N234 PolarHBondContact O-ND2 3.27Å; I230-L273 HydrophobicContact CB-CD1 4.35Å; I230-L273 HydrophobicContact CG1-CD1 4.14Å; I230-L273 HydrophobicContact CG2-CD1 3.96Å
231	V	92.8	Very high	92.9	Very high	9 Å²	9	48.7 Å²	48.7	6%	0.055	22%	0.223	C	C	.	.	H	α-helix	trans	-61.8	-44.4	176.6	-179.2	0	0	0	0	110.8	F178 L206 L227 P228 I233 N234 H235	F178-V231 HydrophobicContact CD1-CG2 3.76Å; F178-V231 HydrophobicContact CE1-CG2 4.25Å; L206-V231 HydrophobicContact CD2-CB 3.67Å; L206-V231 HydrophobicContact CD2-CG1 3.69Å; L206-V231 HydrophobicContact CD2-CG2 4.01Å; L227-V231 PolarHBondContact O-N 3.02Å; P228-V231 PolarHBondContact O-N 2.96Å; V231-I233 PolarHBondContact O-N 3.09Å; V231-N234 PolarHBondContact O-N 3.33Å; V231-H235 PolarHBondContact O-N 3.42Å; V231-H235 PolarHBondContact O-ND1 3.3Å
232	H	93.3	Very high	92.8	Very high	5 Å²	5	50.8 Å²	50.8	2%	0.023	25%	0.249	C	C	.	.	H	α-helix	trans	-57	-48.4	176.9	-176.9	89.7	0	0	0	111.3	F130 F134 P228 A229 I230 N234 H235 Q236 T320 Y321	F130-H232 AromaticContact CE2-CE1 3.97Å; F134-H232 AromaticContact CE2-ND1 3.65Å; P228-H232 WeakPolarHBondContact O-CB 3.27Å; P228-H232 PolarHBondContact O-N 2.86Å; A229-H232 WeakPolarHBondContact O-CB 3.24Å; A229-H232 PolarHBondContact O-N 3.06Å; I230-H232 VanDerWaalsContact C-N 3.34Å; I230-H232 PolarHBondContact O-N 3.32Å; H232-N234 PolarHBondContact O-N 3.3Å; H232-H235 PolarHBondContact O-N 2.9Å; H232-Q236 WeakPolarHBondContact O-CG 3.34Å; H232-T320 PolarHBondContact NE2-OG1 3.31Å; H232-Y321 HydrophobicContact CB-CD2 4.19Å; H232-Y321 AromaticContact CG-CD2 3.98Å
233	I	93.3	Very high	92.8	Very high	8 Å²	8	51 Å²	51	4%	0.041	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-42.7	-179.7	-69.9	160.8	0	0	0	111.6	A229 I230 V231 H235 Q236 I246 C247 L273 E296 I297	A229-I233 WeakPolarHBondContact O-CB 3.45Å; A229-I233 WeakPolarHBondContact O-CD1 3.2Å; A229-I233 WeakPolarHBondContact O-CG1 3.37Å; A229-I233 PolarHBondContact O-N 3.33Å; I230-I233 PolarHBondContact O-N 3.22Å; V231-I233 PolarHBondContact O-N 3.09Å; I233-H235 PolarHBondContact O-N 3.45Å; I233-Q236 WeakPolarHBondContact O-CB 3.48Å; I233-Q236 PolarHBondContact O-N 3.27Å; I233-I246 HydrophobicContact CG1-CB 4.12Å; I233-I246 HydrophobicContact CG1-CG2 3.85Å; I233-I246 HydrophobicContact CG2-CD1 4.24Å; I233-C247 HydrophobicContact CD1-CB 3.86Å; I233-C247 HydrophobicContact CG1-CB 4.43Å; I233-L273 HydrophobicContact CB-CD1 4.5Å; I233-L273 HydrophobicContact CD1-CD1 4.43Å; I233-L273 HydrophobicContact CG2-CD1 4.22Å; I233-L273 HydrophobicContact CG2-CD2 3.57Å; I233-E296 HydrophobicContact CD1-CB 4.09Å; I233-E296 HydrophobicContact CG2-CB 3.84Å; I233-E296 HydrophobicContact CG2-CG 3.87Å; I233-I297 HydrophobicContact CD1-CD1 4.05Å; I233-I297 HydrophobicContact CD1-CG1 3.47Å; I233-I297 VanDerWaalsContact CD1-CG1 3.47Å
234	N	90.8	Very high	92.7	Very high	67 Å²	67	50.2 Å²	50.2	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-60.9	-27	-178.7	-74	-14.8	0	0	0	113.8	Y181 I230 V231 H232 Q236 S271	Y181-N234 PolarHBondContact OH-ND2 2.74Å; I230-N234 VanDerWaalsContact O-CG 3.22Å; I230-N234 PolarHBondContact O-N 2.87Å; I230-N234 PolarHBondContact O-ND2 3.27Å; V231-N234 PolarHBondContact O-N 3.33Å; H232-N234 PolarHBondContact O-N 3.3Å; N234-Q236 VanDerWaalsContact C-N 3.33Å; N234-S271 PolarHBondContact OD1-OG 3.34Å
235	H	90.2	Very high	92.7	Very high	94 Å²	94	50.3 Å²	50.3	44%	0.435	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	1.9	177.3	-67.1	85	0	0	0	113.2	F134 V231 H232 I233	F134-H235 HydrophobicContact CD1-CB 3.61Å; F134-H235 AromaticContact CD1-CD2 3.53Å; F134-H235 AromaticContact CD1-CG 3.45Å; F134-H235 VanDerWaalsContact CD1-CG 3.45Å; F134-H235 HydrophobicContact CE1-CB 3.13Å; F134-H235 AromaticContact CE1-CD2 3.92Å; F134-H235 AromaticContact CE1-CG 3.57Å; F134-H235 HydrophobicContact CE2-CB 4.22Å; F134-H235 HydrophobicContact CG-CB 4.28Å; F134-H235 AromaticContact CG-CG 3.96Å; F134-H235 HydrophobicContact CZ-CB 3.46Å; F134-H235 VanDerWaalsContact CZ-CB 3.46Å; V231-H235 PolarHBondContact O-N 3.42Å; V231-H235 PolarHBondContact O-ND1 3.3Å; H232-H235 PolarHBondContact O-N 2.9Å; I233-H235 PolarHBondContact O-N 3.45Å
236	Q	89.5	Confident	92.7	Very high	22 Å²	22	50.5 Å²	50.5	10%	0.103	25%	0.247	C	C	.	.	S	Bend	trans	-94.9	155.6	172.3	-59.3	-55.1	-42.1	0	0	111	E131 H232 I233 N234 I246	E131-Q236 PolarHBondContact O-NE2 3.44Å; H232-Q236 WeakPolarHBondContact O-CG 3.34Å; I233-Q236 WeakPolarHBondContact O-CB 3.48Å; I233-Q236 PolarHBondContact O-N 3.27Å; N234-Q236 VanDerWaalsContact C-N 3.33Å; Q236-I246 HydrophobicContact CB-CD1 4.02Å; Q236-I246 HydrophobicContact CG-CG2 4.07Å
237	P	90.5	Very high	92.8	Very high	89 Å²	89	50.4 Å²	50.4	58%	0.578	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-54.3	146.7	168	-24.4	34.1	0	0	0	111.3	R318	P237-R318 PolarHBondContact O-NH2 2.89Å
238	Y	91.9	Very high	93	Very high	217 Å²	217	50.3 Å²	50.3	85%	0.851	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-57.1	156.7	174.7	-64.9	-67	0	0	0	111.9	R318	Y238-R318 PolarHBondContact O-NH1 3.32Å
239	L	91.4	Very high	93.1	Very high	34 Å²	34	50.3 Å²	50.3	18%	0.178	25%	0.246	C	C	.	.	P	Polyproline II helix	trans	-68.1	131.8	177.1	-66.6	179.9	0	0	0	111.8	D243 I246 V295 E296	L239-D243 HydrophobicContact CD2-CB 3.96Å; L239-I246 HydrophobicContact CD2-CD1 3.9Å; L239-I246 HydrophobicContact CD2-CG1 3.98Å; L239-V295 WeakPolarHBondContact CD1-O 3.07Å; L239-E296 HydrophobicContact CD1-CB 4.34Å; L239-E296 HydrophobicContact CD1-CG 3.61Å; L239-E296 WeakPolarHBondContact CD1-OE1 3.09Å; L239-E296 HydrophobicContact CG-CG 3.94Å
240	E	91.8	Very high	93.2	Very high	150 Å²	150	50.3 Å²	50.3	70%	0.701	25%	0.246	S	C	*	.	P	Polyproline II helix	trans	-92.7	168.1	168.5	-61.9	-170.3	173.4	0	0	111.1	G242 D243	E240-G242 PolarHBondContact O-N 2.94Å; E240-D243 PolarHBondContact N-OD2 3.08Å; E240-D243 VanDerWaalsContact O-CB 3.32Å; E240-D243 WeakPolarHBondContact O-CB 3.49Å; E240-D243 PolarHBondContact O-N 3.08Å
241	R	90	Very high	93.1	Very high	254 Å²	254	50.2 Å²	50.2	96%	0.958	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.8	126.6	178.6	-69.5	-179	178.9	-91.9	1.8	110.1
242	G	90.2	Very high	93	Very high	61 Å²	61	50.5 Å²	50.5	63%	0.629	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.5	-2.2	-178.1	0	0	0	0	0	114	E240 N315	E240-G242 PolarHBondContact O-N 2.94Å; G242-N315 PolarHBondContact O-ND2 3.15Å
243	D	92.6	Very high	92.7	Very high	39 Å²	39	50.9 Å²	50.9	21%	0.209	25%	0.25	C	S	.	.			trans	-69.4	142.5	172.2	-79.3	-17.8	0	0	0	112.1	L239 E240 R318	L239-D243 HydrophobicContact CD2-CB 3.96Å; E240-D243 PolarHBondContact N-OD2 3.08Å; E240-D243 VanDerWaalsContact O-CB 3.32Å; E240-D243 WeakPolarHBondContact O-CB 3.49Å; E240-D243 PolarHBondContact O-N 3.08Å; D243-R318 HydrophobicContact CB-CG 4.48Å; D243-R318 WeakPolarHBondContact OD1-CD 3.44Å; D243-R318 WeakPolarHBondContact OD2-CD 3.35Å; D243-R318 IonicContact OD2-CZ 2.76Å; D243-R318 IonicContact OD2-NE 3.38Å; D243-R318 IonicContact OD2-NH1 2.67Å; D243-R318 PolarHBondContact OD2-NH1 2.86Å
244	G	93.2	Very high	92.5	Very high	1 Å²	1	54.1 Å²	54.1	1%	0.01	26%	0.262	C	S	.	.			trans	-82.6	176.9	167.4	0	0	0	0	0	113	N315	G244-N315 VanDerWaalsContact CA-O 3.3Å; G244-N315 WeakPolarHBondContact CA-O 3.46Å
245	P	96.4	Very high	92.4	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.013	25%	0.246	C	C	.	.			trans	-65.6	150.9	179.4	29.7	-36.9	0	0	0	112.8	V295 C298 L316 R318 C319	P245-V295 VanDerWaalsContact CA-O 3.3Å; P245-V295 WeakPolarHBondContact CA-O 3.28Å; P245-C298 HydrophobicContact CB-CB 3.55Å; P245-C298 HydrophobicContact CG-CB 3.58Å; P245-L316 HydrophobicContact CG-CD2 4.04Å; P245-R318 CarbonylContact O-C 3.55Å; P245-C319 VanDerWaalsContact O-CA 3.29Å; P245-C319 WeakPolarHBondContact O-CA 3.38Å; P245-C319 PolarHBondContact O-N 3.31Å
246	I	96.1	Very high	92.3	Very high	3 Å²	3	46.9 Å²	46.9	2%	0.015	23%	0.226	C	C	.	.	S	Bend	trans	-87	-43.5	174.6	-65.2	166.7	0	0	0	109.9	I233 Q236 L239 E296 R318 C319 T320 Y321	I233-I246 HydrophobicContact CG1-CB 4.12Å; I233-I246 HydrophobicContact CG1-CG2 3.85Å; I233-I246 HydrophobicContact CG2-CD1 4.24Å; Q236-I246 HydrophobicContact CB-CD1 4.02Å; Q236-I246 HydrophobicContact CG-CG2 4.07Å; L239-I246 HydrophobicContact CD2-CD1 3.9Å; L239-I246 HydrophobicContact CD2-CG1 3.98Å; I246-E296 PolarHBondContact N-O 3.33Å; I246-R318 WeakPolarHBondContact CA-O 3.33Å; I246-R318 HydrophobicContact CG1-CB 4.5Å; I246-C319 WeakPolarHBondContact O-CA 3.43Å; I246-T320 WeakPolarHBondContact CG2-OG1 3.4Å; I246-T320 PolarHBondContact O-N 3.16Å; I246-Y321 PolarHBondContact O-N 2.93Å; I246-Y321 VanDerWaalsContact O-N 3.16Å
247	C	97.2	Very high	92.5	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	126.4	174.7	177.3	0	0	0	0	110.3	A229 I233 E296 I297 C298 Y321	A229-C247 HydrophobicContact CB-CB 4.4Å; I233-C247 HydrophobicContact CD1-CB 3.86Å; I233-C247 HydrophobicContact CG1-CB 4.43Å; C247-E296 PolarHBondContact N-O 2.78Å; C247-I297 HydrophobicContact CB-CG1 4.27Å; C247-C298 PolarHBondContact O-N 3.03Å; C247-Y321 WeakPolarHBondContact CA-O 3.26Å; C247-Y321 HydrophobicContact CB-CD1 4.46Å
248	L	97.9	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	122	172.6	176.5	63	0	0	0	109.6	L250 C298 A300 L305 L316 Y321 L322 V323 I342 I346	L248-L250 HydrophobicContact CD1-CD2 3.94Å; L248-L250 HydrophobicContact CD2-CD2 4.11Å; L248-L250 HydrophobicContact CD2-CG 4.41Å; L248-L250 HydrophobicContact CG-CD2 3.99Å; L248-L250 HydrophobicContact CG-CG 4.28Å; L248-C298 CarbonylContact C-O 3.39Å; L248-C298 WeakPolarHBondContact CA-O 2.89Å; L248-C298 HydrophobicContact CD1-CB 4.09Å; L248-A300 HydrophobicContact CD1-CB 4.3Å; L248-L305 HydrophobicContact CD1-CD2 3.85Å; L248-L305 HydrophobicContact CD2-CD2 3.87Å; L248-L305 HydrophobicContact CG-CD2 4.47Å; L248-L316 HydrophobicContact CD2-CD1 3.97Å; L248-L316 HydrophobicContact CD2-CD2 3.94Å; L248-Y321 PolarHBondContact N-O 3.15Å; L248-L322 HydrophobicContact CB-CD1 4.2Å; L248-L322 HydrophobicContact CD2-CD1 3.95Å; L248-L322 HydrophobicContact CG-CD1 4.07Å; L248-L322 CarbonylContact O-C 3.5Å; L248-L322 WeakPolarHBondContact O-CA 3.29Å; L248-V323 PolarHBondContact O-N 3.35Å; L248-I342 HydrophobicContact CD2-CG2 4.04Å; L248-I346 HydrophobicContact CD2-CD1 4.17Å
249	V	97.8	Very high	92.5	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	123.4	172.3	-173.7	0	0	0	0	109.1	Y225 V260 C298 I299 A300 V323 D325	Y225-V249 HydrophobicContact CE2-CG1 4.17Å; Y225-V249 HydrophobicContact CE2-CG2 4.31Å; V249-V260 HydrophobicContact CG1-CG1 4.34Å; V249-C298 PolarHBondContact N-O 3.33Å; V249-I299 HydrophobicContact CB-CB 4.41Å; V249-I299 HydrophobicContact CB-CG1 3.9Å; V249-I299 HydrophobicContact CB-CG2 4.27Å; V249-I299 HydrophobicContact CG2-CG1 4.05Å; V249-I299 CarbonylContact O-C 3.49Å; V249-I299 WeakPolarHBondContact O-CA 3.39Å; V249-A300 PolarHBondContact O-N 3Å; V249-V323 CarbonylContact C-O 3.57Å; V249-V323 WeakPolarHBondContact CA-O 3.39Å; V249-V323 HydrophobicContact CB-CB 4.26Å; V249-V323 HydrophobicContact CG1-CB 4.05Å; V249-V323 HydrophobicContact CG1-CG1 4.08Å; V249-V323 HydrophobicContact CG2-CB 4.02Å; V249-V323 HydrophobicContact CG2-CG2 4.22Å; V249-D325 HydrophobicContact CG1-CB 4.46Å
250	L	96	Very high	92.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129.2	175	-59.4	-177.1	0	0	0	110.1	L248 A300 L305 L322 V323 L324 D325 M330 I339 I342	L248-L250 HydrophobicContact CD1-CD2 3.94Å; L248-L250 HydrophobicContact CD2-CD2 4.11Å; L248-L250 HydrophobicContact CD2-CG 4.41Å; L248-L250 HydrophobicContact CG-CD2 3.99Å; L248-L250 HydrophobicContact CG-CG 4.28Å; L250-A300 WeakPolarHBondContact CA-O 3.44Å; L250-A300 HydrophobicContact CD2-CB 4.08Å; L250-L305 HydrophobicContact CD2-CD2 3.69Å; L250-L322 HydrophobicContact CD1-CD1 4.36Å; L250-L322 HydrophobicContact CG-CD1 4.42Å; L250-V323 PolarHBondContact N-O 3.11Å; L250-L324 HydrophobicContact CB-CD2 3.82Å; L250-L324 HydrophobicContact CD1-CD2 3.7Å; L250-L324 HydrophobicContact CG-CD2 4.09Å; L250-D325 PolarHBondContact O-N 2.97Å; L250-M330 HydrophobicContact CB-CE 3.99Å; L250-I339 HydrophobicContact CB-CD1 4.36Å; L250-I339 HydrophobicContact CD1-CD1 3.49Å; L250-I339 VanDerWaalsContact CD1-CD1 3.49Å; L250-I342 HydrophobicContact CD1-CD1 4.17Å; L250-I342 HydrophobicContact CD1-CG2 4.13Å
251	A	92.9	Very high	92.8	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.136	C	C	.	.			trans	-128.2	149.4	178.7	0	0	0	0	0	111.3	L256 A257 A300	A251-L256 HydrophobicContact CB-CB 4.49Å; A251-L256 HydrophobicContact CB-CD2 3.99Å; A251-L256 HydrophobicContact CB-CG 4.02Å; A251-A257 HydrophobicContact CB-CB 4.25Å; A251-A300 PolarHBondContact N-O 3.37Å
252	P	88.8	Confident	93	Very high	14 Å²	14	20.1 Å²	20.1	9%	0.091	11%	0.111	C	C	.	.	S	Bend	trans	-72.7	-30.1	-176.6	25.1	-35.7	0	0	0	114.3	L256 E326 R329 M330 F335	P252-L256 HydrophobicContact CG-CD2 4.29Å; P252-E326 HydrophobicContact CG-CB 3.86Å; P252-E326 HydrophobicContact CG-CG 4.25Å; P252-R329 HydrophobicContact CB-CG 4.42Å; P252-M330 WeakPolarHBondContact CA-SD 3.45Å; P252-M330 HydrophobicContact CB-SD 3.57Å; P252-M330 VanDerWaalsContact CB-SD 3.57Å; P252-M330 HydrophobicContact CG-SD 4.19Å; P252-F335 HydrophobicContact CB-CE2 4.32Å
253	T	88.1	Confident	93.1	Very high	14 Å²	14	19 Å²	19	9%	0.086	9%	0.092	C	C	.	.	S	Bend	trans	-119.9	153.7	-174.1	68.4	0	0	0	0	111.2	E255 L256 A257 T301 V477 R480	T253-E255 VanDerWaalsContact C-N 3.33Å; T253-L256 WeakPolarHBondContact OG1-CB 3.43Å; T253-L256 PolarHBondContact OG1-N 3.37Å; T253-A257 PolarHBondContact O-N 2.96Å; T253-A257 VanDerWaalsContact O-N 3.16Å; T253-T301 WeakPolarHBondContact O-CG2 3.49Å; T253-V477 VanDerWaalsContact CG2-O 3.3Å; T253-V477 WeakPolarHBondContact CG2-O 3.46Å; T253-R480 PolarHBondContact OG1-O 3.46Å
254	R	89.5	Confident	93.2	Very high	76 Å²	76	17.3 Å²	17.3	29%	0.287	8%	0.083	S	C	.	.	H	α-helix	trans	-69.3	-37.8	-177.4	-56.9	173.5	-179.6	170.3	3.1	110.7	A257 Q258 Y279 G280 T301	R254-A257 WeakPolarHBondContact O-CB 3.48Å; R254-A257 PolarHBondContact O-N 3.35Å; R254-Q258 WeakPolarHBondContact O-CG 3.28Å; R254-Q258 PolarHBondContact O-N 3.19Å; R254-Y279 HydrophobicContact CB-CD2 3.9Å; R254-Y279 HydrophobicContact CB-CG 4.28Å; R254-Y279 HydrophobicContact CG-CD2 4.17Å; R254-G280 WeakPolarHBondContact CD-O 3.44Å; R254-G280 VanDerWaalsContact CZ-C 3.45Å; R254-G280 VanDerWaalsContact CZ-O 3.28Å; R254-G280 PolarHBondContact NE-O 3.01Å; R254-G280 VanDerWaalsContact NE-O 3.11Å; R254-G280 PolarHBondContact NH1-O 3.01Å; R254-T301 HydrophobicContact CG-CG2 4.15Å
255	E	87.6	Confident	93.2	Very high	4 Å²	4	19 Å²	19	2%	0.019	9%	0.092	C	C	.	.	H	α-helix	trans	-72	-39.5	-177.4	-61.7	67.4	-149.5	0	0	111.3	T253 Q258 Q259 Q454 R457 L461 L482	T253-E255 VanDerWaalsContact C-N 3.33Å; E255-Q258 PolarHBondContact O-N 3.31Å; E255-Q259 WeakPolarHBondContact O-CB 3.47Å; E255-Q259 PolarHBondContact O-N 3.39Å; E255-Q454 PolarHBondContact OE1-NE2 3.19Å; E255-R457 VanDerWaalsContact CD-CZ 3.4Å; E255-R457 IonicContact OE1-CZ 2.74Å; E255-R457 IonicContact OE1-NE 3.87Å; E255-R457 PolarHBondContact OE1-NE 2.96Å; E255-R457 IonicContact OE1-NH1 3.52Å; E255-R457 PolarHBondContact OE1-NH1 3.47Å; E255-R457 IonicContact OE1-NH2 2.69Å; E255-R457 PolarHBondContact OE1-NH2 3.34Å; E255-R457 IonicContact OE2-CZ 3.76Å; E255-R457 IonicContact OE2-NH1 2.66Å; E255-R457 IonicContact OE2-NH2 2.81Å; E255-R457 PolarHBondContact OE2-NH2 3.3Å; E255-L461 HydrophobicContact CB-CD2 4.05Å; E255-L461 HydrophobicContact CG-CD2 4.04Å; E255-L482 HydrophobicContact CB-CD2 3.61Å; E255-L482 HydrophobicContact CG-CD2 4.44Å
256	L	89.5	Confident	93	Very high	4 Å²	4	21.4 Å²	21.4	2%	0.021	11%	0.105	C	C	.	.	H	α-helix	trans	-63.2	-43.4	171.3	175	58.2	0	0	0	110.9	A251 P252 T253 Q258 Q259 V260 E326 G481	A251-L256 HydrophobicContact CB-CB 4.49Å; A251-L256 HydrophobicContact CB-CD2 3.99Å; A251-L256 HydrophobicContact CB-CG 4.02Å; P252-L256 HydrophobicContact CG-CD2 4.29Å; T253-L256 WeakPolarHBondContact OG1-CB 3.43Å; T253-L256 PolarHBondContact OG1-N 3.37Å; L256-Q258 VanDerWaalsContact C-N 3.32Å; L256-Q258 PolarHBondContact O-N 3.13Å; L256-Q259 PolarHBondContact O-N 3.06Å; L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.38Å; L256-V260 WeakPolarHBondContact O-CG2 3.36Å; L256-V260 PolarHBondContact O-N 2.86Å; L256-E326 HydrophobicContact CD2-CG 3.79Å; L256-G481 WeakPolarHBondContact CD1-O 3.47Å
257	A	92.8	Very high	92.7	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-59.8	-40.7	177.4	0	0	0	0	0	112.4	A251 T253 R254 Q261 C277 I299 T301	A251-A257 HydrophobicContact CB-CB 4.25Å; T253-A257 PolarHBondContact O-N 2.96Å; T253-A257 VanDerWaalsContact O-N 3.16Å; R254-A257 WeakPolarHBondContact O-CB 3.48Å; R254-A257 PolarHBondContact O-N 3.35Å; A257-Q261 WeakPolarHBondContact O-CB 3.09Å; A257-Q261 PolarHBondContact O-N 2.97Å; A257-Q261 VanDerWaalsContact O-N 3.15Å; A257-C277 VanDerWaalsContact CB-SG 3.58Å; A257-C277 PolarHBondContact O-SG 3.24Å; A257-C277 VanDerWaalsContact O-SG 3.37Å; A257-I299 HydrophobicContact CB-CG2 3.98Å; A257-I299 VanDerWaalsContact O-CG2 3.29Å; A257-I299 WeakPolarHBondContact O-CG2 3.21Å; A257-T301 HydrophobicContact CB-CG2 4.24Å
258	Q	92.4	Very high	92.1	Very high	50 Å²	50	21.4 Å²	21.4	23%	0.234	11%	0.105	C	C	.	.	H	α-helix	trans	-66.4	-41.1	175.1	-70.8	176.2	27.2	0	0	111.8	R254 E255 L256 Q261 Q262 C277 Y279 D458	R254-Q258 WeakPolarHBondContact O-CG 3.28Å; R254-Q258 PolarHBondContact O-N 3.19Å; E255-Q258 PolarHBondContact O-N 3.31Å; L256-Q258 VanDerWaalsContact C-N 3.32Å; L256-Q258 PolarHBondContact O-N 3.13Å; Q258-Q261 WeakPolarHBondContact O-CB 3.33Å; Q258-Q261 PolarHBondContact O-N 2.79Å; Q258-Q262 PolarHBondContact O-N 3.07Å; Q258-C277 PolarHBondContact N-SG 3.15Å; Q258-Y279 HydrophobicContact CG-CD1 4.43Å; Q258-Y279 HydrophobicContact CG-CE1 3.96Å; Q258-Y279 VanDerWaalsContact NE2-CE2 3.3Å; Q258-Y279 PolarHBondContact NE2-OH 2.93Å; Q258-D458 PolarHBondContact NE2-OD1 2.72Å
259	Q	91.1	Very high	91.2	Very high	26 Å²	26	27.5 Å²	27.5	12%	0.121	13%	0.132	C	C	.	.	H	α-helix	trans	-64.3	-45.9	179	-175.8	-176.9	-68.8	0	0	112.4	E255 L256 Q261 Q262 V263 G481	E255-Q259 WeakPolarHBondContact O-CB 3.47Å; E255-Q259 PolarHBondContact O-N 3.39Å; L256-Q259 PolarHBondContact O-N 3.06Å; Q259-Q261 PolarHBondContact O-N 2.8Å; Q259-Q262 PolarHBondContact O-N 3Å; Q259-V263 WeakPolarHBondContact O-CG2 3.42Å; Q259-V263 PolarHBondContact O-N 2.98Å; Q259-V263 VanDerWaalsContact O-N 3.08Å; Q259-G481 PolarHBondContact NE2-O 3.33Å
260	V	93.9	Very high	90.3	Very high	1 Å²	1	30.8 Å²	30.8	1%	0.006	15%	0.154	C	C	.	.	H	α-helix	trans	-62.2	-32.7	175.5	177.1	0	0	0	0	110.4	T222 Y225 L226 V249 L256 V263 A264 I299	T222-V260 HydrophobicContact CG2-CG1 4.34Å; T222-V260 HydrophobicContact CG2-CG2 4.29Å; Y225-V260 HydrophobicContact CE2-CG1 4.07Å; Y225-V260 WeakPolarHBondContact OH-CG1 3.45Å; Y225-V260 WeakPolarHBondContact OH-CG2 3.42Å; L226-V260 HydrophobicContact CD1-CG1 4.23Å; L226-V260 HydrophobicContact CD2-CG1 4.34Å; V249-V260 HydrophobicContact CG1-CG1 4.34Å; L256-V260 HydrophobicContact CD1-CG2 3.86Å; L256-V260 HydrophobicContact CG-CG2 4.38Å; L256-V260 WeakPolarHBondContact O-CG2 3.36Å; L256-V260 PolarHBondContact O-N 2.86Å; V260-V263 PolarHBondContact O-N 3.06Å; V260-A264 WeakPolarHBondContact O-CB 3.49Å; V260-A264 PolarHBondContact O-N 3.37Å; V260-I299 HydrophobicContact CB-CD1 4.36Å; V260-I299 HydrophobicContact CB-CG2 4.18Å; V260-I299 HydrophobicContact CG1-CD1 3.86Å; V260-I299 HydrophobicContact CG1-CG1 4.19Å; V260-I299 HydrophobicContact CG1-CG2 4.27Å
261	Q	95.4	Very high	89.4	Confident	34 Å²	34	31.8 Å²	31.8	16%	0.159	16%	0.161	C	C	.	.	H	α-helix	trans	-70.1	-40.9	177.6	-173.9	-85.2	-26.5	0	0	112.3	A257 Q258 Q259 V263 A264 D265 S275 C277 I299	A257-Q261 WeakPolarHBondContact O-CB 3.09Å; A257-Q261 PolarHBondContact O-N 2.97Å; A257-Q261 VanDerWaalsContact O-N 3.15Å; Q258-Q261 WeakPolarHBondContact O-CB 3.33Å; Q258-Q261 PolarHBondContact O-N 2.79Å; Q259-Q261 PolarHBondContact O-N 2.8Å; Q261-V263 VanDerWaalsContact C-N 3.33Å; Q261-V263 PolarHBondContact O-N 2.89Å; Q261-A264 PolarHBondContact O-N 3.3Å; Q261-D265 PolarHBondContact NE2-OD1 3.38Å; Q261-D265 PolarHBondContact NE2-OD2 3.29Å; Q261-D265 PolarHBondContact O-N 3.44Å; Q261-S275 WeakPolarHBondContact CG-OG 3.36Å; Q261-S275 PolarHBondContact NE2-OG 3.36Å; Q261-C277 HydrophobicContact CB-CB 4.01Å; Q261-C277 HydrophobicContact CG-CB 3.96Å; Q261-I299 HydrophobicContact CB-CD1 3.59Å; Q261-I299 HydrophobicContact CG-CD1 4.14Å
262	Q	93.2	Very high	89.1	Confident	94 Å²	94	42.5 Å²	42.5	44%	0.439	20%	0.201	S	C	.	.	H	α-helix	trans	-59.1	-46.4	172.4	-176	59.2	55.4	0	0	111.2	Q258 Q259 A264 D265 D266	Q258-Q262 PolarHBondContact O-N 3.07Å; Q259-Q262 PolarHBondContact O-N 3Å; Q262-A264 PolarHBondContact O-N 3.14Å; Q262-D265 WeakPolarHBondContact O-CB 3.23Å; Q262-D265 PolarHBondContact O-N 3.16Å; Q262-D266 PolarHBondContact NE2-OD1 3.23Å; Q262-D266 PolarHBondContact NE2-OD2 3.05Å; Q262-D266 PolarHBondContact O-N 3.42Å
263	V	92.9	Very high	89.3	Confident	38 Å²	38	42.8 Å²	42.8	23%	0.23	20%	0.202	C	C	.	.	H	α-helix	trans	-61.8	-45.9	176.1	-179.8	0	0	0	0	110.4	T222 L223 L226 Q259 V260 Q261 D265 D266 Y267	T222-V263 HydrophobicContact CG2-CB 4.3Å; T222-V263 HydrophobicContact CG2-CG1 4.11Å; T222-V263 HydrophobicContact CG2-CG2 4.46Å; L223-V263 HydrophobicContact CD2-CG1 3.76Å; L226-V263 HydrophobicContact CD1-CB 4.04Å; L226-V263 HydrophobicContact CD1-CG1 3.7Å; Q259-V263 WeakPolarHBondContact O-CG2 3.42Å; Q259-V263 PolarHBondContact O-N 2.98Å; Q259-V263 VanDerWaalsContact O-N 3.08Å; V260-V263 PolarHBondContact O-N 3.06Å; Q261-V263 VanDerWaalsContact C-N 3.33Å; Q261-V263 PolarHBondContact O-N 2.89Å; V263-D265 VanDerWaalsContact C-N 3.28Å; V263-D265 PolarHBondContact O-N 2.88Å; V263-D266 PolarHBondContact O-N 3.09Å; V263-Y267 HydrophobicContact CG1-CD2 4.13Å; V263-Y267 HydrophobicContact CG1-CE2 4.06Å; V263-Y267 VanDerWaalsContact O-CD2 3.31Å; V263-Y267 WeakPolarHBondContact O-CD2 3.26Å; V263-Y267 PolarHBondContact O-N 3.44Å
264	A	94.7	Very high	89.6	Confident	2 Å²	2	47.1 Å²	47.1	2%	0.017	22%	0.22	C	C	.	.	H	α-helix	trans	-60.1	-37.3	177.8	0	0	0	0	0	112.6	L226 V260 Q261 Q262 G268 I297 I299	L226-A264 HydrophobicContact CD1-CB 4.1Å; L226-A264 HydrophobicContact CD2-CB 4.13Å; V260-A264 WeakPolarHBondContact O-CB 3.49Å; V260-A264 PolarHBondContact O-N 3.37Å; Q261-A264 PolarHBondContact O-N 3.3Å; Q262-A264 PolarHBondContact O-N 3.14Å; A264-G268 WeakPolarHBondContact O-CA 3.17Å; A264-G268 PolarHBondContact O-N 3.39Å; A264-I297 HydrophobicContact CB-CD1 4.43Å; A264-I297 HydrophobicContact CB-CG2 4.32Å; A264-I299 HydrophobicContact CB-CD1 3.97Å
265	D	93.7	Very high	89.9	Confident	37 Å²	37	44.3 Å²	44.3	20%	0.198	21%	0.211	C	C	.	.	H	α-helix	trans	-65.8	-40	175.6	-87.3	-6.9	0	0	0	112.4	Q261 Q262 V263 Y267 G268 K269 S275	Q261-D265 PolarHBondContact NE2-OD1 3.38Å; Q261-D265 PolarHBondContact NE2-OD2 3.29Å; Q261-D265 PolarHBondContact O-N 3.44Å; Q262-D265 WeakPolarHBondContact O-CB 3.23Å; Q262-D265 PolarHBondContact O-N 3.16Å; V263-D265 VanDerWaalsContact C-N 3.28Å; V263-D265 PolarHBondContact O-N 2.88Å; D265-Y267 VanDerWaalsContact C-N 3.3Å; D265-Y267 PolarHBondContact O-N 2.85Å; D265-G268 PolarHBondContact O-N 3.02Å; D265-K269 WeakPolarHBondContact O-CB 3.35Å; D265-K269 VanDerWaalsContact O-CD 3.3Å; D265-K269 WeakPolarHBondContact O-CD 3.25Å; D265-K269 WeakPolarHBondContact O-CG 3.35Å; D265-K269 PolarHBondContact O-N 3.16Å; D265-S275 WeakPolarHBondContact OD1-CB 3.45Å; D265-S275 PolarHBondContact OD1-OG 3.21Å
266	D	91.1	Very high	90.3	Very high	53 Å²	53	44.3 Å²	44.3	28%	0.283	21%	0.212	S	C	.	.	H	α-helix	trans	-64.9	-35.7	-177.2	-64.6	-23.7	0	0	0	112.1	Q262 V263 K269	Q262-D266 PolarHBondContact NE2-OD1 3.23Å; Q262-D266 PolarHBondContact NE2-OD2 3.05Å; Q262-D266 PolarHBondContact O-N 3.42Å; V263-D266 PolarHBondContact O-N 3.09Å; D266-K269 IonicContact OD1-NZ 2.71Å; D266-K269 PolarHBondContact OD1-NZ 3.2Å
267	Y	90.2	Very high	90.6	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-89.1	-25.8	174.3	-67.6	-92.5	0	0	0	113.3	V182 V185 L186 Q189 L223 L227 V263 D265	V182-Y267 HydrophobicContact CG1-CD1 4.16Å; V185-Y267 HydrophobicContact CB-CD1 4.23Å; V185-Y267 HydrophobicContact CB-CE1 4.25Å; V185-Y267 HydrophobicContact CG1-CD1 3.86Å; V185-Y267 HydrophobicContact CG1-CE1 3.73Å; V185-Y267 HydrophobicContact CG1-CE2 4.47Å; V185-Y267 HydrophobicContact CG1-CG 4.36Å; L186-Y267 HydrophobicContact CD2-CE1 3.77Å; L186-Y267 HydrophobicContact CG-CE1 4.06Å; Q189-Y267 PolarHBondContact OE1-OH 3.38Å; L223-Y267 HydrophobicContact CD2-CD2 3.95Å; L223-Y267 HydrophobicContact CD2-CE1 4.32Å; L223-Y267 HydrophobicContact CD2-CE2 3.37Å; L227-Y267 HydrophobicContact CD2-CD1 3.52Å; L227-Y267 HydrophobicContact CD2-CE1 3.87Å; L227-Y267 HydrophobicContact CD2-CG 3.91Å; V263-Y267 HydrophobicContact CG1-CD2 4.13Å; V263-Y267 HydrophobicContact CG1-CE2 4.06Å; V263-Y267 VanDerWaalsContact O-CD2 3.31Å; V263-Y267 WeakPolarHBondContact O-CD2 3.26Å; V263-Y267 PolarHBondContact O-N 3.44Å; D265-Y267 VanDerWaalsContact C-N 3.3Å; D265-Y267 PolarHBondContact O-N 2.85Å
268	G	83.6	Confident	90.8	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.01	22%	0.215	C	C	.	.	H	α-helix	trans	-81.1	-30.3	-177.4	0	0	0	0	0	114.3	A264 D265 C270 S271 R272 L273	A264-G268 WeakPolarHBondContact O-CA 3.17Å; A264-G268 PolarHBondContact O-N 3.39Å; D265-G268 PolarHBondContact O-N 3.02Å; G268-C270 PolarHBondContact O-N 2.68Å; G268-S271 WeakPolarHBondContact O-CB 3.3Å; G268-S271 PolarHBondContact O-N 3.4Å; G268-R272 PolarHBondContact O-N 3.14Å; G268-L273 PolarHBondContact O-N 2.95Å
269	K	80.8	Confident	91	Very high	128 Å²	128	44.1 Å²	44.1	56%	0.557	21%	0.211	S	C	*	.	G	3₁₀ helix	trans	-53.3	-40.3	-179.7	-83.8	161.4	-170.2	158.6	0	112.6	D265 D266 S271 R272	D265-K269 WeakPolarHBondContact O-CB 3.35Å; D265-K269 VanDerWaalsContact O-CD 3.3Å; D265-K269 WeakPolarHBondContact O-CD 3.25Å; D265-K269 WeakPolarHBondContact O-CG 3.35Å; D265-K269 PolarHBondContact O-N 3.16Å; D266-K269 IonicContact OD1-NZ 2.71Å; D266-K269 PolarHBondContact OD1-NZ 3.2Å; K269-S271 VanDerWaalsContact C-N 3.25Å; K269-S271 PolarHBondContact O-N 3.38Å; K269-R272 PolarHBondContact O-N 3.22Å
270	C	77.6	Confident	91	Very high	68 Å²	68	43.5 Å²	43.5	46%	0.459	21%	0.211	S	C	.	.	G	3₁₀ helix	trans	-74.2	-17	-178.6	-50.6	0	0	0	0	113.4	Y181 G268	Y181-C270 HydrophobicContact CD2-CB 3.63Å; Y181-C270 HydrophobicContact CG-CB 3.82Å; G268-C270 PolarHBondContact O-N 2.68Å
271	S	78.6	Confident	90.7	Very high	22 Å²	22	45.8 Å²	45.8	15%	0.154	24%	0.235	C	C	.	.	G	3₁₀ helix	trans	-99.1	-1.4	-179.8	-169.5	0	0	0	0	113.5	Y181 N234 G268 K269 L273	Y181-S271 VanDerWaalsContact CZ-CB 3.42Å; Y181-S271 VanDerWaalsContact OH-CB 3.29Å; Y181-S271 WeakPolarHBondContact OH-CB 3.4Å; Y181-S271 PolarHBondContact OH-OG 3.41Å; N234-S271 PolarHBondContact OD1-OG 3.34Å; G268-S271 WeakPolarHBondContact O-CB 3.3Å; G268-S271 PolarHBondContact O-N 3.4Å; K269-S271 VanDerWaalsContact C-N 3.25Å; K269-S271 PolarHBondContact O-N 3.38Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 WeakPolarHBondContact OG-CG 3.36Å
272	R	86	Confident	90.5	Very high	224 Å²	224	44.9 Å²	44.9	85%	0.845	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.1	16.4	-168.5	-50.3	171.3	59.7	-174.1	-1.4	113.7	G268 K269	G268-R272 PolarHBondContact O-N 3.14Å; K269-R272 PolarHBondContact O-N 3.22Å
273	L	92.4	Very high	90.6	Very high	20 Å²	20	45.2 Å²	45.2	11%	0.105	24%	0.243	C	C	.	.			trans	-75	138.1	174.4	-61.8	-179.7	0	0	0	109.4	I230 I233 G268 S271 E296	I230-L273 HydrophobicContact CB-CD1 4.35Å; I230-L273 HydrophobicContact CG1-CD1 4.14Å; I230-L273 HydrophobicContact CG2-CD1 3.96Å; I233-L273 HydrophobicContact CB-CD1 4.5Å; I233-L273 HydrophobicContact CD1-CD1 4.43Å; I233-L273 HydrophobicContact CG2-CD1 4.22Å; I233-L273 HydrophobicContact CG2-CD2 3.57Å; G268-L273 PolarHBondContact O-N 2.95Å; S271-L273 PolarHBondContact O-N 3.37Å; S271-L273 WeakPolarHBondContact OG-CG 3.36Å; L273-E296 HydrophobicContact CD2-CB 4.14Å; L273-E296 HydrophobicContact CD2-CG 3.82Å
274	K	94	Very high	90.7	Very high	106 Å²	106	47.7 Å²	47.7	46%	0.461	25%	0.251	S	S	.	.			trans	-103.3	134.4	176.3	-61.9	165.3	-175.2	163.8	0	109	G294 V295 E296 I297	K274-G294 VanDerWaalsContact CD-O 3.23Å; K274-G294 WeakPolarHBondContact CD-O 3.46Å; K274-V295 HydrophobicContact CB-CB 4.48Å; K274-V295 HydrophobicContact CB-CG1 4.06Å; K274-E296 PolarHBondContact N-OE2 3.37Å; K274-E296 PolarHBondContact O-N 3.41Å; K274-E296 VanDerWaalsContact O-N 3.1Å; K274-I297 PolarHBondContact O-N 3.47Å
275	S	96	Very high	90.8	Very high	16 Å²	16	49.6 Å²	49.6	11%	0.112	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	156.2	171.4	90.5	0	0	0	0	111	Q261 D265 I297	Q261-S275 WeakPolarHBondContact CG-OG 3.36Å; Q261-S275 PolarHBondContact NE2-OG 3.36Å; D265-S275 WeakPolarHBondContact OD1-CB 3.45Å; D265-S275 PolarHBondContact OD1-OG 3.21Å; S275-I297 VanDerWaalsContact CA-O 3.24Å; S275-I297 WeakPolarHBondContact CA-O 3.47Å
276	T	96.4	Very high	90.9	Very high	5 Å²	5	50.9 Å²	50.9	3%	0.031	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	154.4	170.2	-168.6	0	0	0	0	111	I278 D290 L291 V295 I297 I299	T276-I278 HydrophobicContact CG2-CD1 3.92Å; T276-I278 HydrophobicContact CG2-CG1 4.22Å; T276-D290 HydrophobicContact CG2-CB 4.41Å; T276-D290 WeakPolarHBondContact OG1-CB 3.4Å; T276-D290 PolarHBondContact OG1-OD2 2.89Å; T276-L291 HydrophobicContact CG2-CD2 4.16Å; T276-V295 HydrophobicContact CG2-CB 4.28Å; T276-V295 HydrophobicContact CG2-CG1 4.01Å; T276-V295 HydrophobicContact CG2-CG2 3.79Å; T276-I297 PolarHBondContact N-O 3.39Å; T276-I297 VanDerWaalsContact N-O 3.13Å; T276-I299 PolarHBondContact O-N 3.39Å
277	C	96.9	Very high	91.1	Very high	12 Å²	12	48.9 Å²	48.9	8%	0.081	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	121	178.3	-164.3	0	0	0	0	111.1	A257 Q258 Q261 Y279 I299	A257-C277 VanDerWaalsContact CB-SG 3.58Å; A257-C277 PolarHBondContact O-SG 3.24Å; A257-C277 VanDerWaalsContact O-SG 3.37Å; Q258-C277 PolarHBondContact N-SG 3.15Å; Q261-C277 HydrophobicContact CB-CB 4.01Å; Q261-C277 HydrophobicContact CG-CB 3.96Å; C277-Y279 HydrophobicContact CB-CD1 3.96Å; C277-Y279 HydrophobicContact CB-CE1 3.99Å; C277-Y279 WeakPolarHBondContact O-CD1 3.5Å; C277-Y279 WeakPolarHBondContact SG-CD1 3.5Å; C277-I299 CarbonylContact C-O 3.55Å; C277-I299 VanDerWaalsContact CA-O 3.29Å; C277-I299 WeakPolarHBondContact CA-O 3.45Å
278	I	97	Very high	91.4	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	101.5	-176.6	-56	-56	0	0	0	110.3	T276 Q287 L291 C298 I299 A300 T301 R304 L305 F308	T276-I278 HydrophobicContact CG2-CD1 3.92Å; T276-I278 HydrophobicContact CG2-CG1 4.22Å; I278-Q287 HydrophobicContact CD1-CB 3.85Å; I278-Q287 HydrophobicContact CD1-CG 4.32Å; I278-L291 HydrophobicContact CD1-CD1 3.67Å; I278-L291 HydrophobicContact CD1-CD2 4.14Å; I278-L291 HydrophobicContact CD1-CG 3.87Å; I278-L291 HydrophobicContact CG1-CD1 4.36Å; I278-L291 HydrophobicContact CG1-CD2 4.4Å; I278-C298 VanDerWaalsContact CG1-SG 3.59Å; I278-I299 PolarHBondContact N-O 2.96Å; I278-A300 HydrophobicContact CB-CB 3.82Å; I278-A300 HydrophobicContact CG2-CB 4.39Å; I278-A300 CarbonylContact O-C 3.49Å; I278-A300 VanDerWaalsContact O-CA 3.26Å; I278-A300 WeakPolarHBondContact O-CA 3.41Å; I278-T301 PolarHBondContact O-N 3.13Å; I278-T301 PolarHBondContact O-OG1 3.04Å; I278-R304 HydrophobicContact CG2-CB 4.12Å; I278-R304 HydrophobicContact CG2-CG 3.59Å; I278-L305 HydrophobicContact CG2-CB 4.49Å; I278-F308 HydrophobicContact CD1-CD2 4.3Å; I278-F308 HydrophobicContact CD1-CE2 4.08Å; I278-F308 HydrophobicContact CG2-CD2 3.56Å; I278-F308 HydrophobicContact CG2-CE2 3.77Å
279	Y	94.7	Very high	92	Very high	38 Å²	38	56.6 Å²	56.6	15%	0.149	30%	0.301	C	S	.	.			trans	-147	153.9	-174.2	64.8	-82.6	0	0	0	114.4	R254 Q258 C277 A282 Q287 T301 R304 Q454	R254-Y279 HydrophobicContact CB-CD2 3.9Å; R254-Y279 HydrophobicContact CB-CG 4.28Å; R254-Y279 HydrophobicContact CG-CD2 4.17Å; Q258-Y279 HydrophobicContact CG-CD1 4.43Å; Q258-Y279 HydrophobicContact CG-CE1 3.96Å; Q258-Y279 VanDerWaalsContact NE2-CE2 3.3Å; Q258-Y279 PolarHBondContact NE2-OH 2.93Å; C277-Y279 HydrophobicContact CB-CD1 3.96Å; C277-Y279 HydrophobicContact CB-CE1 3.99Å; C277-Y279 WeakPolarHBondContact O-CD1 3.5Å; C277-Y279 WeakPolarHBondContact SG-CD1 3.5Å; Y279-A282 HydrophobicContact CD2-CB 4.24Å; Y279-A282 HydrophobicContact CE2-CB 3.5Å; Y279-A282 VanDerWaalsContact CE2-CB 3.5Å; Y279-Q287 PolarHBondContact O-NE2 3.31Å; Y279-Q287 PolarHBondContact O-OE1 3.35Å; Y279-T301 WeakPolarHBondContact CA-OG1 3.4Å; Y279-R304 PolarHBondContact O-NH1 3.05Å; Y279-Q454 HydrophobicContact CE2-CG 4.13Å
280	G	92	Very high	92.7	Very high	13 Å²	13	53.1 Å²	53.1	13%	0.134	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.6	163.4	179	0	0	0	0	0	113.5	R254 A282	R254-G280 WeakPolarHBondContact CD-O 3.44Å; R254-G280 VanDerWaalsContact CZ-C 3.45Å; R254-G280 VanDerWaalsContact CZ-O 3.28Å; R254-G280 PolarHBondContact NE-O 3.01Å; R254-G280 VanDerWaalsContact NE-O 3.11Å; R254-G280 PolarHBondContact NH1-O 3.01Å; G280-A282 PolarHBondContact O-N 2.82Å; G280-A282 VanDerWaalsContact O-N 3.13Å
281	G	88.7	Confident	93.5	Very high	48 Å²	48	50.2 Å²	50.2	50%	0.495	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.3	-22	176	0	0	0	0	0	115.7
282	A	91.2	Very high	94.2	Very high	16 Å²	16	55.2 Å²	55.2	13%	0.132	29%	0.289	C	S	.	.	S	Bend	trans	-92	155.1	169.1	0	0	0	0	0	112.2	Y279 G280 R304	Y279-A282 HydrophobicContact CD2-CB 4.24Å; Y279-A282 HydrophobicContact CE2-CB 3.5Å; Y279-A282 VanDerWaalsContact CE2-CB 3.5Å; G280-A282 PolarHBondContact O-N 2.82Å; G280-A282 VanDerWaalsContact O-N 3.13Å; A282-R304 PolarHBondContact O-NH1 3.15Å; A282-R304 PolarHBondContact O-NH2 3.3Å
283	P	94	Very high	94.5	Very high	100 Å²	100	52.4 Å²	52.4	65%	0.649	28%	0.279	S	S	*	.			trans	-55.1	137.5	175.5	-25.1	34.5	0	0	0	112.5	G285	P283-G285 PolarHBondContact O-N 3.48Å
284	K	95.5	Very high	94.5	Very high	90 Å²	90	51.9 Å²	51.9	39%	0.391	28%	0.278	S	S	.	.	H	α-helix	trans	-69	-31.8	-179.4	-67.8	-176.6	173.4	-166.4	0	113.3	Q287 I288 D307 F308	K284-Q287 PolarHBondContact O-N 3.31Å; K284-I288 HydrophobicContact CB-CD1 3.99Å; K284-I288 VanDerWaalsContact O-CG1 3.3Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 2.86Å; K284-D307 WeakPolarHBondContact CE-OD2 3.32Å; K284-D307 IonicContact NZ-OD1 4Å; K284-D307 PolarHBondContact NZ-OD1 3.37Å; K284-D307 IonicContact NZ-OD2 3.91Å; K284-D307 PolarHBondContact NZ-OD2 2.99Å; K284-F308 HydrophobicContact CB-CE1 4.08Å; K284-F308 HydrophobicContact CB-CZ 4.1Å; K284-F308 HydrophobicContact CD-CE1 4.09Å; K284-F308 HydrophobicContact CG-CE1 4Å; K284-F308 HydrophobicContact CG-CZ 4.17Å
285	G	96	Very high	94.5	Very high	43 Å²	43	47.1 Å²	47.1	44%	0.443	26%	0.258	S	S	.	.	H	α-helix	trans	-55.1	-53.8	-170.8	0	0	0	0	0	114.7	P283 Q287 I288 R289	P283-G285 PolarHBondContact O-N 3.48Å; G285-Q287 PolarHBondContact O-N 3.32Å; G285-I288 PolarHBondContact O-N 3.49Å; G285-R289 PolarHBondContact O-N 3.46Å
286	P	95.9	Very high	94.5	Very high	64 Å²	64	47.4 Å²	47.4	42%	0.416	26%	0.258	S	S	.	.	H	α-helix	trans	-59.1	-45.7	176.8	-25.7	35.4	0	0	0	112.9	I288 R289 D290	P286-I288 PolarHBondContact O-N 3.16Å; P286-R289 WeakPolarHBondContact O-CB 3.49Å; P286-R289 PolarHBondContact O-N 3.11Å; P286-R289 VanDerWaalsContact O-N 3.15Å; P286-D290 PolarHBondContact O-N 2.82Å
287	Q	96.5	Very high	94.6	Very high	10 Å²	10	47.2 Å²	47.2	5%	0.047	26%	0.257	C	S	.	.	H	α-helix	trans	-62.2	-41	179.6	-64	177.8	4	0	0	112.4	I278 Y279 K284 G285 D290 L291 F308	I278-Q287 HydrophobicContact CD1-CB 3.85Å; I278-Q287 HydrophobicContact CD1-CG 4.32Å; Y279-Q287 PolarHBondContact O-NE2 3.31Å; Y279-Q287 PolarHBondContact O-OE1 3.35Å; K284-Q287 PolarHBondContact O-N 3.31Å; G285-Q287 PolarHBondContact O-N 3.32Å; Q287-D290 PolarHBondContact O-N 2.88Å; Q287-L291 WeakPolarHBondContact O-CG 3.36Å; Q287-L291 PolarHBondContact O-N 3.33Å; Q287-L291 VanDerWaalsContact O-N 3.12Å; Q287-F308 HydrophobicContact CB-CE2 3.72Å; Q287-F308 HydrophobicContact CB-CZ 3.95Å
288	I	95.6	Very high	94.6	Very high	31 Å²	31	46.7 Å²	46.7	16%	0.159	25%	0.253	C	S	.	.	H	α-helix	trans	-63.2	-44.4	175.1	-69.7	168.1	0	0	0	110.4	K284 G285 P286 D290 L291 E292 F308 K313	K284-I288 HydrophobicContact CB-CD1 3.99Å; K284-I288 VanDerWaalsContact O-CG1 3.3Å; K284-I288 WeakPolarHBondContact O-CG1 3.45Å; K284-I288 PolarHBondContact O-N 2.86Å; G285-I288 PolarHBondContact O-N 3.49Å; P286-I288 PolarHBondContact O-N 3.16Å; I288-D290 VanDerWaalsContact C-N 3.28Å; I288-D290 PolarHBondContact O-N 3.29Å; I288-L291 PolarHBondContact O-N 3.49Å; I288-E292 HydrophobicContact CG2-CG 4.17Å; I288-E292 VanDerWaalsContact CG2-OE1 3.3Å; I288-E292 WeakPolarHBondContact CG2-OE1 3.47Å; I288-E292 WeakPolarHBondContact O-CB 3.47Å; I288-E292 WeakPolarHBondContact O-CG 3.44Å; I288-E292 PolarHBondContact O-N 3.34Å; I288-F308 HydrophobicContact CD1-CE1 3.94Å; I288-F308 HydrophobicContact CD1-CZ 4.43Å; I288-F308 HydrophobicContact CG1-CD1 4.28Å; I288-F308 HydrophobicContact CG1-CE1 3.64Å; I288-F308 HydrophobicContact CG1-CZ 3.79Å; I288-K313 HydrophobicContact CD1-CD 4.32Å; I288-K313 HydrophobicContact CD1-CG 4.25Å; I288-K313 HydrophobicContact CG1-CB 4.38Å; I288-K313 HydrophobicContact CG1-CD 4.43Å; I288-K313 HydrophobicContact CG1-CG 4.17Å; I288-K313 HydrophobicContact CG2-CD 4.11Å
289	R	95.9	Very high	94.6	Very high	135 Å²	135	46.7 Å²	46.7	51%	0.509	25%	0.253	S	S	.	.	H	α-helix	trans	-60.6	-40	179.3	-173.3	-169.4	-60.8	150.3	-1.2	111.7	G285 P286 R293	G285-R289 PolarHBondContact O-N 3.46Å; P286-R289 WeakPolarHBondContact O-CB 3.49Å; P286-R289 PolarHBondContact O-N 3.11Å; P286-R289 VanDerWaalsContact O-N 3.15Å; R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 WeakPolarHBondContact O-CD 3.2Å; R289-R293 WeakPolarHBondContact O-CG 3.49Å; R289-R293 PolarHBondContact O-N 2.82Å
290	D	95.2	Very high	94.8	Very high	54 Å²	54	44.9 Å²	44.9	29%	0.289	25%	0.246	S	C	.	.	H	α-helix	trans	-67.6	-43.4	179	-64.7	-17.8	0	0	0	111	T276 P286 Q287 I288 R293 G294 V295	T276-D290 HydrophobicContact CG2-CB 4.41Å; T276-D290 WeakPolarHBondContact OG1-CB 3.4Å; T276-D290 PolarHBondContact OG1-OD2 2.89Å; P286-D290 PolarHBondContact O-N 2.82Å; Q287-D290 PolarHBondContact O-N 2.88Å; I288-D290 VanDerWaalsContact C-N 3.28Å; I288-D290 PolarHBondContact O-N 3.29Å; D290-R293 PolarHBondContact O-N 3.4Å; D290-G294 PolarHBondContact O-N 3.39Å; D290-V295 WeakPolarHBondContact O-CG1 3.44Å
291	L	94.9	Very high	94.8	Very high	8 Å²	8	44.9 Å²	44.9	4%	0.042	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-44.9	174.5	-69.4	168.4	0	0	0	112.3	T276 I278 Q287 I288 R293 G294 V295 F308 T314	T276-L291 HydrophobicContact CG2-CD2 4.16Å; I278-L291 HydrophobicContact CD1-CD1 3.67Å; I278-L291 HydrophobicContact CD1-CD2 4.14Å; I278-L291 HydrophobicContact CD1-CG 3.87Å; I278-L291 HydrophobicContact CG1-CD1 4.36Å; I278-L291 HydrophobicContact CG1-CD2 4.4Å; Q287-L291 WeakPolarHBondContact O-CG 3.36Å; Q287-L291 PolarHBondContact O-N 3.33Å; Q287-L291 VanDerWaalsContact O-N 3.12Å; I288-L291 PolarHBondContact O-N 3.49Å; L291-R293 VanDerWaalsContact C-N 3.27Å; L291-R293 PolarHBondContact O-N 3.28Å; L291-G294 PolarHBondContact O-N 3.38Å; L291-G294 VanDerWaalsContact O-N 3.08Å; L291-V295 HydrophobicContact CD2-CG2 4Å; L291-F308 HydrophobicContact CD1-CD2 3.63Å; L291-F308 HydrophobicContact CD1-CE2 4.12Å; L291-F308 HydrophobicContact CD1-CG 4.33Å; L291-T314 HydrophobicContact CD1-CG2 4.2Å
292	E	92.6	Very high	95.1	Very high	126 Å²	126	42.7 Å²	42.7	59%	0.589	22%	0.22	S	C	*	.	H	α-helix	trans	-66.6	-27	178.6	-73.8	175.4	177.5	0	0	112.9	I288 G294	I288-E292 HydrophobicContact CG2-CG 4.17Å; I288-E292 VanDerWaalsContact CG2-OE1 3.3Å; I288-E292 WeakPolarHBondContact CG2-OE1 3.47Å; I288-E292 WeakPolarHBondContact O-CB 3.47Å; I288-E292 WeakPolarHBondContact O-CG 3.44Å; I288-E292 PolarHBondContact O-N 3.34Å; E292-G294 PolarHBondContact O-N 3.12Å
293	R	92.6	Very high	95.2	Very high	165 Å²	165	43.4 Å²	43.4	62%	0.623	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-12.2	173.8	-78.9	170.6	172.9	-169.2	-4.2	113.5	R289 D290 L291	R289-R293 WeakPolarHBondContact O-CB 3.43Å; R289-R293 WeakPolarHBondContact O-CD 3.2Å; R289-R293 WeakPolarHBondContact O-CG 3.49Å; R289-R293 PolarHBondContact O-N 2.82Å; D290-R293 PolarHBondContact O-N 3.4Å; L291-R293 VanDerWaalsContact C-N 3.27Å; L291-R293 PolarHBondContact O-N 3.28Å
294	G	92	Very high	95.2	Very high	9 Å²	9	40 Å²	40	9%	0.093	20%	0.204	C	C	.	.			trans	80.1	122.1	-173.8	0	0	0	0	0	111.3	K274 D290 L291 E292	K274-G294 VanDerWaalsContact CD-O 3.23Å; K274-G294 WeakPolarHBondContact CD-O 3.46Å; D290-G294 PolarHBondContact O-N 3.39Å; L291-G294 PolarHBondContact O-N 3.38Å; L291-G294 VanDerWaalsContact O-N 3.08Å; E292-G294 PolarHBondContact O-N 3.12Å
295	V	95.6	Very high	95.2	Very high	6 Å²	6	35.8 Å²	35.8	4%	0.036	19%	0.186	C	C	.	.			trans	-131.6	132.7	177.6	-70.3	0	0	0	0	109	L239 P245 K274 T276 D290 L291	L239-V295 WeakPolarHBondContact CD1-O 3.07Å; P245-V295 VanDerWaalsContact CA-O 3.3Å; P245-V295 WeakPolarHBondContact CA-O 3.28Å; K274-V295 HydrophobicContact CB-CB 4.48Å; K274-V295 HydrophobicContact CB-CG1 4.06Å; T276-V295 HydrophobicContact CG2-CB 4.28Å; T276-V295 HydrophobicContact CG2-CG1 4.01Å; T276-V295 HydrophobicContact CG2-CG2 3.79Å; D290-V295 WeakPolarHBondContact O-CG1 3.44Å; L291-V295 HydrophobicContact CD2-CG2 4Å
296	E	96	Very high	95.2	Very high	22 Å²	22	33.8 Å²	33.8	10%	0.103	17%	0.165	C	C	.	.	S	Bend	trans	-78.3	-35.7	178.4	-65.5	79.2	-173.4	0	0	111.3	I233 L239 I246 C247 L273 K274	I233-E296 HydrophobicContact CD1-CB 4.09Å; I233-E296 HydrophobicContact CG2-CB 3.84Å; I233-E296 HydrophobicContact CG2-CG 3.87Å; L239-E296 HydrophobicContact CD1-CB 4.34Å; L239-E296 HydrophobicContact CD1-CG 3.61Å; L239-E296 WeakPolarHBondContact CD1-OE1 3.09Å; L239-E296 HydrophobicContact CG-CG 3.94Å; I246-E296 PolarHBondContact N-O 3.33Å; C247-E296 PolarHBondContact N-O 2.78Å; L273-E296 HydrophobicContact CD2-CB 4.14Å; L273-E296 HydrophobicContact CD2-CG 3.82Å; K274-E296 PolarHBondContact N-OE2 3.37Å; K274-E296 PolarHBondContact O-N 3.41Å; K274-E296 VanDerWaalsContact O-N 3.1Å
297	I	97.2	Very high	95.1	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	117.5	-178.9	-57.1	173.7	0	0	0	109.6	I233 C247 A264 K274 S275 T276 I299	I233-I297 HydrophobicContact CD1-CD1 4.05Å; I233-I297 HydrophobicContact CD1-CG1 3.47Å; I233-I297 VanDerWaalsContact CD1-CG1 3.47Å; C247-I297 HydrophobicContact CB-CG1 4.27Å; A264-I297 HydrophobicContact CB-CD1 4.43Å; A264-I297 HydrophobicContact CB-CG2 4.32Å; K274-I297 PolarHBondContact O-N 3.47Å; S275-I297 VanDerWaalsContact CA-O 3.24Å; S275-I297 WeakPolarHBondContact CA-O 3.47Å; T276-I297 PolarHBondContact N-O 3.39Å; T276-I297 VanDerWaalsContact N-O 3.13Å; I297-I299 HydrophobicContact CG2-CD1 4.09Å; I297-I299 HydrophobicContact CG2-CG1 4.1Å
298	C	97.6	Very high	95.1	Very high	1 Å²	1	32.7 Å²	32.7	1%	0.007	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	124.3	172.7	-177	0	0	0	0	109.6	P245 C247 L248 V249 I278	P245-C298 HydrophobicContact CB-CB 3.55Å; P245-C298 HydrophobicContact CG-CB 3.58Å; C247-C298 PolarHBondContact O-N 3.03Å; L248-C298 CarbonylContact C-O 3.39Å; L248-C298 WeakPolarHBondContact CA-O 2.89Å; L248-C298 HydrophobicContact CD1-CB 4.09Å; V249-C298 PolarHBondContact N-O 3.33Å; I278-C298 VanDerWaalsContact CG1-SG 3.59Å
299	I	97.6	Very high	95	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	125.9	175.8	-60.8	150.4	0	0	0	107.4	V249 A257 V260 Q261 A264 T276 C277 I278 I297	V249-I299 HydrophobicContact CB-CB 4.41Å; V249-I299 HydrophobicContact CB-CG1 3.9Å; V249-I299 HydrophobicContact CB-CG2 4.27Å; V249-I299 HydrophobicContact CG2-CG1 4.05Å; V249-I299 CarbonylContact O-C 3.49Å; V249-I299 WeakPolarHBondContact O-CA 3.39Å; A257-I299 HydrophobicContact CB-CG2 3.98Å; A257-I299 VanDerWaalsContact O-CG2 3.29Å; A257-I299 WeakPolarHBondContact O-CG2 3.21Å; V260-I299 HydrophobicContact CB-CD1 4.36Å; V260-I299 HydrophobicContact CB-CG2 4.18Å; V260-I299 HydrophobicContact CG1-CD1 3.86Å; V260-I299 HydrophobicContact CG1-CG1 4.19Å; V260-I299 HydrophobicContact CG1-CG2 4.27Å; Q261-I299 HydrophobicContact CB-CD1 3.59Å; Q261-I299 HydrophobicContact CG-CD1 4.14Å; A264-I299 HydrophobicContact CB-CD1 3.97Å; T276-I299 PolarHBondContact O-N 3.39Å; C277-I299 CarbonylContact C-O 3.55Å; C277-I299 VanDerWaalsContact CA-O 3.29Å; C277-I299 WeakPolarHBondContact CA-O 3.45Å; I278-I299 PolarHBondContact N-O 2.96Å; I297-I299 HydrophobicContact CG2-CD1 4.09Å; I297-I299 HydrophobicContact CG2-CG1 4.1Å
300	A	97.1	Very high	94.9	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.2	148.7	-165.8	0	0	0	0	0	114.4	L248 V249 L250 A251 I278 L305	L248-A300 HydrophobicContact CD1-CB 4.3Å; V249-A300 PolarHBondContact O-N 3Å; L250-A300 WeakPolarHBondContact CA-O 3.44Å; L250-A300 HydrophobicContact CD2-CB 4.08Å; A251-A300 PolarHBondContact N-O 3.37Å; I278-A300 HydrophobicContact CB-CB 3.82Å; I278-A300 HydrophobicContact CG2-CB 4.39Å; I278-A300 CarbonylContact O-C 3.49Å; I278-A300 VanDerWaalsContact O-CA 3.26Å; I278-A300 WeakPolarHBondContact O-CA 3.41Å; A300-L305 HydrophobicContact CB-CB 4Å; A300-L305 HydrophobicContact CB-CD1 4.49Å; A300-L305 HydrophobicContact CB-CD2 4.03Å; A300-L305 HydrophobicContact CB-CG 4.41Å
301	T	94	Very high	94.6	Very high	13 Å²	13	29.3 Å²	29.3	8%	0.08	15%	0.15	C	C	.	.			trans	-89.1	138.1	159.7	60.4	0	0	0	0	109.2	T253 R254 A257 I278 Y279 G303 R304 L305	T253-T301 WeakPolarHBondContact O-CG2 3.49Å; R254-T301 HydrophobicContact CG-CG2 4.15Å; A257-T301 HydrophobicContact CB-CG2 4.24Å; I278-T301 PolarHBondContact O-N 3.13Å; I278-T301 PolarHBondContact O-OG1 3.04Å; Y279-T301 WeakPolarHBondContact CA-OG1 3.4Å; T301-G303 PolarHBondContact O-N 2.94Å; T301-R304 PolarHBondContact O-N 2.88Å; T301-L305 PolarHBondContact O-N 2.99Å
302	P	93.3	Very high	94.5	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.006	18%	0.179	C	C	.	.	H	α-helix	trans	-54.3	-45.6	-168.4	-30.3	35.9	0	0	0	114.7	R304 L305 I306 M330 F335 Q338 I339 I342	P302-R304 PolarHBondContact O-N 2.9Å; P302-L305 PolarHBondContact O-N 2.79Å; P302-I306 WeakPolarHBondContact O-CG1 3.38Å; P302-I306 PolarHBondContact O-N 2.68Å; P302-M330 HydrophobicContact CG-CE 3.31Å; P302-F335 HydrophobicContact CG-CD1 4.4Å; P302-Q338 HydrophobicContact CB-CB 3.88Å; P302-I339 HydrophobicContact CG-CD1 3.91Å; P302-I342 HydrophobicContact CB-CD1 3.71Å; P302-I342 HydrophobicContact CG-CD1 4.49Å
303	G	93.2	Very high	94.5	Very high	32 Å²	32	29.8 Å²	29.8	33%	0.33	17%	0.168	S	C	.	.	H	α-helix	trans	-60.2	-43.2	-174.5	0	0	0	0	0	114.4	T301 D307	T301-G303 PolarHBondContact O-N 2.94Å; G303-D307 PolarHBondContact O-N 3.13Å
304	R	94.6	Very high	94.5	Very high	29 Å²	29	22.7 Å²	22.7	11%	0.109	14%	0.142	C	C	.	.	H	α-helix	trans	-74.9	-33.5	178.7	179.7	60.3	67.3	81.5	-3.7	111.8	I278 Y279 A282 T301 P302 D307 F308	I278-R304 HydrophobicContact CG2-CB 4.12Å; I278-R304 HydrophobicContact CG2-CG 3.59Å; Y279-R304 PolarHBondContact O-NH1 3.05Å; A282-R304 PolarHBondContact O-NH1 3.15Å; A282-R304 PolarHBondContact O-NH2 3.3Å; T301-R304 PolarHBondContact O-N 2.88Å; P302-R304 PolarHBondContact O-N 2.9Å; R304-D307 WeakPolarHBondContact O-CB 3.39Å; R304-D307 PolarHBondContact O-N 2.77Å; R304-F308 HydrophobicContact CG-CD2 4.27Å; R304-F308 HydrophobicContact CG-CE2 3.92Å; R304-F308 HydrophobicContact CG-CZ 4.26Å; R304-F308 PolarHBondContact O-N 3.2Å; R304-F308 VanDerWaalsContact O-N 3.16Å
305	L	96.4	Very high	94.6	Very high	1 Å²	1	24.2 Å²	24.2	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-63.5	-45.1	175.4	-177.4	60.8	0	0	0	111.3	L248 L250 I278 A300 T301 P302 D307 F308 L309 T314 I342	L248-L305 HydrophobicContact CD1-CD2 3.85Å; L248-L305 HydrophobicContact CD2-CD2 3.87Å; L248-L305 HydrophobicContact CG-CD2 4.47Å; L250-L305 HydrophobicContact CD2-CD2 3.69Å; I278-L305 HydrophobicContact CG2-CB 4.49Å; A300-L305 HydrophobicContact CB-CB 4Å; A300-L305 HydrophobicContact CB-CD1 4.49Å; A300-L305 HydrophobicContact CB-CD2 4.03Å; A300-L305 HydrophobicContact CB-CG 4.41Å; T301-L305 PolarHBondContact O-N 2.99Å; P302-L305 PolarHBondContact O-N 2.79Å; L305-D307 VanDerWaalsContact C-N 3.31Å; L305-D307 PolarHBondContact O-N 3.43Å; L305-F308 PolarHBondContact O-N 3.2Å; L305-F308 VanDerWaalsContact O-N 3.14Å; L305-L309 HydrophobicContact CD1-CD1 4.43Å; L305-L309 HydrophobicContact CD1-CG 4.36Å; L305-L309 HydrophobicContact CG-CD1 3.99Å; L305-L309 HydrophobicContact CG-CG 4.36Å; L305-L309 WeakPolarHBondContact O-CG 3.33Å; L305-L309 PolarHBondContact O-N 2.85Å; L305-T314 HydrophobicContact CD1-CG2 4.24Å; L305-I342 HydrophobicContact CD2-CD1 4.07Å; L305-I342 HydrophobicContact CD2-CG1 4.27Å; L305-I342 HydrophobicContact CD2-CG2 3.82Å
306	I	95	Very high	94.6	Very high	1 Å²	1	24.1 Å²	24.1	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-56.3	-45.7	176.3	-72.6	167.8	0	0	0	111.3	P113 G114 L117 P302 F308 L309 E310 Q338 I342	P113-I306 HydrophobicContact CB-CG2 4.49Å; G114-I306 VanDerWaalsContact CA-CG2 3.41Å; L117-I306 HydrophobicContact CD1-CG2 3.93Å; P302-I306 WeakPolarHBondContact O-CG1 3.38Å; P302-I306 PolarHBondContact O-N 2.68Å; I306-F308 VanDerWaalsContact C-N 3.33Å; I306-F308 PolarHBondContact O-N 3.22Å; I306-L309 PolarHBondContact O-N 3.18Å; I306-E310 HydrophobicContact CG2-CG 4.49Å; I306-E310 WeakPolarHBondContact O-CB 3.05Å; I306-E310 WeakPolarHBondContact O-CG 3.25Å; I306-E310 PolarHBondContact O-N 3.21Å; I306-Q338 HydrophobicContact CD1-CB 3.66Å; I306-Q338 HydrophobicContact CD1-CG 4.02Å; I306-I342 HydrophobicContact CD1-CD1 4.21Å; I306-I342 HydrophobicContact CD1-CG1 4.18Å; I306-I342 HydrophobicContact CG1-CD1 3.96Å; I306-I342 HydrophobicContact CG1-CG1 3.64Å
307	D	95	Very high	94.4	Very high	50 Å²	50	30.4 Å²	30.4	27%	0.267	17%	0.171	S	C	.	.	H	α-helix	trans	-58.1	-42.4	176.8	179.3	0.7	0	0	0	112	K284 G303 R304 L305 S311	K284-D307 WeakPolarHBondContact CE-OD2 3.32Å; K284-D307 IonicContact NZ-OD1 4Å; K284-D307 PolarHBondContact NZ-OD1 3.37Å; K284-D307 IonicContact NZ-OD2 3.91Å; K284-D307 PolarHBondContact NZ-OD2 2.99Å; G303-D307 PolarHBondContact O-N 3.13Å; R304-D307 WeakPolarHBondContact O-CB 3.39Å; R304-D307 PolarHBondContact O-N 2.77Å; L305-D307 VanDerWaalsContact C-N 3.31Å; L305-D307 PolarHBondContact O-N 3.43Å; D307-S311 WeakPolarHBondContact O-CB 3.5Å; D307-S311 PolarHBondContact O-N 3.02Å; D307-S311 PolarHBondContact O-OG 2.65Å
308	F	95.4	Very high	94.2	Very high	1 Å²	1	32.3 Å²	32.3	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-73.3	-30.6	176.4	-71	-19.8	0	0	0	114.3	I278 K284 Q287 I288 L291 R304 L305 I306 G312 K313 T314	I278-F308 HydrophobicContact CD1-CD2 4.3Å; I278-F308 HydrophobicContact CD1-CE2 4.08Å; I278-F308 HydrophobicContact CG2-CD2 3.56Å; I278-F308 HydrophobicContact CG2-CE2 3.77Å; K284-F308 HydrophobicContact CB-CE1 4.08Å; K284-F308 HydrophobicContact CB-CZ 4.1Å; K284-F308 HydrophobicContact CD-CE1 4.09Å; K284-F308 HydrophobicContact CG-CE1 4Å; K284-F308 HydrophobicContact CG-CZ 4.17Å; Q287-F308 HydrophobicContact CB-CE2 3.72Å; Q287-F308 HydrophobicContact CB-CZ 3.95Å; I288-F308 HydrophobicContact CD1-CE1 3.94Å; I288-F308 HydrophobicContact CD1-CZ 4.43Å; I288-F308 HydrophobicContact CG1-CD1 4.28Å; I288-F308 HydrophobicContact CG1-CE1 3.64Å; I288-F308 HydrophobicContact CG1-CZ 3.79Å; L291-F308 HydrophobicContact CD1-CD2 3.63Å; L291-F308 HydrophobicContact CD1-CE2 4.12Å; L291-F308 HydrophobicContact CD1-CG 4.33Å; R304-F308 HydrophobicContact CG-CD2 4.27Å; R304-F308 HydrophobicContact CG-CE2 3.92Å; R304-F308 HydrophobicContact CG-CZ 4.26Å; R304-F308 PolarHBondContact O-N 3.2Å; R304-F308 VanDerWaalsContact O-N 3.16Å; L305-F308 PolarHBondContact O-N 3.2Å; L305-F308 VanDerWaalsContact O-N 3.14Å; I306-F308 VanDerWaalsContact C-N 3.33Å; I306-F308 PolarHBondContact O-N 3.22Å; F308-G312 PolarHBondContact O-N 3.29Å; F308-K313 HydrophobicContact CB-CB 4.1Å; F308-K313 HydrophobicContact CD1-CB 4.21Å; F308-K313 HydrophobicContact CD1-CG 4.21Å; F308-K313 HydrophobicContact CG-CB 4.28Å; F308-K313 PolarHBondContact O-N 3.46Å; F308-T314 HydrophobicContact CB-CG2 4.19Å; F308-T314 PolarHBondContact O-N 3.28Å
309	L	94.5	Very high	94.1	Very high	20 Å²	20	32.3 Å²	32.3	11%	0.105	18%	0.178	C	C	.	.	H	α-helix	trans	-70	-43	171.7	-67.7	170.5	0	0	0	111.2	L117 L305 I306 S311 G312 T314 L316 I342	L117-L309 HydrophobicContact CD1-CB 4.31Å; L117-L309 HydrophobicContact CD2-CB 4.1Å; L305-L309 HydrophobicContact CD1-CD1 4.43Å; L305-L309 HydrophobicContact CD1-CG 4.36Å; L305-L309 HydrophobicContact CG-CD1 3.99Å; L305-L309 HydrophobicContact CG-CG 4.36Å; L305-L309 WeakPolarHBondContact O-CG 3.33Å; L305-L309 PolarHBondContact O-N 2.85Å; I306-L309 PolarHBondContact O-N 3.18Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.12Å; L309-G312 PolarHBondContact O-N 2.93Å; L309-T314 HydrophobicContact CD2-CG2 3.9Å; L309-T314 HydrophobicContact CG-CG2 4.44Å; L309-L316 HydrophobicContact CD1-CD1 3.93Å; L309-L316 HydrophobicContact CD2-CD1 4.2Å; L309-L316 HydrophobicContact CD2-CG 3.89Å; L309-I342 HydrophobicContact CD1-CG1 4.47Å
310	E	92.1	Very high	94	Very high	70 Å²	70	32.5 Å²	32.5	33%	0.327	18%	0.179	S	C	.	.	H	α-helix	trans	-62.6	-38.9	177.1	-81.8	-169.5	144.5	0	0	112.7	G114 E115 R116 L117 I306 G312	G114-E310 VanDerWaalsContact CA-CD 3.5Å; G114-E310 WeakPolarHBondContact CA-OE1 3.1Å; G114-E310 PolarHBondContact N-OE1 2.65Å; G114-E310 VanDerWaalsContact N-OE1 3.16Å; E115-E310 PolarHBondContact N-OE1 3.11Å; R116-E310 HydrophobicContact CB-CG 4.42Å; R116-E310 WeakPolarHBondContact CB-OE1 3.27Å; R116-E310 PolarHBondContact N-OE1 3.25Å; L117-E310 HydrophobicContact CD1-CG 3.95Å; L117-E310 HydrophobicContact CD2-CG 3.91Å; L117-E310 HydrophobicContact CG-CG 3.5Å; L117-E310 VanDerWaalsContact CG-CG 3.5Å; I306-E310 HydrophobicContact CG2-CG 4.49Å; I306-E310 WeakPolarHBondContact O-CB 3.05Å; I306-E310 WeakPolarHBondContact O-CG 3.25Å; I306-E310 PolarHBondContact O-N 3.21Å; E310-G312 VanDerWaalsContact C-N 3.3Å
311	S	90.8	Very high	94	Very high	58 Å²	58	32.5 Å²	32.5	41%	0.406	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	3.2	179.8	55	0	0	0	0	113.9	D307 L309 K313	D307-S311 WeakPolarHBondContact O-CB 3.5Å; D307-S311 PolarHBondContact O-N 3.02Å; D307-S311 PolarHBondContact O-OG 2.65Å; L309-S311 VanDerWaalsContact C-N 3.32Å; L309-S311 PolarHBondContact O-N 3.12Å; S311-K313 PolarHBondContact O-N 3.16Å; S311-K313 WeakPolarHBondContact OG-CG 3.35Å
312	G	91.4	Very high	94.1	Very high	63 Å²	63	31.9 Å²	31.9	65%	0.649	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	64.8	24.1	178.1	0	0	0	0	0	114.2	F308 L309 E310 T314	F308-G312 PolarHBondContact O-N 3.29Å; L309-G312 PolarHBondContact O-N 2.93Å; E310-G312 VanDerWaalsContact C-N 3.3Å; G312-T314 VanDerWaalsContact C-N 3.32Å
313	K	92.8	Very high	94.3	Very high	82 Å²	82	31.9 Å²	31.9	36%	0.357	18%	0.175	S	C	.	.	S	Bend	trans	-77.7	-21.4	177.3	-58.7	-57.2	-178.7	-177.3	0	112.7	I288 F308 S311	I288-K313 HydrophobicContact CD1-CD 4.32Å; I288-K313 HydrophobicContact CD1-CG 4.25Å; I288-K313 HydrophobicContact CG1-CB 4.38Å; I288-K313 HydrophobicContact CG1-CD 4.43Å; I288-K313 HydrophobicContact CG1-CG 4.17Å; I288-K313 HydrophobicContact CG2-CD 4.11Å; F308-K313 HydrophobicContact CB-CB 4.1Å; F308-K313 HydrophobicContact CD1-CB 4.21Å; F308-K313 HydrophobicContact CD1-CG 4.21Å; F308-K313 HydrophobicContact CG-CB 4.28Å; F308-K313 PolarHBondContact O-N 3.46Å; S311-K313 PolarHBondContact O-N 3.16Å; S311-K313 WeakPolarHBondContact OG-CG 3.35Å
314	T	93.8	Very high	94.4	Very high	15 Å²	15	30.3 Å²	30.3	9%	0.092	16%	0.159	C	C	.	.			trans	-147.1	171.3	168.4	-170.2	0	0	0	0	109.6	L291 L305 F308 L309 G312	L291-T314 HydrophobicContact CD1-CG2 4.2Å; L305-T314 HydrophobicContact CD1-CG2 4.24Å; F308-T314 HydrophobicContact CB-CG2 4.19Å; F308-T314 PolarHBondContact O-N 3.28Å; L309-T314 HydrophobicContact CD2-CG2 3.9Å; L309-T314 HydrophobicContact CG-CG2 4.44Å; G312-T314 VanDerWaalsContact C-N 3.32Å
315	N	93.7	Very high	94.4	Very high	42 Å²	42	29.2 Å²	29.2	23%	0.225	16%	0.155	C	C	.	.			trans	-140.7	163.4	174.8	66.6	82.8	0	0	0	109.4	G242 G244 R317	G242-N315 PolarHBondContact O-ND2 3.15Å; G244-N315 VanDerWaalsContact CA-O 3.3Å; G244-N315 WeakPolarHBondContact CA-O 3.46Å; N315-R317 HydrophobicContact CB-CG 4.36Å; N315-R317 WeakPolarHBondContact OD1-CB 3.47Å; N315-R317 WeakPolarHBondContact OD1-CG 3.33Å; N315-R317 PolarHBondContact OD1-N 3.36Å
316	L	94.8	Very high	94.1	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.021	16%	0.157	C	C	.	.			trans	-115.5	29.1	179.2	-60	174.8	0	0	0	112.1	P245 L248 L309 R318 C319 I342 Q345 I346	P245-L316 HydrophobicContact CG-CD2 4.04Å; L248-L316 HydrophobicContact CD2-CD1 3.97Å; L248-L316 HydrophobicContact CD2-CD2 3.94Å; L309-L316 HydrophobicContact CD1-CD1 3.93Å; L309-L316 HydrophobicContact CD2-CD1 4.2Å; L309-L316 HydrophobicContact CD2-CG 3.89Å; L316-R318 VanDerWaalsContact C-N 3.29Å; L316-R318 PolarHBondContact O-N 3.01Å; L316-C319 HydrophobicContact CB-CB 4.01Å; L316-C319 HydrophobicContact CD2-CB 4.21Å; L316-C319 PolarHBondContact O-N 3.36Å; L316-I342 HydrophobicContact CD1-CG2 3.83Å; L316-Q345 WeakPolarHBondContact CB-O 3.31Å; L316-Q345 HydrophobicContact CD1-CB 4.49Å; L316-I346 HydrophobicContact CB-CG1 3.93Å; L316-I346 HydrophobicContact CD1-CD1 4.07Å; L316-I346 HydrophobicContact CD1-CG1 3.6Å; L316-I346 HydrophobicContact CG-CG1 4.35Å
317	R	91.9	Very high	93.8	Very high	153 Å²	153	29.6 Å²	29.6	58%	0.577	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-33.5	-178.9	-62.3	-179.9	-176	-163.9	2.7	112.2	W122 N315	W122-R317 HydrophobicContact CH2-CG 4.45Å; N315-R317 HydrophobicContact CB-CG 4.36Å; N315-R317 WeakPolarHBondContact OD1-CB 3.47Å; N315-R317 WeakPolarHBondContact OD1-CG 3.33Å; N315-R317 PolarHBondContact OD1-N 3.36Å
318	R	92.9	Very high	93.4	Very high	43 Å²	43	27.6 Å²	27.6	16%	0.162	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-1	179	-68.1	-156.5	63.3	-179.2	-5.8	114.2	P237 Y238 D243 P245 I246 L316 T320	P237-R318 PolarHBondContact O-NH2 2.89Å; Y238-R318 PolarHBondContact O-NH1 3.32Å; D243-R318 HydrophobicContact CB-CG 4.48Å; D243-R318 WeakPolarHBondContact OD1-CD 3.44Å; D243-R318 WeakPolarHBondContact OD2-CD 3.35Å; D243-R318 IonicContact OD2-CZ 2.76Å; D243-R318 IonicContact OD2-NE 3.38Å; D243-R318 IonicContact OD2-NH1 2.67Å; D243-R318 PolarHBondContact OD2-NH1 2.86Å; P245-R318 CarbonylContact O-C 3.55Å; I246-R318 WeakPolarHBondContact CA-O 3.33Å; I246-R318 HydrophobicContact CG1-CB 4.5Å; L316-R318 VanDerWaalsContact C-N 3.29Å; L316-R318 PolarHBondContact O-N 3.01Å; R318-T320 PolarHBondContact O-N 3.23Å
319	C	95.5	Very high	92.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.151	C	C	.	.			trans	-71.8	107.8	-179.2	-178.7	0	0	0	0	109.5	P245 I246 L316 I346 R347	P245-C319 VanDerWaalsContact O-CA 3.29Å; P245-C319 WeakPolarHBondContact O-CA 3.38Å; P245-C319 PolarHBondContact O-N 3.31Å; I246-C319 WeakPolarHBondContact O-CA 3.43Å; L316-C319 HydrophobicContact CB-CB 4.01Å; L316-C319 HydrophobicContact CD2-CB 4.21Å; L316-C319 PolarHBondContact O-N 3.36Å; C319-I346 HydrophobicContact CB-CG2 3.96Å; C319-I346 WeakPolarHBondContact O-CG2 3.32Å; C319-R347 WeakPolarHBondContact O-CG 3.43Å
320	T	95.5	Very high	92.3	Very high	4 Å²	4	28 Å²	28	3%	0.025	15%	0.146	C	C	.	.			trans	-113.5	-15.7	-179.7	50.1	0	0	0	0	112.3	F130 H232 I246 R318 Q351	F130-T320 HydrophobicContact CB-CG2 4.45Å; F130-T320 HydrophobicContact CD1-CG2 3.75Å; F130-T320 HydrophobicContact CD2-CG2 3.7Å; F130-T320 HydrophobicContact CE1-CG2 3.73Å; F130-T320 HydrophobicContact CE2-CG2 3.69Å; F130-T320 HydrophobicContact CG-CG2 3.72Å; F130-T320 HydrophobicContact CZ-CG2 3.67Å; H232-T320 PolarHBondContact NE2-OG1 3.31Å; I246-T320 WeakPolarHBondContact CG2-OG1 3.4Å; I246-T320 PolarHBondContact O-N 3.16Å; R318-T320 PolarHBondContact O-N 3.23Å; T320-Q351 PolarHBondContact O-N 2.71Å
321	Y	97	Very high	91.8	Very high	1 Å²	1	25 Å²	25	0%	0.004	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	108.4	179.8	-167	-85	0	0	0	108.8	Y225 A229 H232 I246 C247 L248 V323 Q351 L353	Y225-Y321 PolarHBondContact O-OH 2.79Å; Y225-Y321 VanDerWaalsContact O-OH 3.05Å; A229-Y321 HydrophobicContact CB-CD1 3.88Å; A229-Y321 HydrophobicContact CB-CE1 3.61Å; H232-Y321 HydrophobicContact CB-CD2 4.19Å; H232-Y321 AromaticContact CG-CD2 3.98Å; I246-Y321 PolarHBondContact O-N 2.93Å; I246-Y321 VanDerWaalsContact O-N 3.16Å; C247-Y321 WeakPolarHBondContact CA-O 3.26Å; C247-Y321 HydrophobicContact CB-CD1 4.46Å; L248-Y321 PolarHBondContact N-O 3.15Å; Y321-V323 HydrophobicContact CD1-CG2 3.77Å; Y321-V323 HydrophobicContact CE1-CG2 3.33Å; Y321-Q351 VanDerWaalsContact CD2-OE1 3.29Å; Y321-L353 HydrophobicContact CD1-CD1 4.08Å; Y321-L353 HydrophobicContact CD2-CD1 3.93Å; Y321-L353 HydrophobicContact CE1-CD1 3.69Å; Y321-L353 HydrophobicContact CE2-CD1 3.51Å; Y321-L353 HydrophobicContact CE2-CD2 4.12Å; Y321-L353 HydrophobicContact CE2-CG 4.49Å; Y321-L353 HydrophobicContact CG-CD1 4.2Å; Y321-L353 WeakPolarHBondContact OH-CD2 3.49Å
322	L	97.5	Very high	91	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	126.1	-178.6	173.9	67.2	0	0	0	109.6	L248 L250 L324 V343 I346 Q351 T352 L353	L248-L322 HydrophobicContact CB-CD1 4.2Å; L248-L322 HydrophobicContact CD2-CD1 3.95Å; L248-L322 HydrophobicContact CG-CD1 4.07Å; L248-L322 CarbonylContact O-C 3.5Å; L248-L322 WeakPolarHBondContact O-CA 3.29Å; L250-L322 HydrophobicContact CD1-CD1 4.36Å; L250-L322 HydrophobicContact CG-CD1 4.42Å; L322-L324 HydrophobicContact CD1-CD2 4.42Å; L322-V343 HydrophobicContact CD2-CG2 3.91Å; L322-I346 HydrophobicContact CD1-CD1 3.95Å; L322-I346 HydrophobicContact CD2-CD1 3.93Å; L322-I346 HydrophobicContact CG-CD1 4.4Å; L322-Q351 PolarHBondContact N-O 3.4Å; L322-T352 HydrophobicContact CD2-CG2 4.07Å; L322-T352 HydrophobicContact CG-CG2 4.46Å; L322-T352 CarbonylContact O-C 3.52Å; L322-T352 WeakPolarHBondContact O-CA 3.42Å; L322-L353 PolarHBondContact O-N 3.31Å
323	V	97.5	Very high	89.8	Confident	0 Å²	0	28 Å²	28	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.6	174.8	-175.6	0	0	0	0	109.7	Y225 L248 V249 L250 Y321 L353	Y225-V323 HydrophobicContact CD1-CG1 3.95Å; Y225-V323 HydrophobicContact CD2-CB 4.5Å; Y225-V323 HydrophobicContact CD2-CG1 3.89Å; Y225-V323 HydrophobicContact CD2-CG2 4.13Å; Y225-V323 HydrophobicContact CE1-CG1 4.22Å; Y225-V323 HydrophobicContact CE2-CG1 4.21Å; Y225-V323 HydrophobicContact CG-CG1 3.77Å; Y225-V323 HydrophobicContact CG-CG2 4.3Å; L248-V323 PolarHBondContact O-N 3.35Å; V249-V323 CarbonylContact C-O 3.57Å; V249-V323 WeakPolarHBondContact CA-O 3.39Å; V249-V323 HydrophobicContact CB-CB 4.26Å; V249-V323 HydrophobicContact CG1-CB 4.05Å; V249-V323 HydrophobicContact CG1-CG1 4.08Å; V249-V323 HydrophobicContact CG2-CB 4.02Å; V249-V323 HydrophobicContact CG2-CG2 4.22Å; L250-V323 PolarHBondContact N-O 3.11Å; Y321-V323 HydrophobicContact CD1-CG2 3.77Å; Y321-V323 HydrophobicContact CE1-CG2 3.33Å; V323-L353 CarbonylContact C-O 3.58Å; V323-L353 VanDerWaalsContact CA-O 3.3Å; V323-L353 WeakPolarHBondContact CA-O 3.49Å; V323-L353 HydrophobicContact CG2-CD1 4.47Å
324	L	95.4	Very high	89	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	105.7	164.5	-55.7	-175.2	0	0	0	108.2	L250 L322 A327 I339 L353 M354 W355	L250-L324 HydrophobicContact CB-CD2 3.82Å; L250-L324 HydrophobicContact CD1-CD2 3.7Å; L250-L324 HydrophobicContact CG-CD2 4.09Å; L322-L324 HydrophobicContact CD1-CD2 4.42Å; L324-A327 HydrophobicContact CB-CB 4.07Å; L324-I339 HydrophobicContact CD1-CG2 4.38Å; L324-I339 HydrophobicContact CD2-CD1 4.31Å; L324-L353 PolarHBondContact N-O 3.42Å; L324-M354 HydrophobicContact CB-CG 4.18Å; L324-M354 HydrophobicContact CD1-CE 3.72Å; L324-M354 HydrophobicContact CD1-CG 4.12Å; L324-M354 HydrophobicContact CD1-SD 4.25Å; L324-M354 HydrophobicContact CG-CG 4.4Å; L324-W355 PolarHBondContact O-N 2.89Å
325	D	93.7	Very high	88.4	Confident	5 Å²	5	27.6 Å²	27.6	3%	0.027	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	143.7	174.7	-157.8	-0.9	0	0	0	109.9	Y225 V249 L250 A327	Y225-D325 HydrophobicContact CE1-CB 4.5Å; Y225-D325 PolarHBondContact OH-OD2 2.6Å; V249-D325 HydrophobicContact CG1-CB 4.46Å; L250-D325 PolarHBondContact O-N 2.97Å; D325-A327 VanDerWaalsContact C-N 3.28Å; D325-A327 PolarHBondContact O-N 3.38Å
326	E	89.3	Confident	88.1	Confident	11 Å²	11	27.4 Å²	27.4	5%	0.051	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	49.2	-168.1	-55.2	-74.7	-166.5	0	0	111.5	P252 L256 D328 R329 M330 W355 H504	P252-E326 HydrophobicContact CG-CB 3.86Å; P252-E326 HydrophobicContact CG-CG 4.25Å; L256-E326 HydrophobicContact CD2-CG 3.79Å; E326-D328 VanDerWaalsContact C-N 3.32Å; E326-D328 PolarHBondContact O-N 3.13Å; E326-R329 HydrophobicContact CB-CB 4.4Å; E326-R329 WeakPolarHBondContact O-CB 3.19Å; E326-R329 PolarHBondContact O-N 3.34Å; E326-M330 PolarHBondContact O-N 3.43Å; E326-M330 VanDerWaalsContact O-N 3.15Å; E326-W355 WeakPolarHBondContact CA-O 3.46Å; E326-W355 PolarHBondContact N-O 3.44Å; E326-H504 IonicContact OE2-CE1 3.95Å; E326-H504 PolarHBondContact OE2-CE1 2.65Å; E326-H504 IonicContact OE2-ND1 2.61Å
327	A	89.4	Confident	87.9	Confident	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-59.7	-35.5	-167	0	0	0	0	0	114.3	L324 D325 R329 M330 L331 M354 W355 W359	L324-A327 HydrophobicContact CB-CB 4.07Å; D325-A327 VanDerWaalsContact C-N 3.28Å; D325-A327 PolarHBondContact O-N 3.38Å; A327-R329 VanDerWaalsContact C-N 3.27Å; A327-R329 PolarHBondContact O-N 3.07Å; A327-M330 PolarHBondContact O-N 3.17Å; A327-L331 VanDerWaalsContact O-CG 3.32Å; A327-L331 WeakPolarHBondContact O-CG 3.43Å; A327-L331 PolarHBondContact O-N 3.42Å; A327-L331 VanDerWaalsContact O-N 3.16Å; A327-M354 HydrophobicContact CB-CB 3.83Å; A327-M354 HydrophobicContact CB-CG 4.26Å; A327-M354 HydrophobicContact CB-SD 4.37Å; A327-W355 PolarHBondContact N-O 3.26Å; A327-W359 HydrophobicContact CB-CH2 4.29Å; A327-W359 HydrophobicContact CB-CZ3 3.82Å
328	D	87.3	Confident	87.8	Confident	7 Å²	7	25.4 Å²	25.4	4%	0.037	14%	0.139	C	C	.	.	H	α-helix	trans	-58.1	-41.6	173.6	64	-43.5	0	0	0	111.5	E326 L331 D332 S356 T358 V363 R480 H504	E326-D328 VanDerWaalsContact C-N 3.32Å; E326-D328 PolarHBondContact O-N 3.13Å; D328-L331 PolarHBondContact O-N 2.96Å; D328-D332 VanDerWaalsContact O-CB 3.25Å; D328-D332 WeakPolarHBondContact O-CB 3.29Å; D328-D332 PolarHBondContact O-N 2.88Å; D328-S356 WeakPolarHBondContact OD1-CB 3.26Å; D328-S356 PolarHBondContact OD1-OG 3.19Å; D328-T358 WeakPolarHBondContact CB-O 3.41Å; D328-T358 PolarHBondContact OD2-OG1 2.66Å; D328-V363 HydrophobicContact CB-CG1 4.26Å; D328-V363 HydrophobicContact CB-CG2 4.15Å; D328-R480 IonicContact OD2-NH1 3.2Å; D328-H504 IonicContact OD2-NE2 3.27Å
329	R	82.4	Confident	87.8	Confident	29 Å²	29	23.4 Å²	23.4	11%	0.109	13%	0.131	C	C	.	.	H	α-helix	trans	-72.2	-36.5	-179.9	-164.4	55.5	167.7	171	1.4	112.9	P252 E326 A327 L331 D332 M333	P252-R329 HydrophobicContact CB-CG 4.42Å; E326-R329 HydrophobicContact CB-CB 4.4Å; E326-R329 WeakPolarHBondContact O-CB 3.19Å; E326-R329 PolarHBondContact O-N 3.34Å; A327-R329 VanDerWaalsContact C-N 3.27Å; A327-R329 PolarHBondContact O-N 3.07Å; R329-L331 PolarHBondContact O-N 2.88Å; R329-D332 IonicContact NH1-OD2 3.33Å; R329-D332 PolarHBondContact NH1-OD2 3.21Å; R329-D332 PolarHBondContact O-N 3.33Å; R329-M333 VanDerWaalsContact CD-SD 3.59Å; R329-M333 HydrophobicContact CG-CG 3.81Å; R329-M333 HydrophobicContact CG-SD 3.57Å; R329-M333 VanDerWaalsContact CG-SD 3.57Å; R329-M333 VanDerWaalsContact CZ-SD 3.53Å; R329-M333 PolarHBondContact NE-SD 3.21Å; R329-M333 PolarHBondContact O-N 3.07Å; R329-M333 VanDerWaalsContact O-N 3.11Å
330	M	83	Confident	87.6	Confident	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64	-22.1	174.1	-63.6	-64.3	-78.6	0	0	112.1	L250 P252 P302 E326 A327 F335 E336 I339	L250-M330 HydrophobicContact CB-CE 3.99Å; P252-M330 WeakPolarHBondContact CA-SD 3.45Å; P252-M330 HydrophobicContact CB-SD 3.57Å; P252-M330 VanDerWaalsContact CB-SD 3.57Å; P252-M330 HydrophobicContact CG-SD 4.19Å; P302-M330 HydrophobicContact CG-CE 3.31Å; E326-M330 PolarHBondContact O-N 3.43Å; E326-M330 VanDerWaalsContact O-N 3.15Å; A327-M330 PolarHBondContact O-N 3.17Å; M330-F335 CarbonylContact O-C 3.54Å; M330-F335 WeakPolarHBondContact O-CB 3.36Å; M330-F335 HydrophobicContact SD-CD2 4.24Å; M330-E336 PolarHBondContact O-N 2.98Å; M330-I339 HydrophobicContact CB-CG1 4.44Å; M330-I339 HydrophobicContact CE-CD1 3.38Å; M330-I339 HydrophobicContact CE-CG1 4.15Å
331	L	82.8	Confident	87.4	Confident	9 Å²	9	29.5 Å²	29.5	5%	0.047	16%	0.155	C	C	.	.	H	α-helix	trans	-94.7	-37.2	175.9	-63	173.3	0	0	0	112	A327 D328 R329 E336 V363 L366 A367 F370	A327-L331 VanDerWaalsContact O-CG 3.32Å; A327-L331 WeakPolarHBondContact O-CG 3.43Å; A327-L331 PolarHBondContact O-N 3.42Å; A327-L331 VanDerWaalsContact O-N 3.16Å; D328-L331 PolarHBondContact O-N 2.96Å; R329-L331 PolarHBondContact O-N 2.88Å; L331-E336 HydrophobicContact CD2-CB 4.36Å; L331-E336 HydrophobicContact CD2-CG 4.27Å; L331-V363 HydrophobicContact CB-CB 4.5Å; L331-V363 HydrophobicContact CB-CG1 4.24Å; L331-V363 HydrophobicContact CD1-CB 4.12Å; L331-L366 HydrophobicContact CD1-CB 4.34Å; L331-A367 HydrophobicContact CD1-CB 4.22Å; L331-F370 HydrophobicContact CD2-CD2 4.33Å; L331-F370 HydrophobicContact CD2-CE2 3.63Å; L331-F370 HydrophobicContact CD2-CZ 4.48Å
332	D	73.1	Confident	87.2	Confident	105 Å²	105	29.5 Å²	29.5	56%	0.561	16%	0.155	S	C	*	.	H	α-helix	trans	-76	-43.3	-175.5	177.2	45	0	0	0	114.7	D328 R329 G334	D328-D332 VanDerWaalsContact O-CB 3.25Å; D328-D332 WeakPolarHBondContact O-CB 3.29Å; D328-D332 PolarHBondContact O-N 2.88Å; R329-D332 IonicContact NH1-OD2 3.33Å; R329-D332 PolarHBondContact NH1-OD2 3.21Å; R329-D332 PolarHBondContact O-N 3.33Å; D332-G334 PolarHBondContact O-N 3.12Å
333	M	66	Low	87	Confident	79 Å²	79	29.9 Å²	29.9	39%	0.389	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	12.3	-173.7	-65.4	-174.6	77.2	0	0	115.5	R329 F335	R329-M333 VanDerWaalsContact CD-SD 3.59Å; R329-M333 HydrophobicContact CG-CG 3.81Å; R329-M333 HydrophobicContact CG-SD 3.57Å; R329-M333 VanDerWaalsContact CG-SD 3.57Å; R329-M333 VanDerWaalsContact CZ-SD 3.53Å; R329-M333 PolarHBondContact NE-SD 3.21Å; R329-M333 PolarHBondContact O-N 3.07Å; R329-M333 VanDerWaalsContact O-N 3.11Å; M333-F335 HydrophobicContact CB-CD2 3.68Å; M333-F335 HydrophobicContact CB-CE2 3.96Å; M333-F335 HydrophobicContact CE-CE2 4.38Å; M333-F335 HydrophobicContact CG-CD2 4.39Å; M333-F335 HydrophobicContact CG-CE2 4.42Å; M333-F335 PolarHBondContact O-N 3.33Å; M333-F335 HydrophobicContact SD-CD2 4.2Å; M333-F335 HydrophobicContact SD-CE2 3.71Å
334	G	77.1	Confident	86.7	Confident	47 Å²	47	32.3 Å²	32.3	49%	0.485	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	69.4	21.1	-168.7	0	0	0	0	0	112.9	D332 E336 P337	D332-G334 PolarHBondContact O-N 3.12Å; G334-E336 VanDerWaalsContact C-N 3.27Å; G334-P337 WeakPolarHBondContact O-CD 3.29Å
335	F	80.3	Confident	86.5	Confident	40 Å²	40	33.8 Å²	33.8	18%	0.175	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-16.3	166.7	-78	-55.4	0	0	0	111.9	P252 P302 M330 M333 Q338 I339	P252-F335 HydrophobicContact CB-CE2 4.32Å; P302-F335 HydrophobicContact CG-CD1 4.4Å; M330-F335 CarbonylContact O-C 3.54Å; M330-F335 WeakPolarHBondContact O-CB 3.36Å; M330-F335 HydrophobicContact SD-CD2 4.24Å; M333-F335 HydrophobicContact CB-CD2 3.68Å; M333-F335 HydrophobicContact CB-CE2 3.96Å; M333-F335 HydrophobicContact CE-CE2 4.38Å; M333-F335 HydrophobicContact CG-CD2 4.39Å; M333-F335 HydrophobicContact CG-CE2 4.42Å; M333-F335 PolarHBondContact O-N 3.33Å; M333-F335 HydrophobicContact SD-CD2 4.2Å; M333-F335 HydrophobicContact SD-CE2 3.71Å; F335-Q338 CarbonylContact O-C 3.6Å; F335-Q338 WeakPolarHBondContact O-CA 3.4Å; F335-Q338 WeakPolarHBondContact O-CB 3.49Å; F335-Q338 PolarHBondContact O-N 3.22Å; F335-I339 PolarHBondContact O-N 3.04Å
336	E	88.8	Confident	86.5	Confident	39 Å²	39	33.6 Å²	33.6	18%	0.182	18%	0.176	C	C	.	.	H	α-helix	trans	-48.2	-47.5	179.3	-179.6	-76.4	151.2	0	0	113.3	M330 L331 G334 Q338 I339 R340	M330-E336 PolarHBondContact O-N 2.98Å; L331-E336 HydrophobicContact CD2-CB 4.36Å; L331-E336 HydrophobicContact CD2-CG 4.27Å; G334-E336 VanDerWaalsContact C-N 3.27Å; E336-Q338 VanDerWaalsContact C-N 3.27Å; E336-Q338 PolarHBondContact O-N 3.18Å; E336-I339 PolarHBondContact O-N 3.04Å; E336-R340 WeakPolarHBondContact O-CB 3.37Å; E336-R340 PolarHBondContact O-N 3.23Å; E336-R340 IonicContact OE1-CZ 3.85Å; E336-R340 IonicContact OE1-NE 3.04Å; E336-R340 PolarHBondContact OE1-NE 2.82Å; E336-R340 IonicContact OE1-NH2 3.24Å; E336-R340 PolarHBondContact OE1-NH2 3.38Å
337	P	89.6	Confident	86.6	Confident	66 Å²	66	33.5 Å²	33.5	43%	0.429	18%	0.175	S	C	.	.	H	α-helix	trans	-65.7	-31.2	178.3	-22.9	34.5	0	0	0	112.9	G334 K341	G334-P337 WeakPolarHBondContact O-CD 3.29Å; P337-K341 VanDerWaalsContact O-CG 3.28Å; P337-K341 WeakPolarHBondContact O-CG 3.33Å; P337-K341 PolarHBondContact O-N 2.83Å
338	Q	90.2	Very high	86.6	Confident	49 Å²	49	36.2 Å²	36.2	23%	0.229	19%	0.193	C	C	.	.	H	α-helix	trans	-72.5	-43.2	176.4	-64.3	178.8	51.5	0	0	110.7	P302 I306 F335 E336 K341 I342	P302-Q338 HydrophobicContact CB-CB 3.88Å; I306-Q338 HydrophobicContact CD1-CB 3.66Å; I306-Q338 HydrophobicContact CD1-CG 4.02Å; F335-Q338 CarbonylContact O-C 3.6Å; F335-Q338 WeakPolarHBondContact O-CA 3.4Å; F335-Q338 WeakPolarHBondContact O-CB 3.49Å; F335-Q338 PolarHBondContact O-N 3.22Å; E336-Q338 VanDerWaalsContact C-N 3.27Å; E336-Q338 PolarHBondContact O-N 3.18Å; Q338-K341 PolarHBondContact O-N 3.11Å; Q338-I342 WeakPolarHBondContact O-CD1 3.08Å; Q338-I342 WeakPolarHBondContact O-CG1 3.3Å; Q338-I342 PolarHBondContact O-N 2.97Å; Q338-I342 VanDerWaalsContact O-N 3.15Å
339	I	92.1	Very high	86.8	Confident	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-59.2	-48.8	174.2	-67.3	-57.1	0	0	0	110.3	L250 P302 L324 M330 F335 E336 K341 I342 V343 F370	L250-I339 HydrophobicContact CB-CD1 4.36Å; L250-I339 HydrophobicContact CD1-CD1 3.49Å; L250-I339 VanDerWaalsContact CD1-CD1 3.49Å; P302-I339 HydrophobicContact CG-CD1 3.91Å; L324-I339 HydrophobicContact CD1-CG2 4.38Å; L324-I339 HydrophobicContact CD2-CD1 4.31Å; M330-I339 HydrophobicContact CB-CG1 4.44Å; M330-I339 HydrophobicContact CE-CD1 3.38Å; M330-I339 HydrophobicContact CE-CG1 4.15Å; F335-I339 PolarHBondContact O-N 3.04Å; E336-I339 PolarHBondContact O-N 3.04Å; I339-K341 VanDerWaalsContact C-N 3.31Å; I339-K341 PolarHBondContact O-N 2.98Å; I339-I342 PolarHBondContact O-N 3.42Å; I339-V343 HydrophobicContact CG2-CG2 3.91Å; I339-V343 WeakPolarHBondContact O-CG2 3.16Å; I339-V343 PolarHBondContact O-N 3.39Å; I339-F370 HydrophobicContact CG2-CD1 4.42Å; I339-F370 HydrophobicContact CG2-CE1 4.02Å; I339-F370 HydrophobicContact CG2-CE2 4.44Å; I339-F370 HydrophobicContact CG2-CZ 4.02Å
340	R	91.6	Very high	87.4	Confident	80 Å²	80	37.1 Å²	37.1	30%	0.302	20%	0.198	S	C	.	.	H	α-helix	trans	-56.5	-44.4	178.9	-168.7	173.4	-61.3	-92.1	3.2	112.3	E336 I342 V343 D344 D369 F370	E336-R340 WeakPolarHBondContact O-CB 3.37Å; E336-R340 PolarHBondContact O-N 3.23Å; E336-R340 IonicContact OE1-CZ 3.85Å; E336-R340 IonicContact OE1-NE 3.04Å; E336-R340 PolarHBondContact OE1-NE 2.82Å; E336-R340 IonicContact OE1-NH2 3.24Å; E336-R340 PolarHBondContact OE1-NH2 3.38Å; R340-I342 VanDerWaalsContact C-N 3.3Å; R340-I342 PolarHBondContact O-N 2.8Å; R340-V343 PolarHBondContact O-N 3.08Å; R340-D344 WeakPolarHBondContact O-CB 3.38Å; R340-D344 PolarHBondContact O-N 3Å; R340-D369 IonicContact CZ-OD2 2.65Å; R340-D369 IonicContact NH1-OD2 3.46Å; R340-D369 PolarHBondContact NH1-OD2 2.99Å; R340-D369 IonicContact NH2-OD2 2.66Å; R340-D369 PolarHBondContact NH2-OD2 2.58Å; R340-F370 HydrophobicContact CB-CE1 4.15Å; R340-F370 HydrophobicContact CB-CZ 4.39Å; R340-F370 HydrophobicContact CG-CE1 4.41Å
341	K	91.4	Very high	88	Confident	53 Å²	53	37.1 Å²	37.1	23%	0.23	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-35.8	175.5	-73.2	-179	-167.5	-170.7	0	113.5	P113 P337 Q338 I339 Q345	P113-K341 PolarHBondContact O-NZ 3.09Å; P337-K341 VanDerWaalsContact O-CG 3.28Å; P337-K341 WeakPolarHBondContact O-CG 3.33Å; P337-K341 PolarHBondContact O-N 2.83Å; Q338-K341 PolarHBondContact O-N 3.11Å; I339-K341 VanDerWaalsContact C-N 3.31Å; I339-K341 PolarHBondContact O-N 2.98Å; K341-Q345 WeakPolarHBondContact O-CG 3.5Å
342	I	93.4	Very high	88.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-73.3	-48.8	177	-65.9	159.3	0	0	0	109.9	L248 L250 P302 L305 I306 L309 L316 Q338 I339 R340 D344 Q345 I346	L248-I342 HydrophobicContact CD2-CG2 4.04Å; L250-I342 HydrophobicContact CD1-CD1 4.17Å; L250-I342 HydrophobicContact CD1-CG2 4.13Å; P302-I342 HydrophobicContact CB-CD1 3.71Å; P302-I342 HydrophobicContact CG-CD1 4.49Å; L305-I342 HydrophobicContact CD2-CD1 4.07Å; L305-I342 HydrophobicContact CD2-CG1 4.27Å; L305-I342 HydrophobicContact CD2-CG2 3.82Å; I306-I342 HydrophobicContact CD1-CD1 4.21Å; I306-I342 HydrophobicContact CD1-CG1 4.18Å; I306-I342 HydrophobicContact CG1-CD1 3.96Å; I306-I342 HydrophobicContact CG1-CG1 3.64Å; L309-I342 HydrophobicContact CD1-CG1 4.47Å; L316-I342 HydrophobicContact CD1-CG2 3.83Å; Q338-I342 WeakPolarHBondContact O-CD1 3.08Å; Q338-I342 WeakPolarHBondContact O-CG1 3.3Å; Q338-I342 PolarHBondContact O-N 2.97Å; Q338-I342 VanDerWaalsContact O-N 3.15Å; I339-I342 PolarHBondContact O-N 3.42Å; R340-I342 VanDerWaalsContact C-N 3.3Å; R340-I342 PolarHBondContact O-N 2.8Å; I342-D344 VanDerWaalsContact C-N 3.34Å; I342-D344 PolarHBondContact O-N 3.15Å; I342-Q345 WeakPolarHBondContact O-CA 3.4Å; I342-Q345 WeakPolarHBondContact O-CB 3.45Å; I342-Q345 PolarHBondContact O-N 3.18Å; I342-I346 HydrophobicContact CG2-CD1 4.46Å
343	V	92.7	Very high	89.8	Confident	9 Å²	9	31.7 Å²	31.7	6%	0.055	17%	0.169	C	C	.	.	H	α-helix	trans	-66.3	-34.4	-175.6	177.8	0	0	0	0	112.2	L322 I339 R340 Q345 I346 F370	L322-V343 HydrophobicContact CD2-CG2 3.91Å; I339-V343 HydrophobicContact CG2-CG2 3.91Å; I339-V343 WeakPolarHBondContact O-CG2 3.16Å; I339-V343 PolarHBondContact O-N 3.39Å; R340-V343 PolarHBondContact O-N 3.08Å; V343-Q345 PolarHBondContact O-N 2.98Å; V343-Q345 VanDerWaalsContact O-N 3.16Å; V343-I346 PolarHBondContact O-N 3.36Å; V343-F370 HydrophobicContact CB-CD1 4.17Å; V343-F370 HydrophobicContact CG1-CD1 4.02Å; V343-F370 HydrophobicContact CG2-CD1 4.14Å
344	D	91.5	Very high	91.2	Very high	51 Å²	51	28 Å²	28	27%	0.273	15%	0.151	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-18.2	172	-85.8	-34.1	0	0	0	113	K119 R340 I342	K119-D344 VanDerWaalsContact CE-OD1 3.32Å; K119-D344 WeakPolarHBondContact CE-OD1 3.47Å; K119-D344 HydrophobicContact CG-CB 4.35Å; K119-D344 IonicContact NZ-OD1 3.59Å; K119-D344 PolarHBondContact NZ-OD1 2.92Å; R340-D344 WeakPolarHBondContact O-CB 3.38Å; R340-D344 PolarHBondContact O-N 3Å; I342-D344 VanDerWaalsContact C-N 3.34Å; I342-D344 PolarHBondContact O-N 3.15Å
345	Q	91.6	Very high	92.1	Very high	30 Å²	30	25.7 Å²	25.7	14%	0.14	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.7	4.5	174.2	-58.3	-64.9	-7.8	0	0	113.5	R118 W122 L316 K341 I342 V343	R118-Q345 PolarHBondContact O-NE2 2.95Å; W122-Q345 VanDerWaalsContact CZ2-O 3.23Å; W122-Q345 WeakPolarHBondContact CZ2-O 3.44Å; L316-Q345 WeakPolarHBondContact CB-O 3.31Å; L316-Q345 HydrophobicContact CD1-CB 4.49Å; K341-Q345 WeakPolarHBondContact O-CG 3.5Å; I342-Q345 WeakPolarHBondContact O-CA 3.4Å; I342-Q345 WeakPolarHBondContact O-CB 3.45Å; I342-Q345 PolarHBondContact O-N 3.18Å; V343-Q345 PolarHBondContact O-N 2.98Å; V343-Q345 VanDerWaalsContact O-N 3.16Å
346	I	93.1	Very high	92.6	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.01	12%	0.119	C	C	.	.	S	Bend	trans	-107.3	147	176.4	-50.5	171.9	0	0	0	108.9	W122 L248 L316 C319 L322 I342 V343 R350	W122-I346 PolarHBondContact NE1-O 2.85Å; L248-I346 HydrophobicContact CD2-CD1 4.17Å; L316-I346 HydrophobicContact CB-CG1 3.93Å; L316-I346 HydrophobicContact CD1-CD1 4.07Å; L316-I346 HydrophobicContact CD1-CG1 3.6Å; L316-I346 HydrophobicContact CG-CG1 4.35Å; C319-I346 HydrophobicContact CB-CG2 3.96Å; C319-I346 WeakPolarHBondContact O-CG2 3.32Å; L322-I346 HydrophobicContact CD1-CD1 3.95Å; L322-I346 HydrophobicContact CD2-CD1 3.93Å; L322-I346 HydrophobicContact CG-CD1 4.4Å; I342-I346 HydrophobicContact CG2-CD1 4.46Å; V343-I346 PolarHBondContact O-N 3.36Å; I346-R350 HydrophobicContact CG2-CB 4.09Å; I346-R350 HydrophobicContact CG2-CG 4.34Å
347	R	91.1	Very high	92.5	Very high	8 Å²	8	22.6 Å²	22.6	3%	0.03	12%	0.116	C	C	.	.			trans	-55.2	141.3	173	66.4	-171	-65.7	167.8	2.7	111.2	W122 L127 P128 C319 D349 R350	W122-R347 HydrophobicContact CE3-CB 4.49Å; L127-R347 HydrophobicContact CD1-CB 4.02Å; P128-R347 PolarHBondContact O-NH1 3.14Å; P128-R347 PolarHBondContact O-NH2 2.8Å; C319-R347 WeakPolarHBondContact O-CG 3.43Å; R347-D349 VanDerWaalsContact C-N 3.27Å; R347-D349 VanDerWaalsContact CB-OD1 3.26Å; R347-D349 WeakPolarHBondContact CB-OD1 3.35Å; R347-D349 VanDerWaalsContact CG-OD1 3.24Å; R347-D349 WeakPolarHBondContact CG-OD1 3.46Å; R347-D349 IonicContact CZ-OD1 3.87Å; R347-D349 IonicContact CZ-OD2 2.86Å; R347-D349 VanDerWaalsContact CZ-OD2 3.27Å; R347-D349 VanDerWaalsContact NE-CG 3.27Å; R347-D349 IonicContact NE-OD1 3.7Å; R347-D349 PolarHBondContact NE-OD1 3.42Å; R347-D349 IonicContact NE-OD2 2.72Å; R347-D349 PolarHBondContact NE-OD2 2.84Å; R347-D349 IonicContact NH2-OD1 3.51Å; R347-D349 IonicContact NH2-OD2 3.07Å; R347-D349 PolarHBondContact NH2-OD2 3.3Å; R347-D349 PolarHBondContact O-N 2.8Å; R347-R350 HydrophobicContact CG-CB 4.38Å; R347-R350 WeakPolarHBondContact O-CG 3.35Å; R347-R350 PolarHBondContact O-N 3.1Å; R347-R350 PolarHBondContact O-NH1 2.51Å
348	P	89.5	Confident	92.4	Very high	57 Å²	57	19.6 Å²	19.6	37%	0.37	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.6	-17.9	-175.4	29.8	-35.7	0	0	0	113.5	W122 L124 R350	W122-P348 HydrophobicContact CB-CG 4.45Å; L124-P348 HydrophobicContact CD2-CG 4.27Å; P348-R350 VanDerWaalsContact C-N 3.3Å
349	D	91.7	Very high	92.3	Very high	28 Å²	28	18 Å²	18	15%	0.15	9%	0.089	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.5	16.2	175.6	63.8	-34.7	0	0	0	112.6	L124 F130 K132 R347	L124-D349 HydrophobicContact CD2-CB 4.06Å; F130-D349 WeakPolarHBondContact CE1-OD2 3.33Å; F130-D349 WeakPolarHBondContact CZ-O 3.36Å; K132-D349 WeakPolarHBondContact CE-O 3.41Å; K132-D349 PolarHBondContact NZ-O 2.85Å; R347-D349 VanDerWaalsContact C-N 3.27Å; R347-D349 VanDerWaalsContact CB-OD1 3.26Å; R347-D349 WeakPolarHBondContact CB-OD1 3.35Å; R347-D349 VanDerWaalsContact CG-OD1 3.24Å; R347-D349 WeakPolarHBondContact CG-OD1 3.46Å; R347-D349 IonicContact CZ-OD1 3.87Å; R347-D349 IonicContact CZ-OD2 2.86Å; R347-D349 VanDerWaalsContact CZ-OD2 3.27Å; R347-D349 VanDerWaalsContact NE-CG 3.27Å; R347-D349 IonicContact NE-OD1 3.7Å; R347-D349 PolarHBondContact NE-OD1 3.42Å; R347-D349 IonicContact NE-OD2 2.72Å; R347-D349 PolarHBondContact NE-OD2 2.84Å; R347-D349 IonicContact NH2-OD1 3.51Å; R347-D349 IonicContact NH2-OD2 3.07Å; R347-D349 PolarHBondContact NH2-OD2 3.3Å; R347-D349 PolarHBondContact O-N 2.8Å
350	R	94.3	Very high	92	Very high	27 Å²	27	19.5 Å²	19.5	10%	0.102	10%	0.098	C	C	.	.	S	Bend	trans	-59.5	165.7	166.9	67.8	-173.9	177.2	-85.2	-9	111.9	K132 I346 R347 P348 T352 F370	K132-R350 PolarHBondContact NZ-O 3.48Å; I346-R350 HydrophobicContact CG2-CB 4.09Å; I346-R350 HydrophobicContact CG2-CG 4.34Å; R347-R350 HydrophobicContact CG-CB 4.38Å; R347-R350 WeakPolarHBondContact O-CG 3.35Å; R347-R350 PolarHBondContact O-N 3.1Å; R347-R350 PolarHBondContact O-NH1 2.51Å; P348-R350 VanDerWaalsContact C-N 3.3Å; R350-T352 PolarHBondContact NE-OG1 3.28Å; R350-T352 VanDerWaalsContact NE-OG1 3.16Å; R350-F370 PolarHBondContact NH2-O 3.02Å; R350-F370 VanDerWaalsContact NH2-O 3.17Å
351	Q	96.1	Very high	91.8	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.005	12%	0.118	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	129.1	161.1	-172.6	-177.3	8.6	0	0	108.6	A205 R209 D210 T320 Y321 L322 L353	A205-Q351 PolarHBondContact O-NE2 2.87Å; R209-Q351 WeakPolarHBondContact O-CG 3.21Å; R209-Q351 PolarHBondContact O-NE2 2.84Å; D210-Q351 VanDerWaalsContact OD1-CA 3.29Å; D210-Q351 WeakPolarHBondContact OD1-CA 3.32Å; T320-Q351 PolarHBondContact O-N 2.71Å; Y321-Q351 VanDerWaalsContact CD2-OE1 3.29Å; L322-Q351 PolarHBondContact N-O 3.4Å; Q351-L353 HydrophobicContact CG-CD1 3.85Å; Q351-L353 HydrophobicContact CG-CG 4.44Å
352	T	96.9	Very high	91.4	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	123.5	179.5	-51.7	0	0	0	0	110.4	D210 M211 L322 R350 M354 F370 L371	D210-T352 VanDerWaalsContact CA-O 3.23Å; D210-T352 WeakPolarHBondContact CA-O 3.31Å; D210-T352 WeakPolarHBondContact CB-O 3.28Å; D210-T352 PolarHBondContact OD1-N 3.25Å; M211-T352 PolarHBondContact N-O 3.48Å; L322-T352 HydrophobicContact CD2-CG2 4.07Å; L322-T352 HydrophobicContact CG-CG2 4.46Å; L322-T352 CarbonylContact O-C 3.52Å; L322-T352 WeakPolarHBondContact O-CA 3.42Å; R350-T352 PolarHBondContact NE-OG1 3.28Å; R350-T352 VanDerWaalsContact NE-OG1 3.16Å; T352-M354 HydrophobicContact CG2-CE 4.4Å; T352-F370 PolarHBondContact OG1-O 3.38Å; T352-L371 HydrophobicContact CG2-CD2 3.8Å
353	L	97.1	Very high	91.1	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	122.6	180	-53	89.5	0	0	0	109.6	A205 M211 Y321 L322 V323 L324 Q351 W355	A205-L353 HydrophobicContact CB-CD2 3.71Å; M211-L353 HydrophobicContact CG-CB 4.1Å; M211-L353 HydrophobicContact CG-CD2 3.77Å; M211-L353 HydrophobicContact CG-CG 3.9Å; M211-L353 CarbonylContact O-C 3.58Å; M211-L353 WeakPolarHBondContact O-CA 3.35Å; M211-L353 HydrophobicContact SD-CD2 3.82Å; Y321-L353 HydrophobicContact CD1-CD1 4.08Å; Y321-L353 HydrophobicContact CD2-CD1 3.93Å; Y321-L353 HydrophobicContact CE1-CD1 3.69Å; Y321-L353 HydrophobicContact CE2-CD1 3.51Å; Y321-L353 HydrophobicContact CE2-CD2 4.12Å; Y321-L353 HydrophobicContact CE2-CG 4.49Å; Y321-L353 HydrophobicContact CG-CD1 4.2Å; Y321-L353 WeakPolarHBondContact OH-CD2 3.49Å; L322-L353 PolarHBondContact O-N 3.31Å; V323-L353 CarbonylContact C-O 3.58Å; V323-L353 VanDerWaalsContact CA-O 3.3Å; V323-L353 WeakPolarHBondContact CA-O 3.49Å; V323-L353 HydrophobicContact CG2-CD1 4.47Å; L324-L353 PolarHBondContact N-O 3.42Å; Q351-L353 HydrophobicContact CG-CD1 3.85Å; Q351-L353 HydrophobicContact CG-CG 4.44Å; L353-W355 HydrophobicContact CD2-CZ2 4.21Å
354	M	96.2	Very high	91	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	134.7	176.2	-62.3	-170.1	-174.3	0	0	110.2	M211 V212 G213 L324 A327 T352 W359 A367 F370 L371	M211-M354 PolarHBondContact O-N 3.18Å; V212-M354 CarbonylContact C-O 3.35Å; V212-M354 WeakPolarHBondContact CA-O 3.23Å; V212-M354 HydrophobicContact CG2-CB 4.28Å; G213-M354 PolarHBondContact N-O 3.08Å; L324-M354 HydrophobicContact CB-CG 4.18Å; L324-M354 HydrophobicContact CD1-CE 3.72Å; L324-M354 HydrophobicContact CD1-CG 4.12Å; L324-M354 HydrophobicContact CD1-SD 4.25Å; L324-M354 HydrophobicContact CG-CG 4.4Å; A327-M354 HydrophobicContact CB-CB 3.83Å; A327-M354 HydrophobicContact CB-CG 4.26Å; A327-M354 HydrophobicContact CB-SD 4.37Å; T352-M354 HydrophobicContact CG2-CE 4.4Å; M354-W359 HydrophobicContact CB-CH2 4.34Å; M354-W359 HydrophobicContact SD-CH2 3.77Å; M354-W359 HydrophobicContact SD-CZ2 4.46Å; M354-A367 HydrophobicContact CE-CB 4.02Å; M354-A367 HydrophobicContact SD-CB 3.65Å; M354-F370 HydrophobicContact CE-CB 3.61Å; M354-F370 HydrophobicContact CE-CD2 4.04Å; M354-F370 HydrophobicContact CE-CG 4.26Å; M354-L371 HydrophobicContact CE-CD1 3.93Å; M354-L371 HydrophobicContact CE-CD2 4.06Å; M354-L371 HydrophobicContact CE-CG 3.68Å; M354-L371 HydrophobicContact CG-CD2 4.27Å; M354-L371 HydrophobicContact SD-CD1 3.95Å; M354-L371 HydrophobicContact SD-CD2 4.48Å; M354-L371 HydrophobicContact SD-CG 4.29Å
355	W	95.2	Very high	90.7	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	134.7	-179.9	-56.6	85.4	0	0	0	110.1	I197 M211 G213 K221 A224 Y225 L324 E326 A327 L353	I197-W355 HydrophobicContact CD1-CZ3 3.9Å; I197-W355 HydrophobicContact CG1-CE3 4.3Å; I197-W355 HydrophobicContact CG1-CZ3 3.7Å; M211-W355 HydrophobicContact CE-CH2 3.26Å; M211-W355 HydrophobicContact CE-CZ2 3.57Å; M211-W355 HydrophobicContact CE-CZ3 3.86Å; M211-W355 HydrophobicContact SD-CH2 4.12Å; M211-W355 HydrophobicContact SD-CZ2 3.94Å; G213-W355 WeakPolarHBondContact O-CA 3.42Å; K221-W355 HydrophobicContact CB-CE3 4.46Å; K221-W355 HydrophobicContact CG-CE3 4.42Å; A224-W355 HydrophobicContact CB-CH2 3.65Å; A224-W355 HydrophobicContact CB-CZ2 4.31Å; A224-W355 HydrophobicContact CB-CZ3 3.84Å; Y225-W355 AromaticContact CD1-CD1 3.62Å; Y225-W355 HydrophobicContact CD1-CD2 4.18Å; Y225-W355 AromaticContact CD1-CG 3.91Å; Y225-W355 HydrophobicContact CD1-CG 3.91Å; Y225-W355 AromaticContact CD1-NE1 3.7Å; Y225-W355 AromaticContact CG-NE1 3.95Å; L324-W355 PolarHBondContact O-N 2.89Å; E326-W355 WeakPolarHBondContact CA-O 3.46Å; E326-W355 PolarHBondContact N-O 3.44Å; A327-W355 PolarHBondContact N-O 3.26Å; L353-W355 HydrophobicContact CD2-CZ2 4.21Å
356	S	91.4	Very high	90.4	Very high	0 Å²	0	38 Å²	38	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	165.9	171	-173.4	0	0	0	0	111.4	G213 I214 A215 K221 D328 T358	G213-S356 PolarHBondContact O-N 2.93Å; I214-S356 WeakPolarHBondContact CA-O 3.47Å; A215-S356 PolarHBondContact N-O 3.48Å; K221-S356 PolarHBondContact NZ-O 3.02Å; D328-S356 WeakPolarHBondContact OD1-CB 3.26Å; D328-S356 PolarHBondContact OD1-OG 3.19Å; S356-T358 VanDerWaalsContact CB-O 3.31Å; S356-T358 WeakPolarHBondContact CB-O 3.46Å; S356-T358 PolarHBondContact OG-N 3.07Å; S356-T358 VanDerWaalsContact OG-N 3.09Å; S356-T358 PolarHBondContact OG-O 3.25Å
357	A	86.7	Confident	90.3	Very high	14 Å²	14	38 Å²	38	12%	0.116	18%	0.183	C	C	.	.	S	Bend	trans	-84.4	-22.7	165.2	0	0	0	0	0	111.9	A215 T217	A215-A357 VanDerWaalsContact O-CA 3.26Å; A215-A357 WeakPolarHBondContact O-CA 3.48Å; T217-A357 HydrophobicContact CG2-CB 3.91Å
358	T	85.7	Confident	90.2	Very high	3 Å²	3	42.2 Å²	42.2	2%	0.018	20%	0.203	C	C	.	.			trans	-128.9	133.5	-171.4	41	0	0	0	0	109.1	D328 S356 L384 E500 H504	D328-T358 WeakPolarHBondContact CB-O 3.41Å; D328-T358 PolarHBondContact OD2-OG1 2.66Å; S356-T358 VanDerWaalsContact CB-O 3.31Å; S356-T358 WeakPolarHBondContact CB-O 3.46Å; S356-T358 PolarHBondContact OG-N 3.07Å; S356-T358 VanDerWaalsContact OG-N 3.09Å; S356-T358 PolarHBondContact OG-O 3.25Å; T358-L384 HydrophobicContact CG2-CD1 3.39Å; T358-E500 HydrophobicContact CG2-CB 4.02Å; T358-E500 HydrophobicContact CG2-CG 4.1Å; T358-H504 PolarHBondContact OG1-NE2 3.17Å
359	W	89.1	Confident	90.2	Very high	16 Å²	16	44.1 Å²	44.1	6%	0.061	21%	0.21	C	C	.	.			trans	-135.9	67.6	-178.5	-156.8	-119.6	0	0	0	111.5	V212 I214 A327 M354 V363 R364 A367	V212-W359 HydrophobicContact CG1-CD2 4.01Å; V212-W359 HydrophobicContact CG1-CE3 4.44Å; V212-W359 HydrophobicContact CG1-CH2 4.16Å; V212-W359 HydrophobicContact CG1-CZ2 3.66Å; V212-W359 HydrophobicContact CG2-CZ2 4.06Å; I214-W359 HydrophobicContact CD1-CB 3.35Å; I214-W359 VanDerWaalsContact CD1-CD1 3.46Å; I214-W359 HydrophobicContact CD1-CD2 4.24Å; I214-W359 HydrophobicContact CD1-CG 3.41Å; I214-W359 VanDerWaalsContact CD1-CG 3.41Å; I214-W359 HydrophobicContact CG1-CB 3.76Å; I214-W359 HydrophobicContact CG1-CD2 4.46Å; I214-W359 HydrophobicContact CG1-CG 3.98Å; I214-W359 HydrophobicContact CG2-CB 4.37Å; A327-W359 HydrophobicContact CB-CH2 4.29Å; A327-W359 HydrophobicContact CB-CZ3 3.82Å; M354-W359 HydrophobicContact CB-CH2 4.34Å; M354-W359 HydrophobicContact SD-CH2 3.77Å; M354-W359 HydrophobicContact SD-CZ2 4.46Å; W359-V363 HydrophobicContact CD2-CG2 4.03Å; W359-V363 HydrophobicContact CE3-CG2 3.86Å; W359-V363 HydrophobicContact CH2-CG2 4.49Å; W359-V363 HydrophobicContact CZ3-CG2 4.1Å; W359-R364 VanDerWaalsContact CD1-NE 3.34Å; W359-R364 HydrophobicContact CG-CG 4.36Å; W359-R364 PolarHBondContact O-NE 2.7Å; W359-R364 PolarHBondContact O-NH2 2.73Å; W359-A367 HydrophobicContact CH2-CB 3.7Å; W359-A367 HydrophobicContact CZ2-CB 3.54Å
360	P	86	Confident	90.2	Very high	30 Å²	30	43.1 Å²	43.1	20%	0.195	21%	0.205	C	C	.	.			trans	-64.9	162.1	-178.1	31.3	-37.3	0	0	0	110.9	E362 V363 R364	P360-E362 VanDerWaalsContact C-N 3.27Å; P360-E362 WeakPolarHBondContact CB-OE2 3.32Å; P360-E362 PolarHBondContact O-N 3.14Å; P360-V363 HydrophobicContact CG-CG1 4.09Å; P360-V363 HydrophobicContact CG-CG2 3.83Å; P360-V363 VanDerWaalsContact O-CG2 3.25Å; P360-V363 WeakPolarHBondContact O-CG2 3.3Å; P360-V363 PolarHBondContact O-N 3.27Å; P360-R364 WeakPolarHBondContact O-CG 3.37Å
361	K	86.2	Confident	90.1	Very high	167 Å²	167	42.7 Å²	42.7	73%	0.726	20%	0.204	S	C	*	.	H	α-helix	trans	-66	-33.4	-169.2	-72.4	-178.5	-179.2	176.3	0	112.3	V363 R364	K361-V363 VanDerWaalsContact C-N 3.35Å; K361-V363 PolarHBondContact O-N 2.87Å; K361-R364 PolarHBondContact O-N 2.88Å
362	E	84.7	Confident	89.8	Confident	138 Å²	138	50.5 Å²	50.5	65%	0.645	23%	0.234	S	C	*	.	H	α-helix	trans	-63.8	-38.9	-176.8	-57.4	73.9	-160.7	0	0	111.4	P360	P360-E362 VanDerWaalsContact C-N 3.27Å; P360-E362 WeakPolarHBondContact CB-OE2 3.32Å; P360-E362 PolarHBondContact O-N 3.14Å
363	V	87.3	Confident	89.4	Confident	9 Å²	9	56.3 Å²	56.3	6%	0.055	27%	0.265	C	S	.	.	H	α-helix	trans	-78.9	-22.6	179.6	-56.5	0	0	0	0	112.7	D328 L331 W359 P360 K361 Q365 L366 A367	D328-V363 HydrophobicContact CB-CG1 4.26Å; D328-V363 HydrophobicContact CB-CG2 4.15Å; L331-V363 HydrophobicContact CB-CB 4.5Å; L331-V363 HydrophobicContact CB-CG1 4.24Å; L331-V363 HydrophobicContact CD1-CB 4.12Å; W359-V363 HydrophobicContact CD2-CG2 4.03Å; W359-V363 HydrophobicContact CE3-CG2 3.86Å; W359-V363 HydrophobicContact CH2-CG2 4.49Å; W359-V363 HydrophobicContact CZ3-CG2 4.1Å; P360-V363 HydrophobicContact CG-CG1 4.09Å; P360-V363 HydrophobicContact CG-CG2 3.83Å; P360-V363 VanDerWaalsContact O-CG2 3.25Å; P360-V363 WeakPolarHBondContact O-CG2 3.3Å; P360-V363 PolarHBondContact O-N 3.27Å; K361-V363 VanDerWaalsContact C-N 3.35Å; K361-V363 PolarHBondContact O-N 2.87Å; V363-Q365 PolarHBondContact O-N 3.47Å; V363-L366 PolarHBondContact O-N 3.43Å; V363-A367 VanDerWaalsContact O-CB 3.3Å; V363-A367 WeakPolarHBondContact O-CB 3.45Å; V363-A367 PolarHBondContact O-N 2.98Å
364	R	88.7	Confident	89.3	Confident	79 Å²	79	57.8 Å²	57.8	30%	0.298	27%	0.27	S	S	.	.	H	α-helix	trans	-63.7	-45.1	-178.5	-47.3	-164.3	-178.4	171.7	-4.4	111.4	W359 P360 K361 L366 A367 E368	W359-R364 VanDerWaalsContact CD1-NE 3.34Å; W359-R364 HydrophobicContact CG-CG 4.36Å; W359-R364 PolarHBondContact O-NE 2.7Å; W359-R364 PolarHBondContact O-NH2 2.73Å; P360-R364 WeakPolarHBondContact O-CG 3.37Å; K361-R364 PolarHBondContact O-N 2.88Å; R364-L366 VanDerWaalsContact C-N 3.33Å; R364-L366 PolarHBondContact O-N 3.33Å; R364-A367 PolarHBondContact O-N 3.16Å; R364-E368 PolarHBondContact O-N 2.91Å
365	Q	85.8	Confident	89.2	Confident	152 Å²	152	57.8 Å²	57.8	71%	0.71	27%	0.27	S	S	*	.	H	α-helix	trans	-66.5	-37.6	179.5	-170.1	173	24.6	0	0	111.6	V363	V363-Q365 PolarHBondContact O-N 3.47Å
366	L	86.1	Confident	89.2	Confident	68 Å²	68	58.4 Å²	58.4	36%	0.356	27%	0.273	S	S	.	.	H	α-helix	trans	-71.1	-31	176.1	-68	172.5	0	0	0	112.6	L331 V363 R364 E368 D369 F370	L331-L366 HydrophobicContact CD1-CB 4.34Å; V363-L366 PolarHBondContact O-N 3.43Å; R364-L366 VanDerWaalsContact C-N 3.33Å; R364-L366 PolarHBondContact O-N 3.33Å; L366-E368 VanDerWaalsContact C-N 3.34Å; L366-D369 PolarHBondContact O-N 2.84Å; L366-F370 WeakPolarHBondContact O-CD2 3.46Å; L366-F370 WeakPolarHBondContact O-CE2 3.43Å
367	A	89.9	Confident	89.4	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.008	27%	0.273	C	S	.	.	H	α-helix	trans	-67.9	-33.1	178.2	0	0	0	0	0	112.7	L331 M354 W359 V363 R364 D369 F370 L371	L331-A367 HydrophobicContact CD1-CB 4.22Å; M354-A367 HydrophobicContact CE-CB 4.02Å; M354-A367 HydrophobicContact SD-CB 3.65Å; W359-A367 HydrophobicContact CH2-CB 3.7Å; W359-A367 HydrophobicContact CZ2-CB 3.54Å; V363-A367 VanDerWaalsContact O-CB 3.3Å; V363-A367 WeakPolarHBondContact O-CB 3.45Å; V363-A367 PolarHBondContact O-N 2.98Å; R364-A367 PolarHBondContact O-N 3.16Å; A367-D369 PolarHBondContact O-N 3.26Å; A367-F370 PolarHBondContact O-N 3.42Å; A367-L371 HydrophobicContact CB-CD1 4.13Å; A367-L371 WeakPolarHBondContact O-CD1 3.3Å; A367-L371 WeakPolarHBondContact O-CG 3.47Å; A367-L371 PolarHBondContact O-N 3.42Å
368	E	89.2	Confident	89.7	Confident	97 Å²	97	58.1 Å²	58.1	45%	0.453	27%	0.27	S	S	.	.	H	α-helix	trans	-58	-28.4	178.6	-72.1	178.5	176.8	0	0	112.6	R364 L366 F370 L371 Y374	R364-E368 PolarHBondContact O-N 2.91Å; L366-E368 VanDerWaalsContact C-N 3.34Å; E368-F370 PolarHBondContact O-N 2.84Å; E368-L371 PolarHBondContact O-N 3.34Å; E368-Y374 HydrophobicContact CG-CE1 4.06Å
369	D	89.8	Confident	90	Very high	97 Å²	97	58.8 Å²	58.8	52%	0.519	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-23.3	175.9	-83	5.6	0	0	0	114	R340 L366 A367	R340-D369 IonicContact CZ-OD2 2.65Å; R340-D369 IonicContact NH1-OD2 3.46Å; R340-D369 PolarHBondContact NH1-OD2 2.99Å; R340-D369 IonicContact NH2-OD2 2.66Å; R340-D369 PolarHBondContact NH2-OD2 2.58Å; L366-D369 PolarHBondContact O-N 2.84Å; A367-D369 PolarHBondContact O-N 3.26Å
370	F	90.9	Very high	90	Very high	7 Å²	7	58.9 Å²	58.9	3%	0.031	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.1	-13	-175.1	-54.3	-67.7	0	0	0	113.4	L331 I339 R340 V343 R350 T352 M354 L366 A367 E368	L331-F370 HydrophobicContact CD2-CD2 4.33Å; L331-F370 HydrophobicContact CD2-CE2 3.63Å; L331-F370 HydrophobicContact CD2-CZ 4.48Å; I339-F370 HydrophobicContact CG2-CD1 4.42Å; I339-F370 HydrophobicContact CG2-CE1 4.02Å; I339-F370 HydrophobicContact CG2-CE2 4.44Å; I339-F370 HydrophobicContact CG2-CZ 4.02Å; R340-F370 HydrophobicContact CB-CE1 4.15Å; R340-F370 HydrophobicContact CB-CZ 4.39Å; R340-F370 HydrophobicContact CG-CE1 4.41Å; V343-F370 HydrophobicContact CB-CD1 4.17Å; V343-F370 HydrophobicContact CG1-CD1 4.02Å; V343-F370 HydrophobicContact CG2-CD1 4.14Å; R350-F370 PolarHBondContact NH2-O 3.02Å; R350-F370 VanDerWaalsContact NH2-O 3.17Å; T352-F370 PolarHBondContact OG1-O 3.38Å; M354-F370 HydrophobicContact CE-CB 3.61Å; M354-F370 HydrophobicContact CE-CD2 4.04Å; M354-F370 HydrophobicContact CE-CG 4.26Å; L366-F370 WeakPolarHBondContact O-CD2 3.46Å; L366-F370 WeakPolarHBondContact O-CE2 3.43Å; A367-F370 PolarHBondContact O-N 3.42Å; E368-F370 PolarHBondContact O-N 2.84Å
371	L	92.4	Very high	89.8	Confident	18 Å²	18	60.8 Å²	60.8	9%	0.094	29%	0.288	C	S	.	.			trans	-108.7	153	-171.3	-67.9	167.4	0	0	0	111.6	D210 V212 T352 M354 A367 E368 Y374	D210-L371 HydrophobicContact CB-CD2 4.12Å; V212-L371 HydrophobicContact CG2-CD1 3.6Å; T352-L371 HydrophobicContact CG2-CD2 3.8Å; M354-L371 HydrophobicContact CE-CD1 3.93Å; M354-L371 HydrophobicContact CE-CD2 4.06Å; M354-L371 HydrophobicContact CE-CG 3.68Å; M354-L371 HydrophobicContact CG-CD2 4.27Å; M354-L371 HydrophobicContact SD-CD1 3.95Å; M354-L371 HydrophobicContact SD-CD2 4.48Å; M354-L371 HydrophobicContact SD-CG 4.29Å; A367-L371 HydrophobicContact CB-CD1 4.13Å; A367-L371 WeakPolarHBondContact O-CD1 3.3Å; A367-L371 WeakPolarHBondContact O-CG 3.47Å; A367-L371 PolarHBondContact O-N 3.42Å; E368-L371 PolarHBondContact O-N 3.34Å; L371-Y374 HydrophobicContact CB-CD1 3.84Å; L371-Y374 HydrophobicContact CB-CG 4.04Å; L371-Y374 HydrophobicContact CD1-CD1 4.1Å; L371-Y374 HydrophobicContact CD1-CD2 3.95Å; L371-Y374 HydrophobicContact CD1-CE1 4.39Å; L371-Y374 HydrophobicContact CD1-CE2 4.22Å; L371-Y374 HydrophobicContact CD1-CG 3.88Å; L371-Y374 HydrophobicContact CG-CG 4.41Å
372	R	89.9	Confident	89.6	Confident	165 Å²	165	57.6 Å²	57.6	62%	0.623	28%	0.279	S	S	*	.	S	Bend	trans	-135.2	126.3	174.5	-175.1	179.2	178.1	175.6	2.6	111.7	D210 Y374	D210-R372 WeakPolarHBondContact CB-O 3.24Å; D210-R372 PolarHBondContact OD2-N 2.92Å; R372-Y374 PolarHBondContact O-N 3.47Å; R372-Y374 VanDerWaalsContact O-N 3.13Å
373	D	90	Very high	89.5	Confident	122 Å²	122	57.5 Å²	57.5	65%	0.652	28%	0.278	S	S	*	.	S	Bend	trans	46.5	42.4	178.1	-58	-42.2	0	0	0	113	R209	R209-D373 PolarHBondContact NH1-O 3.13Å
374	Y	94	Very high	89.2	Confident	30 Å²	30	59.5 Å²	59.5	12%	0.118	29%	0.289	C	S	.	.			trans	-80.8	157.1	-167.2	75.5	-80.9	0	0	0	113	R161 D210 V212 E368 L371 R372 Q376	R161-Y374 PolarHBondContact NH1-OH 3.43Å; D210-Y374 CarbonylContact O-C 3.44Å; D210-Y374 VanDerWaalsContact O-CA 3.23Å; D210-Y374 WeakPolarHBondContact O-CA 3.45Å; V212-Y374 HydrophobicContact CB-CD2 4.47Å; V212-Y374 HydrophobicContact CG2-CD2 3.7Å; V212-Y374 HydrophobicContact CG2-CE2 3.79Å; E368-Y374 HydrophobicContact CG-CE1 4.06Å; L371-Y374 HydrophobicContact CB-CD1 3.84Å; L371-Y374 HydrophobicContact CB-CG 4.04Å; L371-Y374 HydrophobicContact CD1-CD1 4.1Å; L371-Y374 HydrophobicContact CD1-CD2 3.95Å; L371-Y374 HydrophobicContact CD1-CE1 4.39Å; L371-Y374 HydrophobicContact CD1-CE2 4.22Å; L371-Y374 HydrophobicContact CD1-CG 3.88Å; L371-Y374 HydrophobicContact CG-CG 4.41Å; R372-Y374 PolarHBondContact O-N 3.47Å; R372-Y374 VanDerWaalsContact O-N 3.13Å; Y374-Q376 HydrophobicContact CE2-CB 4.32Å
375	T	95.1	Very high	88.8	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	129.6	174.7	-60.6	0	0	0	0	110.4	V160 D164 V165 C166 L204 R209 D210 M211 V212 I377	V160-T375 HydrophobicContact CG1-CG2 4.19Å; D164-T375 HydrophobicContact CB-CG2 3.73Å; D164-T375 WeakPolarHBondContact OD2-CA 3.29Å; V165-T375 PolarHBondContact O-OG1 2.57Å; C166-T375 HydrophobicContact CB-CG2 4.01Å; L204-T375 HydrophobicContact CD1-CG2 4.09Å; L204-T375 HydrophobicContact CD2-CG2 3.78Å; R209-T375 PolarHBondContact NH1-OG1 3.09Å; D210-T375 PolarHBondContact O-N 2.93Å; M211-T375 CarbonylContact C-O 3.58Å; M211-T375 WeakPolarHBondContact CA-O 3.44Å; M211-T375 WeakPolarHBondContact CB-O 3.03Å; V212-T375 PolarHBondContact N-O 2.98Å; T375-I377 HydrophobicContact CG2-CG2 4.22Å
376	Q	94.7	Very high	88.8	Confident	13 Å²	13	49.7 Å²	49.7	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	128.3	174.3	-174.8	-176.4	-37.9	0	0	111.5	R161 D164 V212 I214 Y374 N378	R161-Q376 HydrophobicContact CB-CB 3.96Å; R161-Q376 PolarHBondContact N-O 2.81Å; D164-Q376 PolarHBondContact OD2-N 3.44Å; V212-Q376 HydrophobicContact CB-CB 4.43Å; V212-Q376 HydrophobicContact CB-CG 4.21Å; V212-Q376 HydrophobicContact CG1-CG 4.34Å; I214-Q376 HydrophobicContact CD1-CG 4.1Å; Y374-Q376 HydrophobicContact CE2-CB 4.32Å; Q376-N378 PolarHBondContact NE2-OD1 3Å
377	I	94.8	Very high	88.7	Confident	1 Å²	1	46.8 Å²	46.8	1%	0.005	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	138.3	173.6	69.2	175.2	0	0	0	110.5	T159 V160 I197 Q200 L204 M211 V212 I214 T375	T159-I377 WeakPolarHBondContact O-CA 3.33Å; V160-I377 HydrophobicContact CG2-CG2 4.34Å; I197-I377 HydrophobicContact CD1-CD1 3.67Å; I197-I377 HydrophobicContact CD1-CG1 4.02Å; Q200-I377 HydrophobicContact CB-CD1 4.23Å; Q200-I377 HydrophobicContact CG-CB 4.36Å; Q200-I377 HydrophobicContact CG-CD1 4.13Å; Q200-I377 HydrophobicContact CG-CG2 3.89Å; L204-I377 HydrophobicContact CD2-CD1 4.4Å; L204-I377 HydrophobicContact CD2-CG2 3.72Å; M211-I377 HydrophobicContact CE-CD1 3.56Å; M211-I377 HydrophobicContact CE-CG1 4.09Å; V212-I377 PolarHBondContact O-N 2.91Å; I214-I377 PolarHBondContact N-O 3.01Å; T375-I377 HydrophobicContact CG2-CG2 4.22Å
378	N	94	Very high	88.6	Confident	8 Å²	8	51.1 Å²	51.1	4%	0.043	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136	179.9	-74.5	74.4	0	0	0	109.2	I158 T159 I214 Q376 L382	I158-N378 CarbonylContact C-O 3.59Å; I158-N378 WeakPolarHBondContact CA-O 3.43Å; T159-N378 PolarHBondContact N-O 3.21Å; T159-N378 PolarHBondContact O-N 3.44Å; I214-N378 VanDerWaalsContact CD1-ND2 3.29Å; I214-N378 WeakPolarHBondContact CD1-ND2 3.37Å; I214-N378 CarbonylContact O-C 3.57Å; I214-N378 WeakPolarHBondContact O-CA 3.23Å; Q376-N378 PolarHBondContact NE2-OD1 3Å; N378-L382 HydrophobicContact CB-CD2 3.83Å
379	V	92	Very high	88.7	Confident	16 Å²	16	49.6 Å²	49.6	10%	0.097	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	128	171	175.8	0	0	0	0	108.8	E157 I158 P196 I197 I214 A215	E157-V379 CarbonylContact O-C 3.58Å; E157-V379 WeakPolarHBondContact O-CA 3.3Å; I158-V379 HydrophobicContact CG1-CG2 4.21Å; P196-V379 HydrophobicContact CB-CG1 3.68Å; P196-V379 HydrophobicContact CB-CG2 4.14Å; P196-V379 HydrophobicContact CG-CG1 4.42Å; I197-V379 HydrophobicContact CB-CG2 3.94Å; I197-V379 HydrophobicContact CD1-CG2 3.92Å; I197-V379 HydrophobicContact CG1-CG2 4.5Å; I214-V379 PolarHBondContact O-N 3.39Å; A215-V379 HydrophobicContact CB-CB 3.89Å; A215-V379 HydrophobicContact CB-CG2 4.24Å
380	G	88	Confident	88.9	Confident	19 Å²	19	45 Å²	45	20%	0.196	22%	0.224	C	C	.	.	S	Bend	trans	85.9	-153.9	-174.7	0	0	0	0	0	111.8	E157	E157-G380 PolarHBondContact O-N 2.93Å
381	N	82.6	Confident	89.1	Confident	69 Å²	69	49 Å²	49	37%	0.369	25%	0.245	S	C	.	.			trans	-68.5	146.4	-178	-158.1	-20	0	0	0	111.8	E383 E539	N381-E383 PolarHBondContact O-N 3.23Å; N381-E383 PolarHBondContact OD1-N 3.27Å; N381-E539 VanDerWaalsContact CB-OE1 3.25Å; N381-E539 WeakPolarHBondContact CB-OE1 3.45Å; N381-E539 WeakPolarHBondContact ND2-CG 3.49Å; N381-E539 PolarHBondContact ND2-OE1 2.9Å
382	L	81.4	Confident	89.3	Confident	101 Å²	101	48.3 Å²	48.3	53%	0.529	24%	0.242	S	C	.	.	S	Bend	trans	-73	-22	176.5	-65.7	177.4	0	0	0	112.3	T159 N378	T159-L382 HydrophobicContact CG2-CD2 4.1Å; N378-L382 HydrophobicContact CB-CD2 3.83Å
383	E	83	Confident	89.6	Confident	135 Å²	135	43.2 Å²	43.2	63%	0.631	23%	0.226	S	C	*	.	S	Bend	trans	-83.1	170	172.9	-59.1	-161.6	163.1	0	0	111.8	N381 S385	N381-E383 PolarHBondContact O-N 3.23Å; N381-E383 PolarHBondContact OD1-N 3.27Å; E383-S385 PolarHBondContact O-N 3.06Å; E383-S385 PolarHBondContact O-OG 3.36Å
384	L	81.5	Confident	89.8	Confident	52 Å²	52	37.8 Å²	37.8	27%	0.272	20%	0.198	S	C	.	.			trans	-61.9	106.6	177.1	-179.8	65.8	0	0	0	109.7	T358 E500 V503 V536	T358-L384 HydrophobicContact CG2-CD1 3.39Å; L384-E500 HydrophobicContact CD1-CG 4.27Å; L384-V503 HydrophobicContact CD1-CB 4.38Å; L384-V503 HydrophobicContact CD1-CG2 3.9Å; L384-V503 HydrophobicContact CD2-CG2 4.32Å; L384-V503 HydrophobicContact CG-CG2 3.98Å; L384-V536 HydrophobicContact CD2-CG2 3.84Å; L384-V536 HydrophobicContact CG-CG2 4.09Å
385	S	80.5	Confident	89.9	Confident	23 Å²	23	38.2 Å²	38.2	16%	0.161	20%	0.202	C	C	.	.			trans	-116.1	138.6	-177.4	44	0	0	0	0	110.7	E383 V503 E539	E383-S385 PolarHBondContact O-N 3.06Å; E383-S385 PolarHBondContact O-OG 3.36Å; S385-V503 WeakPolarHBondContact O-CG1 3.45Å; S385-E539 WeakPolarHBondContact CA-OE2 3.38Å; S385-E539 VanDerWaalsContact CB-CD 3.46Å; S385-E539 WeakPolarHBondContact CB-OE2 3.19Å
386	A	84.9	Confident	89.9	Confident	2 Å²	2	39.2 Å²	39.2	2%	0.017	21%	0.208	C	C	.	.			trans	-87.7	162.9	169.2	0	0	0	0	0	109.8	H388 V503 I506 V536	A386-H388 PolarHBondContact O-CD2 3.28Å; A386-H388 PolarHBondContact O-N 2.85Å; A386-V503 HydrophobicContact CB-CG2 4.42Å; A386-I506 HydrophobicContact CB-CD1 3.78Å; A386-V536 HydrophobicContact CB-CG1 3.99Å
387	N	85	Confident	89.9	Confident	7 Å²	7	38.8 Å²	38.8	4%	0.037	21%	0.206	C	C	.	.			trans	-65.7	122.1	170.3	-178.1	-18.8	0	0	0	109.6	Q216 N389 I390 A510	Q216-N387 VanDerWaalsContact OE1-CG 3.27Å; Q216-N387 PolarHBondContact OE1-OD1 3.11Å; N387-N389 PolarHBondContact O-N 2.92Å; N387-N389 VanDerWaalsContact O-N 3.17Å; N387-N389 WeakPolarHBondContact OD1-CB 3.35Å; N387-N389 PolarHBondContact OD1-N 2.82Å; N387-I390 HydrophobicContact CB-CD1 3.86Å; N387-I390 HydrophobicContact CB-CG1 4.17Å; N387-I390 WeakPolarHBondContact O-CB 3.33Å; N387-I390 WeakPolarHBondContact O-CG1 3.09Å; N387-I390 PolarHBondContact O-N 2.83Å; N387-I390 VanDerWaalsContact O-N 3.14Å; N387-A510 PolarHBondContact ND2-O 3.32Å
388	H	88.2	Confident	89.9	Confident	91 Å²	91	43.8 Å²	43.8	42%	0.421	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-13.6	-176.8	-62.5	176.3	0	0	0	113.6	A386 I390 E539	A386-H388 PolarHBondContact O-CD2 3.28Å; A386-H388 PolarHBondContact O-N 2.85Å; H388-I390 PolarHBondContact O-N 2.98Å; H388-E539 IonicContact CD2-OE2 3.58Å; H388-E539 IonicContact CE1-OE1 3.43Å; H388-E539 IonicContact NE2-OE1 3.21Å; H388-E539 PolarHBondContact NE2-OE1 3.32Å; H388-E539 IonicContact NE2-OE2 2.81Å; H388-E539 PolarHBondContact NE2-OE2 2.81Å; H388-E539 VanDerWaalsContact NE2-OE2 3.09Å
389	N	90.4	Very high	89.9	Confident	65 Å²	65	47.4 Å²	47.4	35%	0.348	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77	-1.6	173.6	-68.4	-32.1	0	0	0	113.9	N387 A510 G516	N387-N389 PolarHBondContact O-N 2.92Å; N387-N389 VanDerWaalsContact O-N 3.17Å; N387-N389 WeakPolarHBondContact OD1-CB 3.35Å; N387-N389 PolarHBondContact OD1-N 2.82Å; N389-A510 HydrophobicContact CB-CB 4.02Å; N389-G516 PolarHBondContact O-N 2.66Å
390	I	93.3	Very high	90	Very high	2 Å²	2	51.5 Å²	51.5	1%	0.01	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	121.7	179.2	-55.7	170.2	0	0	0	109.6	N387 H388 Q392 I506 T509 A510 G516 A518 Q542	N387-I390 HydrophobicContact CB-CD1 3.86Å; N387-I390 HydrophobicContact CB-CG1 4.17Å; N387-I390 WeakPolarHBondContact O-CB 3.33Å; N387-I390 WeakPolarHBondContact O-CG1 3.09Å; N387-I390 PolarHBondContact O-N 2.83Å; N387-I390 VanDerWaalsContact O-N 3.14Å; H388-I390 PolarHBondContact O-N 2.98Å; I390-Q392 HydrophobicContact CB-CG 4.43Å; I390-Q392 HydrophobicContact CG2-CG 3.97Å; I390-Q392 PolarHBondContact O-N 3.17Å; I390-I506 HydrophobicContact CD1-CB 4.19Å; I390-I506 HydrophobicContact CD1-CD1 4.23Å; I390-I506 HydrophobicContact CD1-CG1 3.89Å; I390-I506 WeakPolarHBondContact CD1-O 3.46Å; I390-T509 HydrophobicContact CG1-CG2 4.37Å; I390-T509 HydrophobicContact CG2-CG2 4.29Å; I390-A510 HydrophobicContact CD1-CB 4.4Å; I390-A510 HydrophobicContact CG1-CB 3.49Å; I390-A510 VanDerWaalsContact CG1-CB 3.49Å; I390-G516 CarbonylContact C-O 3.59Å; I390-G516 WeakPolarHBondContact CA-O 3.4Å; I390-A518 HydrophobicContact CG2-CB 3.72Å; I390-Q542 PolarHBondContact O-NE2 2.81Å
391	L	95.7	Very high	90.3	Very high	89 Å²	89	54.6 Å²	54.6	47%	0.466	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.1	116.5	164.8	176.1	62.8	0	0	0	108.9	I393 G516 T517 A518	L391-I393 HydrophobicContact CD2-CD1 4.07Å; L391-I393 HydrophobicContact CG-CD1 4.23Å; L391-I393 HydrophobicContact CG-CG1 4.21Å; L391-G516 PolarHBondContact N-O 3.46Å; L391-T517 HydrophobicContact CB-CG2 4.3Å; L391-T517 HydrophobicContact CD2-CG2 4.13Å; L391-T517 HydrophobicContact CG-CG2 4.28Å; L391-T517 CarbonylContact O-C 3.55Å; L391-T517 WeakPolarHBondContact O-CA 3.31Å; L391-A518 PolarHBondContact O-N 3.23Å
392	Q	96.1	Very high	91	Very high	5 Å²	5	51.5 Å²	51.5	2%	0.023	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	116.3	-175.5	-57.3	-178.7	57.8	0	0	110.6	I390 Y502 I506 L537 Q542	I390-Q392 HydrophobicContact CB-CG 4.43Å; I390-Q392 HydrophobicContact CG2-CG 3.97Å; I390-Q392 PolarHBondContact O-N 3.17Å; Q392-Y502 PolarHBondContact OE1-OH 3.13Å; Q392-I506 HydrophobicContact CG-CD1 4.29Å; Q392-L537 HydrophobicContact CB-CD2 3.62Å; Q392-L537 HydrophobicContact CG-CD2 4.39Å; Q392-Q542 HydrophobicContact CB-CB 4.48Å; Q392-Q542 HydrophobicContact CB-CG 3.97Å; Q392-Q542 HydrophobicContact CG-CG 4.14Å
393	I	96	Very high	91.6	Very high	57 Å²	57	48.5 Å²	48.5	29%	0.292	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	119.7	-179.5	-60.9	168.8	0	0	0	108.7	L391 T517 A518 Y519 T520	L391-I393 HydrophobicContact CD2-CD1 4.07Å; L391-I393 HydrophobicContact CG-CD1 4.23Å; L391-I393 HydrophobicContact CG-CG1 4.21Å; I393-T517 HydrophobicContact CD1-CG2 4.07Å; I393-A518 PolarHBondContact N-O 2.81Å; I393-Y519 HydrophobicContact CB-CD1 3.78Å; I393-Y519 HydrophobicContact CB-CE1 3.89Å; I393-Y519 HydrophobicContact CD1-CD1 4.15Å; I393-Y519 HydrophobicContact CD1-CE1 3.4Å; I393-Y519 HydrophobicContact CD1-CE2 4.35Å; I393-Y519 HydrophobicContact CG1-CE1 4.23Å; I393-Y519 HydrophobicContact CG2-CD1 3.74Å; I393-Y519 HydrophobicContact CG2-CE1 3.75Å; I393-Y519 CarbonylContact O-C 3.47Å; I393-Y519 WeakPolarHBondContact O-CA 3.23Å; I393-T520 PolarHBondContact O-N 2.92Å
394	V	95.8	Very high	92.2	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	120.4	176.4	-176.3	0	0	0	0	109.5	F522 L533 L537 N545 L548	V394-F522 HydrophobicContact CG1-CB 3.69Å; V394-F522 HydrophobicContact CG1-CG 4.36Å; V394-L533 HydrophobicContact CG1-CD2 4.33Å; V394-L533 HydrophobicContact CG2-CD2 4.23Å; V394-L537 HydrophobicContact CG2-CD1 3.91Å; V394-L537 HydrophobicContact CG2-CD2 4.41Å; V394-N545 WeakPolarHBondContact O-CB 3.49Å; V394-N545 PolarHBondContact O-ND2 3.14Å; V394-L548 HydrophobicContact CG1-CD2 4.3Å
395	D	95.8	Very high	92.9	Very high	39 Å²	39	47.6 Å²	47.6	21%	0.209	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	113.4	176.4	-171.8	6.2	0	0	0	110.2	C397 K405 T520 F521 F522	D395-C397 PolarHBondContact O-N 3.2Å; D395-K405 IonicContact OD1-NZ 3.21Å; D395-K405 WeakPolarHBondContact OD2-CD 3.36Å; D395-K405 VanDerWaalsContact OD2-CE 3.29Å; D395-K405 WeakPolarHBondContact OD2-CE 3.44Å; D395-K405 IonicContact OD2-NZ 3.09Å; D395-K405 PolarHBondContact OD2-NZ 3.38Å; D395-T520 PolarHBondContact N-O 3.16Å; D395-F521 HydrophobicContact CB-CD1 4.22Å; D395-F522 PolarHBondContact O-N 3.24Å
396	V	94.5	Very high	93.6	Very high	20 Å²	20	46.7 Å²	46.7	12%	0.121	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	111.1	179.1	179.8	0	0	0	0	109.2	F522 K547 L548 L551	V396-F522 VanDerWaalsContact CA-O 3.3Å; V396-F522 WeakPolarHBondContact CA-O 3.41Å; V396-K547 HydrophobicContact CB-CB 3.78Å; V396-K547 HydrophobicContact CB-CD 4.26Å; V396-K547 HydrophobicContact CG1-CB 4.18Å; V396-K547 HydrophobicContact CG2-CB 3.9Å; V396-L548 HydrophobicContact CG2-CB 4.01Å; V396-L548 HydrophobicContact CG2-CD1 4.33Å; V396-L551 HydrophobicContact CG1-CD1 3.45Å; V396-L551 VanDerWaalsContact CG1-CD1 3.45Å; V396-L551 HydrophobicContact CG1-CG 4.27Å; V396-L551 HydrophobicContact CG2-CD1 4.33Å
397	C	94.4	Very high	94.1	Very high	5 Å²	5	49.2 Å²	49.2	3%	0.034	25%	0.253	C	S	.	.			trans	-141.7	167.8	-173.1	63	0	0	0	0	112.5	D395 E401 K405 F522 T523	D395-C397 PolarHBondContact O-N 3.2Å; C397-E401 WeakPolarHBondContact CA-OE2 3.25Å; C397-E401 HydrophobicContact CB-CB 4.31Å; C397-E401 WeakPolarHBondContact CB-OE2 3.5Å; C397-K405 HydrophobicContact CB-CD 3.64Å; C397-F522 PolarHBondContact N-O 2.99Å; C397-T523 WeakPolarHBondContact O-CA 3.4Å
398	M	94.9	Very high	94.6	Very high	105 Å²	105	53 Å²	53	52%	0.517	27%	0.271	S	S	.	.			trans	-82.3	154.1	170.8	-62.8	-64	-177.3	0	0	110.8	S400 E401 P524	M398-S400 PolarHBondContact O-N 2.87Å; M398-S400 VanDerWaalsContact O-N 3.16Å; M398-E401 HydrophobicContact CB-CG 4.08Å; M398-E401 PolarHBondContact N-OE2 3.35Å; M398-E401 WeakPolarHBondContact O-CB 3.44Å; M398-E401 PolarHBondContact O-N 3.13Å; M398-P524 HydrophobicContact SD-CG 4.05Å
399	E	94	Very high	95	Very high	84 Å²	84	49.3 Å²	49.3	39%	0.393	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-54.9	-36.7	179.4	-174.4	64.3	-158.7	0	0	112.7	E401 K402 R430	E399-E401 VanDerWaalsContact C-N 3.26Å; E399-E401 PolarHBondContact O-N 3.31Å; E399-K402 PolarHBondContact O-N 3.18Å; E399-K402 IonicContact OE1-NZ 3.26Å; E399-K402 PolarHBondContact OE1-NZ 3.31Å; E399-K402 WeakPolarHBondContact OE2-CE 3.21Å; E399-K402 IonicContact OE2-NZ 3.23Å; E399-K402 PolarHBondContact OE2-NZ 3.1Å; E399-R430 IonicContact OE1-CZ 3.64Å; E399-R430 IonicContact OE1-NH1 3.42Å; E399-R430 PolarHBondContact OE1-NH1 3.18Å; E399-R430 VanDerWaalsContact OE1-NH1 3.16Å; E399-R430 IonicContact OE1-NH2 3.54Å; E399-R430 PolarHBondContact OE1-NH2 3.18Å
400	S	94.2	Very high	95.2	Very high	103 Å²	103	46.2 Å²	46.2	72%	0.72	24%	0.238	S	C	*	.	G	3₁₀ helix	trans	-69.5	-19.5	178.1	53.2	0	0	0	0	114.3	M398	M398-S400 PolarHBondContact O-N 2.87Å; M398-S400 VanDerWaalsContact O-N 3.16Å
401	E	95.2	Very high	95.3	Very high	83 Å²	83	51.7 Å²	51.7	39%	0.388	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-88.6	-17	-176.9	-62.9	172.1	167	0	0	112.2	C397 M398 E399 D403 H404 K405	C397-E401 WeakPolarHBondContact CA-OE2 3.25Å; C397-E401 HydrophobicContact CB-CB 4.31Å; C397-E401 WeakPolarHBondContact CB-OE2 3.5Å; M398-E401 HydrophobicContact CB-CG 4.08Å; M398-E401 PolarHBondContact N-OE2 3.35Å; M398-E401 WeakPolarHBondContact O-CB 3.44Å; M398-E401 PolarHBondContact O-N 3.13Å; E399-E401 VanDerWaalsContact C-N 3.26Å; E399-E401 PolarHBondContact O-N 3.31Å; E401-D403 VanDerWaalsContact C-N 3.28Å; E401-D403 PolarHBondContact O-N 2.86Å; E401-H404 PolarHBondContact O-N 2.96Å; E401-K405 HydrophobicContact CB-CD 4.34Å; E401-K405 WeakPolarHBondContact O-CG 3.3Å; E401-K405 PolarHBondContact O-N 2.93Å
402	K	95.6	Very high	95.3	Very high	4 Å²	4	53.4 Å²	53.4	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-55	-41.5	-176	-72.8	-178.5	167.4	174.2	0	113	E399 K405 L406 Y493 D494 F521 T523	E399-K402 PolarHBondContact O-N 3.18Å; E399-K402 IonicContact OE1-NZ 3.26Å; E399-K402 PolarHBondContact OE1-NZ 3.31Å; E399-K402 WeakPolarHBondContact OE2-CE 3.21Å; E399-K402 IonicContact OE2-NZ 3.23Å; E399-K402 PolarHBondContact OE2-NZ 3.1Å; K402-K405 PolarHBondContact O-N 3.3Å; K402-L406 VanDerWaalsContact O-CB 3.25Å; K402-L406 WeakPolarHBondContact O-CB 3.42Å; K402-L406 PolarHBondContact O-N 2.83Å; K402-Y493 HydrophobicContact CB-CD2 4.33Å; K402-Y493 HydrophobicContact CB-CE1 4.35Å; K402-Y493 HydrophobicContact CB-CE2 3.66Å; K402-Y493 HydrophobicContact CD-CD1 4.38Å; K402-Y493 HydrophobicContact CD-CE1 4.08Å; K402-Y493 WeakPolarHBondContact CD-O 3.45Å; K402-Y493 WeakPolarHBondContact CE-O 3.46Å; K402-Y493 PolarHBondContact NZ-O 3.23Å; K402-Y493 VanDerWaalsContact NZ-O 3.14Å; K402-D494 IonicContact NZ-OD1 3.13Å; K402-D494 PolarHBondContact NZ-OD1 3.11Å; K402-F521 HydrophobicContact CB-CD2 4.22Å; K402-F521 HydrophobicContact CG-CB 4.18Å; K402-F521 HydrophobicContact CG-CD2 4.12Å; K402-F521 HydrophobicContact CG-CG 4.43Å; K402-T523 VanDerWaalsContact CE-CG2 3.46Å
403	D	94.6	Very high	95.2	Very high	38 Å²	38	53.3 Å²	53.3	20%	0.203	27%	0.269	C	S	.	.	H	α-helix	trans	-63.1	-46	-179.7	-74.6	-29.9	0	0	0	112.1	E401 L406 I407 R437 Y493	E401-D403 VanDerWaalsContact C-N 3.28Å; E401-D403 PolarHBondContact O-N 2.86Å; D403-L406 PolarHBondContact O-N 3.49Å; D403-I407 WeakPolarHBondContact O-CG1 3.35Å; D403-I407 PolarHBondContact O-N 3.18Å; D403-I407 VanDerWaalsContact O-N 3.17Å; D403-R437 VanDerWaalsContact CG-NH1 3.26Å; D403-R437 IonicContact OD1-NH1 3.44Å; D403-R437 IonicContact OD2-CZ 3.95Å; D403-R437 VanDerWaalsContact OD2-CZ 3.28Å; D403-R437 IonicContact OD2-NH1 3.8Å; D403-R437 PolarHBondContact OD2-NH1 3.01Å; D403-R437 IonicContact OD2-NH2 3.28Å; D403-R437 PolarHBondContact OD2-NH2 3.3Å; D403-Y493 PolarHBondContact OD1-OH 2.88Å
404	H	95.4	Very high	95.1	Very high	119 Å²	119	53 Å²	53	55%	0.551	27%	0.266	S	S	*	.	H	α-helix	trans	-67.2	-44.4	179.4	-176.7	59.1	0	0	0	111.3	E401 L406 I407 Q408	E401-H404 PolarHBondContact O-N 2.96Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.34Å; H404-I407 PolarHBondContact O-N 3.3Å; H404-Q408 PolarHBondContact NE2-NE2 3.5Å; H404-Q408 WeakPolarHBondContact O-CG 3.3Å; H404-Q408 PolarHBondContact O-N 3.12Å
405	K	95.7	Very high	95	Very high	50 Å²	50	56.8 Å²	56.8	22%	0.217	30%	0.298	C	S	.	.	H	α-helix	trans	-63	-38.1	177.1	-73.6	-179.4	163.9	-69.9	0	112.5	D395 C397 E401 K402 L409 F521	D395-K405 IonicContact OD1-NZ 3.21Å; D395-K405 WeakPolarHBondContact OD2-CD 3.36Å; D395-K405 VanDerWaalsContact OD2-CE 3.29Å; D395-K405 WeakPolarHBondContact OD2-CE 3.44Å; D395-K405 IonicContact OD2-NZ 3.09Å; D395-K405 PolarHBondContact OD2-NZ 3.38Å; C397-K405 HydrophobicContact CB-CD 3.64Å; E401-K405 HydrophobicContact CB-CD 4.34Å; E401-K405 WeakPolarHBondContact O-CG 3.3Å; E401-K405 PolarHBondContact O-N 2.93Å; K402-K405 PolarHBondContact O-N 3.3Å; K405-L409 VanDerWaalsContact O-CB 3.25Å; K405-L409 WeakPolarHBondContact O-CB 3.4Å; K405-L409 PolarHBondContact O-N 2.91Å; K405-F521 HydrophobicContact CB-CE1 3.83Å; K405-F521 HydrophobicContact CB-CE2 4.35Å; K405-F521 HydrophobicContact CB-CZ 3.71Å
406	L	96.6	Very high	94.9	Very high	4 Å²	4	59.8 Å²	59.8	2%	0.021	31%	0.311	C	S	.	.	H	α-helix	trans	-62.3	-47.8	175.4	-178.2	65.3	0	0	0	110.9	K402 D403 H404 L409 M410 I423 L434 M438 I491 Y493 F521	K402-L406 VanDerWaalsContact O-CB 3.25Å; K402-L406 WeakPolarHBondContact O-CB 3.42Å; K402-L406 PolarHBondContact O-N 2.83Å; D403-L406 PolarHBondContact O-N 3.49Å; H404-L406 VanDerWaalsContact C-N 3.33Å; H404-L406 PolarHBondContact O-N 3.34Å; L406-L409 PolarHBondContact O-N 3.36Å; L406-M410 HydrophobicContact CD1-CG 4.06Å; L406-M410 HydrophobicContact CD1-SD 4.45Å; L406-M410 HydrophobicContact CG-CG 4.18Å; L406-M410 WeakPolarHBondContact O-CB 3.39Å; L406-M410 WeakPolarHBondContact O-CG 3.29Å; L406-M410 PolarHBondContact O-N 3.18Å; L406-I423 HydrophobicContact CD1-CD1 4.06Å; L406-I423 HydrophobicContact CD1-CG2 4.49Å; L406-L434 HydrophobicContact CD2-CD1 3.79Å; L406-L434 HydrophobicContact CD2-CD2 4.14Å; L406-L434 HydrophobicContact CD2-CG 4.4Å; L406-M438 HydrophobicContact CD2-SD 4Å; L406-I491 HydrophobicContact CD1-CD1 4.09Å; L406-I491 HydrophobicContact CD1-CG2 4.06Å; L406-Y493 HydrophobicContact CB-CD2 4.22Å; L406-Y493 HydrophobicContact CB-CE2 4.19Å; L406-Y493 HydrophobicContact CD1-CD2 4.45Å; L406-Y493 HydrophobicContact CD2-CD2 3.81Å; L406-Y493 HydrophobicContact CD2-CE2 3.93Å; L406-Y493 HydrophobicContact CG-CD2 4.39Å; L406-F521 HydrophobicContact CB-CE2 4.03Å; L406-F521 HydrophobicContact CB-CZ 4.45Å; L406-F521 HydrophobicContact CD1-CE2 4.42Å
407	I	95.1	Very high	94.7	Very high	54 Å²	54	68.7 Å²	68.7	28%	0.277	35%	0.348	S	S	.	.	H	α-helix	trans	-61.8	-46.9	-179	-67.4	169.7	0	0	0	110.6	D403 H404 L409 M410 E411 W443	D403-I407 WeakPolarHBondContact O-CG1 3.35Å; D403-I407 PolarHBondContact O-N 3.18Å; D403-I407 VanDerWaalsContact O-N 3.17Å; H404-I407 PolarHBondContact O-N 3.3Å; I407-L409 VanDerWaalsContact C-N 3.32Å; I407-L409 PolarHBondContact O-N 3.32Å; I407-M410 PolarHBondContact O-N 2.8Å; I407-E411 WeakPolarHBondContact O-CG 3.13Å; I407-E411 PolarHBondContact O-N 2.72Å; I407-W443 HydrophobicContact CG2-CZ2 4.39Å
408	Q	95.2	Very high	94.6	Very high	86 Å²	86	73.5 Å²	73.5	40%	0.402	37%	0.37	S	S	.	.	H	α-helix	trans	-56.1	-47.4	175.6	-72.9	179.8	-35.6	0	0	111.9	H404 M410 E411 E412	H404-Q408 PolarHBondContact NE2-NE2 3.5Å; H404-Q408 WeakPolarHBondContact O-CG 3.3Å; H404-Q408 PolarHBondContact O-N 3.12Å; Q408-M410 VanDerWaalsContact C-N 3.33Å; Q408-M410 PolarHBondContact O-N 3.48Å; Q408-E411 PolarHBondContact O-N 2.74Å; Q408-E412 PolarHBondContact O-N 2.98Å
409	L	96.1	Very high	94.5	Very high	14 Å²	14	70.2 Å²	70.2	7%	0.073	36%	0.355	C	S	.	.	H	α-helix	trans	-64.9	-38.6	179.3	-173.7	65.4	0	0	0	112.1	K405 L406 I407 E412 I413 I491 Y519 F521	K405-L409 VanDerWaalsContact O-CB 3.25Å; K405-L409 WeakPolarHBondContact O-CB 3.4Å; K405-L409 PolarHBondContact O-N 2.91Å; L406-L409 PolarHBondContact O-N 3.36Å; I407-L409 VanDerWaalsContact C-N 3.32Å; I407-L409 PolarHBondContact O-N 3.32Å; L409-E412 PolarHBondContact O-N 3.22Å; L409-I413 HydrophobicContact CD1-CD1 4.27Å; L409-I413 HydrophobicContact CD2-CD1 4.41Å; L409-I413 HydrophobicContact CG-CD1 3.83Å; L409-I413 WeakPolarHBondContact O-CB 3.43Å; L409-I413 VanDerWaalsContact O-CG1 3.27Å; L409-I413 WeakPolarHBondContact O-CG1 3.25Å; L409-I413 PolarHBondContact O-N 3.02Å; L409-I491 HydrophobicContact CD2-CD1 3.68Å; L409-I491 HydrophobicContact CD2-CG1 3.93Å; L409-I491 HydrophobicContact CD2-CG2 4.25Å; L409-I491 HydrophobicContact CG-CD1 4.29Å; L409-Y519 HydrophobicContact CD1-CD1 3.86Å; L409-Y519 HydrophobicContact CD1-CD2 3.88Å; L409-Y519 HydrophobicContact CD1-CE1 3.71Å; L409-Y519 HydrophobicContact CD1-CE2 3.73Å; L409-Y519 HydrophobicContact CD1-CG 3.94Å; L409-Y519 HydrophobicContact CD2-CD1 4.06Å; L409-Y519 HydrophobicContact CD2-CD2 3.91Å; L409-Y519 HydrophobicContact CD2-CG 3.6Å; L409-Y519 HydrophobicContact CG-CD2 4.39Å; L409-Y519 HydrophobicContact CG-CG 4.4Å; L409-F521 HydrophobicContact CD2-CZ 4.34Å
410	M	95.9	Very high	94.5	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	34%	0.341	C	S	.	.	H	α-helix	trans	-69.1	-33.2	177.6	-71.4	-54.2	-47.2	0	0	112.5	L406 I407 Q408 M414 T421 I423 M438 W443 I471 I491	L406-M410 HydrophobicContact CD1-CG 4.06Å; L406-M410 HydrophobicContact CD1-SD 4.45Å; L406-M410 HydrophobicContact CG-CG 4.18Å; L406-M410 WeakPolarHBondContact O-CB 3.39Å; L406-M410 WeakPolarHBondContact O-CG 3.29Å; L406-M410 PolarHBondContact O-N 3.18Å; I407-M410 PolarHBondContact O-N 2.8Å; Q408-M410 VanDerWaalsContact C-N 3.33Å; Q408-M410 PolarHBondContact O-N 3.48Å; M410-M414 HydrophobicContact CE-CG 3.87Å; M410-M414 HydrophobicContact CE-SD 4.28Å; M410-M414 WeakPolarHBondContact O-CB 3.29Å; M410-M414 WeakPolarHBondContact O-CG 3.36Å; M410-M414 PolarHBondContact O-N 3.34Å; M410-T421 HydrophobicContact SD-CG2 4.2Å; M410-I423 HydrophobicContact SD-CD1 4.05Å; M410-M438 HydrophobicContact CG-CE 3.9Å; M410-W443 HydrophobicContact CB-CH2 3.99Å; M410-W443 HydrophobicContact CB-CZ2 4.2Å; M410-W443 HydrophobicContact CB-CZ3 4.17Å; M410-I471 HydrophobicContact CE-CD1 3.48Å; M410-I471 VanDerWaalsContact CE-CD1 3.48Å; M410-I471 HydrophobicContact CE-CG1 3.67Å; M410-I491 HydrophobicContact SD-CD1 3.72Å
411	E	94.9	Very high	94.6	Very high	118 Å²	118	62.3 Å²	62.3	55%	0.551	31%	0.306	S	S	*	.	H	α-helix	trans	-62.4	-43.6	172.8	-73.2	170.6	176.9	0	0	111.5	I407 Q408 A415 W443	I407-E411 WeakPolarHBondContact O-CG 3.13Å; I407-E411 PolarHBondContact O-N 2.72Å; Q408-E411 PolarHBondContact O-N 2.74Å; E411-A415 PolarHBondContact O-N 3.33Å; E411-W443 HydrophobicContact CG-CH2 3.83Å; E411-W443 HydrophobicContact CG-CZ2 4.02Å
412	E	94.9	Very high	94.6	Very high	125 Å²	125	58.6 Å²	58.6	58%	0.584	29%	0.289	S	S	*	.	H	α-helix	trans	-64.5	-49.6	175.3	-67.8	176.1	-169.6	0	0	111.6	Q408 L409 M414 A415	Q408-E412 PolarHBondContact O-N 2.98Å; L409-E412 PolarHBondContact O-N 3.22Å; E412-M414 PolarHBondContact O-N 3.49Å; E412-A415 WeakPolarHBondContact O-CB 3.44Å; E412-A415 PolarHBondContact O-N 3.28Å
413	I	95	Very high	94.6	Very high	3 Å²	3	58.4 Å²	58.4	2%	0.015	29%	0.288	C	S	.	.	H	α-helix	trans	-64.1	-43.3	-177.7	-71.2	168.2	0	0	0	111.8	L409 A415 E416 N419 T421 F489 I491	L409-I413 HydrophobicContact CD1-CD1 4.27Å; L409-I413 HydrophobicContact CD2-CD1 4.41Å; L409-I413 HydrophobicContact CG-CD1 3.83Å; L409-I413 WeakPolarHBondContact O-CB 3.43Å; L409-I413 VanDerWaalsContact O-CG1 3.27Å; L409-I413 WeakPolarHBondContact O-CG1 3.25Å; L409-I413 PolarHBondContact O-N 3.02Å; I413-A415 PolarHBondContact O-N 2.87Å; I413-E416 WeakPolarHBondContact O-CB 3.46Å; I413-E416 PolarHBondContact O-N 3.5Å; I413-N419 HydrophobicContact CG2-CB 4.01Å; I413-N419 VanDerWaalsContact O-CB 3.23Å; I413-N419 WeakPolarHBondContact O-CB 3.33Å; I413-T421 WeakPolarHBondContact CG2-OG1 3.07Å; I413-F489 HydrophobicContact CB-CD2 4.34Å; I413-F489 HydrophobicContact CB-CE2 4.38Å; I413-F489 HydrophobicContact CD1-CB 3.96Å; I413-F489 HydrophobicContact CD1-CD1 3.85Å; I413-F489 HydrophobicContact CD1-CD2 4.27Å; I413-F489 HydrophobicContact CD1-CE1 4.43Å; I413-F489 HydrophobicContact CD1-CG 3.76Å; I413-F489 HydrophobicContact CG1-CD1 3.9Å; I413-F489 HydrophobicContact CG1-CD2 4.03Å; I413-F489 HydrophobicContact CG1-CE1 4Å; I413-F489 HydrophobicContact CG1-CE2 4.13Å; I413-F489 HydrophobicContact CG1-CG 3.92Å; I413-F489 HydrophobicContact CG1-CZ 4.11Å; I413-F489 HydrophobicContact CG2-CD2 3.46Å; I413-F489 VanDerWaalsContact CG2-CD2 3.46Å; I413-F489 HydrophobicContact CG2-CE2 3.74Å; I413-F489 HydrophobicContact CG2-CG 4.05Å; I413-I491 HydrophobicContact CD1-CD1 3.87Å
414	M	93	Very high	94.7	Very high	50 Å²	50	56.6 Å²	56.6	25%	0.246	28%	0.279	C	S	.	.	H	α-helix	trans	-74.4	-13.8	-176	-69.1	-69.2	-60.2	0	0	113.1	M410 E412 E416 N419 W443 P444 P470 I471	M410-M414 HydrophobicContact CE-CG 3.87Å; M410-M414 HydrophobicContact CE-SD 4.28Å; M410-M414 WeakPolarHBondContact O-CB 3.29Å; M410-M414 WeakPolarHBondContact O-CG 3.36Å; M410-M414 PolarHBondContact O-N 3.34Å; E412-M414 PolarHBondContact O-N 3.49Å; M414-E416 VanDerWaalsContact C-N 3.28Å; M414-N419 HydrophobicContact SD-CB 3.99Å; M414-W443 HydrophobicContact CB-CZ3 3.97Å; M414-W443 HydrophobicContact CG-CE3 4.17Å; M414-W443 HydrophobicContact CG-CZ3 3.66Å; M414-P444 HydrophobicContact CE-CG 4.08Å; M414-P470 HydrophobicContact CE-CG 3.93Å; M414-P470 HydrophobicContact SD-CG 4.23Å; M414-I471 HydrophobicContact SD-CD1 4.06Å; M414-I471 HydrophobicContact SD-CG1 4.2Å
415	A	94.2	Very high	94.7	Very high	88 Å²	88	51 Å²	51	73%	0.727	25%	0.252	S	S	*	.	H	α-helix	trans	-73.3	-20.7	168.5	0	0	0	0	0	112.6	E411 E412 I413	E411-A415 PolarHBondContact O-N 3.33Å; E412-A415 WeakPolarHBondContact O-CB 3.44Å; E412-A415 PolarHBondContact O-N 3.28Å; I413-A415 PolarHBondContact O-N 2.87Å
416	E	93.3	Very high	94.6	Very high	103 Å²	103	53.3 Å²	53.3	48%	0.481	26%	0.264	S	S	.	.	S	Bend	trans	-79.8	151.7	175.1	-60.7	-170.1	-168.6	0	0	112.3	I413 M414 N419 F489	I413-E416 WeakPolarHBondContact O-CB 3.46Å; I413-E416 PolarHBondContact O-N 3.5Å; M414-E416 VanDerWaalsContact C-N 3.28Å; E416-N419 PolarHBondContact O-ND2 3.23Å; E416-F489 WeakPolarHBondContact OE2-CZ 3.4Å
417	K	90.7	Very high	94.4	Very high	206 Å²	206	55.8 Å²	55.8	90%	0.896	28%	0.279	S	S	*	.	S	Bend	trans	-67.1	-38	176.4	-174.9	-176.2	176	-171.5	0	112
418	E	91.2	Very high	94.4	Very high	106 Å²	106	56.8 Å²	56.8	50%	0.495	28%	0.282	S	S	.	.			trans	-102.5	81.4	-179.8	-57.4	-173.6	134.2	0	0	109.8	K488	E418-K488 HydrophobicContact CB-CD 4.29Å; E418-K488 HydrophobicContact CB-CG 3.76Å; E418-K488 VanDerWaalsContact CD-NZ 3.32Å; E418-K488 WeakPolarHBondContact O-CG 3.33Å; E418-K488 IonicContact OE1-NZ 3.63Å; E418-K488 PolarHBondContact OE1-NZ 3.27Å; E418-K488 WeakPolarHBondContact OE2-CE 3.33Å; E418-K488 IonicContact OE2-NZ 3.56Å; E418-K488 PolarHBondContact OE2-NZ 2.98Å
419	N	93.5	Very high	94.4	Very high	36 Å²	36	61.8 Å²	61.8	19%	0.193	30%	0.297	C	S	.	.			trans	-110.6	15.6	-168.4	57.3	23.2	0	0	0	114.2	I413 M414 E416 T421 P470	I413-N419 HydrophobicContact CG2-CB 4.01Å; I413-N419 VanDerWaalsContact O-CB 3.23Å; I413-N419 WeakPolarHBondContact O-CB 3.33Å; M414-N419 HydrophobicContact SD-CB 3.99Å; E416-N419 PolarHBondContact O-ND2 3.23Å; N419-T421 PolarHBondContact O-N 3.01Å; N419-T421 VanDerWaalsContact O-N 3.15Å; N419-T421 PolarHBondContact O-OG1 3.43Å; N419-P470 WeakPolarHBondContact OD1-CB 3.29Å
420	K	94.6	Very high	94.4	Very high	21 Å²	21	64.7 Å²	64.7	9%	0.091	31%	0.307	C	S	.	.			trans	-65.2	117.2	-179.3	-164.3	-177.3	-58.3	176.2	0	109.7	F464 P470 V484 E485 D486 V487 K488 F489	K420-F464 HydrophobicContact CD-CE1 4.27Å; K420-F464 HydrophobicContact CD-CE2 4.26Å; K420-F464 HydrophobicContact CD-CZ 3.98Å; K420-F464 HydrophobicContact CG-CD2 4.34Å; K420-F464 HydrophobicContact CG-CE1 4.34Å; K420-F464 HydrophobicContact CG-CE2 3.56Å; K420-F464 HydrophobicContact CG-CZ 3.55Å; K420-P470 CarbonylContact C-O 3.5Å; K420-P470 WeakPolarHBondContact CA-O 3.28Å; K420-V484 HydrophobicContact CD-CG1 4.11Å; K420-E485 PolarHBondContact NZ-O 3.45Å; K420-D486 WeakPolarHBondContact CB-O 3.41Å; K420-D486 IonicContact NZ-OD2 3.75Å; K420-V487 HydrophobicContact CD-CG2 4.14Å; K420-V487 HydrophobicContact CG-CG2 4.48Å; K420-K488 PolarHBondContact O-N 2.97Å; K420-F489 PolarHBondContact O-N 3.17Å
421	T	95.3	Very high	94.3	Very high	0 Å²	0	64.7 Å²	64.7	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	134.5	-164.9	-57.9	0	0	0	0	111.7	M410 I413 N419 I423 P470 L472 F489 I491	M410-T421 HydrophobicContact SD-CG2 4.2Å; I413-T421 WeakPolarHBondContact CG2-OG1 3.07Å; N419-T421 PolarHBondContact O-N 3.01Å; N419-T421 VanDerWaalsContact O-N 3.15Å; N419-T421 PolarHBondContact O-OG1 3.43Å; T421-I423 HydrophobicContact CG2-CG1 4.17Å; T421-P470 PolarHBondContact N-O 2.88Å; T421-L472 PolarHBondContact O-N 2.83Å; T421-F489 WeakPolarHBondContact CA-O 3.48Å; T421-F489 HydrophobicContact CG2-CB 3.94Å; T421-I491 HydrophobicContact CG2-CD1 3.66Å; T421-I491 HydrophobicContact CG2-CG1 4.03Å
422	I	95.1	Very high	94.4	Very high	5 Å²	5	61.5 Å²	61.5	3%	0.026	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	125.9	170.1	-55.3	180	0	0	0	109.6	F424 F464 L472 A474 V487 F489 V490 I491 R508	I422-F424 HydrophobicContact CB-CE2 4.42Å; I422-F424 HydrophobicContact CB-CZ 4.47Å; I422-F424 HydrophobicContact CG2-CD1 4.34Å; I422-F424 HydrophobicContact CG2-CD2 4.24Å; I422-F424 HydrophobicContact CG2-CE1 3.74Å; I422-F424 HydrophobicContact CG2-CE2 3.7Å; I422-F424 HydrophobicContact CG2-CZ 3.42Å; I422-F424 VanDerWaalsContact CG2-CZ 3.42Å; I422-F464 HydrophobicContact CD1-CE1 3.87Å; I422-F464 HydrophobicContact CD1-CZ 4.02Å; I422-F464 HydrophobicContact CG1-CE1 3.81Å; I422-F464 HydrophobicContact CG1-CE2 4.38Å; I422-F464 HydrophobicContact CG1-CZ 3.43Å; I422-F464 VanDerWaalsContact CG1-CZ 3.43Å; I422-L472 CarbonylContact C-O 3.51Å; I422-L472 VanDerWaalsContact CA-O 3.3Å; I422-L472 WeakPolarHBondContact CA-O 3.42Å; I422-L472 HydrophobicContact CG1-CB 4.46Å; I422-A474 HydrophobicContact CG2-CB 4.45Å; I422-V487 HydrophobicContact CD1-CG1 4.03Å; I422-V487 HydrophobicContact CD1-CG2 4.04Å; I422-V487 HydrophobicContact CG1-CG1 3.98Å; I422-V487 HydrophobicContact CG1-CG2 4.43Å; I422-F489 PolarHBondContact N-O 3.42Å; I422-V490 CarbonylContact O-C 3.55Å; I422-V490 WeakPolarHBondContact O-CA 3.32Å; I422-I491 PolarHBondContact O-N 3.4Å; I422-R508 HydrophobicContact CD1-CB 3.97Å; I422-R508 HydrophobicContact CD1-CG 4.26Å
423	I	96.1	Very high	94.5	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	117.4	177.6	-54.9	168.8	0	0	0	108.9	L406 M410 T421 L434 M438 I471 L472 I473 A474 I491	L406-I423 HydrophobicContact CD1-CD1 4.06Å; L406-I423 HydrophobicContact CD1-CG2 4.49Å; M410-I423 HydrophobicContact SD-CD1 4.05Å; T421-I423 HydrophobicContact CG2-CG1 4.17Å; I423-L434 HydrophobicContact CG2-CD2 4.1Å; I423-M438 HydrophobicContact CD1-CE 4.2Å; I423-M438 HydrophobicContact CD1-SD 3.87Å; I423-I471 HydrophobicContact CD1-CG2 3.75Å; I423-I471 HydrophobicContact CG1-CG2 4.49Å; I423-L472 PolarHBondContact N-O 2.88Å; I423-I473 HydrophobicContact CB-CG1 4.09Å; I423-I473 HydrophobicContact CD1-CG1 4.09Å; I423-I473 CarbonylContact O-C 3.6Å; I423-I473 VanDerWaalsContact O-CA 3.3Å; I423-I473 WeakPolarHBondContact O-CA 3.3Å; I423-A474 PolarHBondContact O-N 3.49Å; I423-I491 CarbonylContact C-O 3.55Å; I423-I491 WeakPolarHBondContact CA-O 3.37Å; I423-I491 HydrophobicContact CG1-CB 4.2Å; I423-I491 HydrophobicContact CG1-CD1 4.17Å; I423-I491 HydrophobicContact CG2-CB 4.47Å
424	F	96	Very high	94.5	Very high	1 Å²	1	59 Å²	59	0%	0.004	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	133	178.2	-70.4	-63	0	0	0	112.9	I422 A474 S479 V490 I491 Y493 D494 R505 R508	I422-F424 HydrophobicContact CB-CE2 4.42Å; I422-F424 HydrophobicContact CB-CZ 4.47Å; I422-F424 HydrophobicContact CG2-CD1 4.34Å; I422-F424 HydrophobicContact CG2-CD2 4.24Å; I422-F424 HydrophobicContact CG2-CE1 3.74Å; I422-F424 HydrophobicContact CG2-CE2 3.7Å; I422-F424 HydrophobicContact CG2-CZ 3.42Å; I422-F424 VanDerWaalsContact CG2-CZ 3.42Å; F424-A474 WeakPolarHBondContact CA-O 3.27Å; F424-A474 HydrophobicContact CD1-CB 3.93Å; F424-A474 HydrophobicContact CE1-CB 3.71Å; F424-S479 VanDerWaalsContact CZ-CB 3.41Å; F424-V490 HydrophobicContact CD2-CG1 3.77Å; F424-V490 HydrophobicContact CE2-CG1 3.74Å; F424-I491 PolarHBondContact N-O 2.87Å; F424-Y493 WeakPolarHBondContact O-CB 3.35Å; F424-Y493 PolarHBondContact O-N 3.43Å; F424-D494 PolarHBondContact O-N 3.24Å; F424-R505 HydrophobicContact CD1-CG 4.32Å; F424-R505 HydrophobicContact CD2-CB 3.66Å; F424-R505 HydrophobicContact CD2-CG 3.64Å; F424-R505 HydrophobicContact CE2-CB 3.68Å; F424-R505 HydrophobicContact CE2-CG 3.83Å; F424-R505 HydrophobicContact CG-CB 4.41Å; F424-R505 HydrophobicContact CG-CG 3.89Å; F424-R505 HydrophobicContact CZ-CB 4.49Å; F424-R505 HydrophobicContact CZ-CG 4.29Å; F424-R508 HydrophobicContact CE2-CG 4.24Å; F424-R508 HydrophobicContact CZ-CG 3.96Å
425	V	95.7	Very high	94.7	Very high	0 Å²	0	57 Å²	57	0%	0	28%	0.275	C	S	.	.			trans	-126.8	156.8	176.4	-62.8	0	0	0	0	110.6	R430 C431 L434 I473 A474 T475 Y493	V425-R430 HydrophobicContact CB-CB 4.43Å; V425-C431 HydrophobicContact CG2-CB 3.54Å; V425-L434 HydrophobicContact CG1-CD2 3.68Å; V425-I473 HydrophobicContact CG1-CG2 4.22Å; V425-I473 HydrophobicContact CG2-CG2 4.3Å; V425-A474 PolarHBondContact N-O 2.98Å; V425-T475 HydrophobicContact CG2-CG2 4.24Å; V425-Y493 HydrophobicContact CG1-CD1 3.98Å; V425-Y493 HydrophobicContact CG1-CG 4.33Å
426	E	93.5	Very high	94.8	Very high	100 Å²	100	60.8 Å²	60.8	47%	0.467	27%	0.27	S	S	.	.	S	Bend	trans	-72.8	-44	-173.7	-172.4	-172.5	167.2	0	0	112.7	D494	E426-D494 HydrophobicContact CB-CB 3.91Å; E426-D494 PolarHBondContact N-OD2 3.26Å
427	T	93.8	Very high	94.9	Very high	55 Å²	55	61.6 Å²	61.6	34%	0.337	27%	0.269	S	S	.	.	S	Bend	trans	-120.2	152.6	-170.2	71	0	0	0	0	112.9	R429 R430 C431	T427-R429 VanDerWaalsContact C-N 3.27Å; T427-R429 PolarHBondContact O-N 3.34Å; T427-R430 PolarHBondContact O-N 2.86Å; T427-R430 WeakPolarHBondContact OG1-CB 3.48Å; T427-R430 VanDerWaalsContact OG1-CG 3.29Å; T427-R430 WeakPolarHBondContact OG1-CG 3.08Å; T427-R430 PolarHBondContact OG1-N 3.49Å; T427-C431 PolarHBondContact O-N 3.47Å
428	K	93.7	Very high	95.1	Very high	75 Å²	75	52.2 Å²	52.2	33%	0.326	23%	0.228	S	C	.	.	H	α-helix	trans	-58.3	-40	176.6	-53.8	-178.2	-173.4	172	0	112.1	C431 D432 H449 D451 T475	K428-C431 VanDerWaalsContact O-CB 3.25Å; K428-C431 WeakPolarHBondContact O-CB 3.31Å; K428-C431 PolarHBondContact O-N 3.06Å; K428-D432 PolarHBondContact O-N 3.37Å; K428-D432 VanDerWaalsContact O-N 3.13Å; K428-H449 HydrophobicContact CB-CB 4.33Å; K428-H449 HydrophobicContact CG-CB 4.17Å; K428-D451 HydrophobicContact CD-CB 4.28Å; K428-D451 WeakPolarHBondContact CD-OD1 3.49Å; K428-D451 WeakPolarHBondContact CD-OD2 3.43Å; K428-D451 IonicContact NZ-OD1 2.84Å; K428-D451 PolarHBondContact NZ-OD1 3.37Å; K428-D451 IonicContact NZ-OD2 2.8Å; K428-T475 HydrophobicContact CG-CG2 4.34Å
429	R	95.5	Very high	95.4	Very high	192 Å²	192	54.1 Å²	54.1	73%	0.725	23%	0.231	S	C	*	.	H	α-helix	trans	-63.4	-47.1	176.7	-177.9	175.9	177.2	177.9	1.8	111.8	T427 C431 D432 D433	T427-R429 VanDerWaalsContact C-N 3.27Å; T427-R429 PolarHBondContact O-N 3.34Å; R429-C431 PolarHBondContact O-N 3.03Å; R429-D432 PolarHBondContact O-N 3.42Å; R429-D433 IonicContact NE-OD2 3.8Å; R429-D433 WeakPolarHBondContact O-CB 3.18Å; R429-D433 VanDerWaalsContact O-CG 3.3Å; R429-D433 PolarHBondContact O-N 3.16Å
430	R	95.4	Very high	95.5	Very high	75 Å²	75	63 Å²	63	28%	0.283	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-35.1	175.6	-73.3	175.3	70.9	99.4	-6.1	111.8	E399 V425 T427 D433 L434 Y493 D494	E399-R430 IonicContact OE1-CZ 3.64Å; E399-R430 IonicContact OE1-NH1 3.42Å; E399-R430 PolarHBondContact OE1-NH1 3.18Å; E399-R430 VanDerWaalsContact OE1-NH1 3.16Å; E399-R430 IonicContact OE1-NH2 3.54Å; E399-R430 PolarHBondContact OE1-NH2 3.18Å; V425-R430 HydrophobicContact CB-CB 4.43Å; T427-R430 PolarHBondContact O-N 2.86Å; T427-R430 WeakPolarHBondContact OG1-CB 3.48Å; T427-R430 VanDerWaalsContact OG1-CG 3.29Å; T427-R430 WeakPolarHBondContact OG1-CG 3.08Å; T427-R430 PolarHBondContact OG1-N 3.49Å; R430-D433 PolarHBondContact O-N 2.86Å; R430-L434 WeakPolarHBondContact O-CB 3.37Å; R430-L434 PolarHBondContact O-N 3.22Å; R430-Y493 VanDerWaalsContact NH2-CE1 3.3Å; R430-D494 IonicContact CZ-OD1 3.34Å; R430-D494 IonicContact CZ-OD2 3.51Å; R430-D494 IonicContact NE-OD1 2.85Å; R430-D494 IonicContact NE-OD2 2.63Å; R430-D494 PolarHBondContact NE-OD2 2.81Å; R430-D494 IonicContact NH2-OD1 2.67Å; R430-D494 PolarHBondContact NH2-OD1 3.09Å; R430-D494 IonicContact NH2-OD2 2.71Å; R430-D494 PolarHBondContact NH2-OD2 3.02Å
431	C	95.8	Very high	95.5	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59.5	-51	175	-165.6	0	0	0	0	112.2	V425 T427 K428 R429 T435 C447 I473 T475	V425-C431 HydrophobicContact CG2-CB 3.54Å; T427-C431 PolarHBondContact O-N 3.47Å; K428-C431 VanDerWaalsContact O-CB 3.25Å; K428-C431 WeakPolarHBondContact O-CB 3.31Å; K428-C431 PolarHBondContact O-N 3.06Å; R429-C431 PolarHBondContact O-N 3.03Å; C431-T435 VanDerWaalsContact O-CB 3.31Å; C431-T435 WeakPolarHBondContact O-CB 3.23Å; C431-T435 PolarHBondContact O-N 3.2Å; C431-T435 PolarHBondContact O-OG1 2.93Å; C431-C447 VanDerWaalsContact SG-CB 3.51Å; C431-I473 PolarHBondContact SG-O 2.71Å; C431-T475 HydrophobicContact CB-CG2 4.03Å
432	D	96.1	Very high	95.4	Very high	50 Å²	50	69.3 Å²	69.3	27%	0.267	31%	0.311	S	S	.	.	H	α-helix	trans	-65.3	-43.5	176.3	-81.5	-39.6	0	0	0	112.5	K428 R429 T435 R436 C447 H449 K452	K428-D432 PolarHBondContact O-N 3.37Å; K428-D432 VanDerWaalsContact O-N 3.13Å; R429-D432 PolarHBondContact O-N 3.42Å; D432-T435 PolarHBondContact O-N 3.16Å; D432-R436 WeakPolarHBondContact O-CB 3.48Å; D432-R436 PolarHBondContact O-N 2.62Å; D432-C447 PolarHBondContact OD1-SG 3.34Å; D432-H449 VanDerWaalsContact CG-NE2 3.33Å; D432-H449 IonicContact OD1-CE1 3.82Å; D432-H449 IonicContact OD1-NE2 3.45Å; D432-H449 PolarHBondContact OD1-NE2 3.31Å; D432-H449 VanDerWaalsContact OD1-NE2 3.09Å; D432-H449 IonicContact OD2-CE1 2.66Å; D432-H449 PolarHBondContact OD2-CE1 3.24Å; D432-H449 IonicContact OD2-NE2 3.16Å; D432-H449 PolarHBondContact OD2-NE2 2.94Å; D432-K452 IonicContact OD1-NZ 3.19Å
433	D	96.6	Very high	95.4	Very high	66 Å²	66	71.2 Å²	71.2	35%	0.353	32%	0.318	S	S	.	.	H	α-helix	trans	-65.6	-43.9	-178.3	-72	-23	0	0	0	111.6	R429 R430 R436 R437	R429-D433 IonicContact NE-OD2 3.8Å; R429-D433 WeakPolarHBondContact O-CB 3.18Å; R429-D433 VanDerWaalsContact O-CG 3.3Å; R429-D433 PolarHBondContact O-N 3.16Å; R430-D433 PolarHBondContact O-N 2.86Å; D433-R436 PolarHBondContact O-N 2.73Å; D433-R436 IonicContact OD1-NH1 3.87Å; D433-R437 PolarHBondContact O-N 2.84Å; D433-R437 VanDerWaalsContact O-N 3.09Å
434	L	96.4	Very high	95.3	Very high	10 Å²	10	74 Å²	74	5%	0.052	34%	0.336	C	S	.	.	H	α-helix	trans	-65.2	-44	176.9	-176.7	61.2	0	0	0	111.2	L406 I423 V425 R430 R436 R437 M438 I473 Y493	L406-L434 HydrophobicContact CD2-CD1 3.79Å; L406-L434 HydrophobicContact CD2-CD2 4.14Å; L406-L434 HydrophobicContact CD2-CG 4.4Å; I423-L434 HydrophobicContact CG2-CD2 4.1Å; V425-L434 HydrophobicContact CG1-CD2 3.68Å; R430-L434 WeakPolarHBondContact O-CB 3.37Å; R430-L434 PolarHBondContact O-N 3.22Å; L434-R436 PolarHBondContact O-N 2.9Å; L434-R437 WeakPolarHBondContact O-CB 3.5Å; L434-R437 PolarHBondContact O-N 3.03Å; L434-M438 HydrophobicContact CD1-CG 4.38Å; L434-M438 HydrophobicContact CG-SD 4.5Å; L434-M438 WeakPolarHBondContact O-CG 3.22Å; L434-M438 PolarHBondContact O-N 3.49Å; L434-I473 HydrophobicContact CD2-CD1 4.43Å; L434-I473 HydrophobicContact CD2-CG2 4.16Å; L434-I473 HydrophobicContact CG-CD1 4.17Å; L434-Y493 HydrophobicContact CD1-CE2 4.27Å; L434-Y493 HydrophobicContact CD2-CD1 4.37Å; L434-Y493 HydrophobicContact CD2-CD2 4.24Å; L434-Y493 HydrophobicContact CD2-CE2 4.47Å; L434-Y493 HydrophobicContact CD2-CG 4.18Å
435	T	96.4	Very high	95.3	Very high	7 Å²	7	73.9 Å²	73.9	4%	0.043	34%	0.336	C	S	.	.	H	α-helix	trans	-63.2	-43.4	178.8	-55.6	0	0	0	0	111.6	C431 D432 R437 M438 R439 C447 I473	C431-T435 VanDerWaalsContact O-CB 3.31Å; C431-T435 WeakPolarHBondContact O-CB 3.23Å; C431-T435 PolarHBondContact O-N 3.2Å; C431-T435 PolarHBondContact O-OG1 2.93Å; D432-T435 PolarHBondContact O-N 3.16Å; T435-R437 VanDerWaalsContact C-N 3.3Å; T435-R437 PolarHBondContact O-N 2.95Å; T435-M438 PolarHBondContact O-N 3.43Å; T435-R439 HydrophobicContact CG2-CG 4.34Å; T435-R439 WeakPolarHBondContact O-CB 3.18Å; T435-R439 VanDerWaalsContact O-CG 3.28Å; T435-R439 WeakPolarHBondContact O-CG 3.48Å; T435-R439 PolarHBondContact O-N 3.49Å; T435-C447 HydrophobicContact CG2-CB 4.12Å; T435-C447 VanDerWaalsContact OG1-CB 3.26Å; T435-C447 WeakPolarHBondContact OG1-CB 3.35Å; T435-I473 HydrophobicContact CG2-CD1 4.32Å; T435-I473 WeakPolarHBondContact OG1-CD1 3.41Å
436	R	96.2	Very high	95.3	Very high	168 Å²	168	74.6 Å²	74.6	63%	0.634	34%	0.339	S	S	*	.	H	α-helix	trans	-62	-40.4	177.1	-170.9	-176.3	-59.6	143.2	7.6	111.3	D432 D433 L434 R440	D432-R436 WeakPolarHBondContact O-CB 3.48Å; D432-R436 PolarHBondContact O-N 2.62Å; D433-R436 PolarHBondContact O-N 2.73Å; D433-R436 IonicContact OD1-NH1 3.87Å; L434-R436 PolarHBondContact O-N 2.9Å; R436-R440 WeakPolarHBondContact O-CB 3.43Å; R436-R440 PolarHBondContact O-N 3.07Å
437	R	95.3	Very high	95.3	Very high	121 Å²	121	70.3 Å²	70.3	46%	0.457	32%	0.32	S	S	.	.	H	α-helix	trans	-63.7	-53.8	176.5	-172	-174.8	-56.2	-154	15.3	111.2	D403 D433 L434 T435 R439 R440 D441	D403-R437 VanDerWaalsContact CG-NH1 3.26Å; D403-R437 IonicContact OD1-NH1 3.44Å; D403-R437 IonicContact OD2-CZ 3.95Å; D403-R437 VanDerWaalsContact OD2-CZ 3.28Å; D403-R437 IonicContact OD2-NH1 3.8Å; D403-R437 PolarHBondContact OD2-NH1 3.01Å; D403-R437 IonicContact OD2-NH2 3.28Å; D403-R437 PolarHBondContact OD2-NH2 3.3Å; D433-R437 PolarHBondContact O-N 2.84Å; D433-R437 VanDerWaalsContact O-N 3.09Å; L434-R437 WeakPolarHBondContact O-CB 3.5Å; L434-R437 PolarHBondContact O-N 3.03Å; T435-R437 VanDerWaalsContact C-N 3.3Å; T435-R437 PolarHBondContact O-N 2.95Å; R437-R439 VanDerWaalsContact C-N 3.3Å; R437-R439 PolarHBondContact O-N 3.15Å; R437-R440 WeakPolarHBondContact O-CB 3.5Å; R437-R440 PolarHBondContact O-N 3.31Å; R437-D441 PolarHBondContact O-N 3.34Å; R437-D441 VanDerWaalsContact O-N 3.11Å
438	M	95.5	Very high	95.3	Very high	8 Å²	8	67.7 Å²	67.7	4%	0.039	30%	0.304	C	S	.	.	H	α-helix	trans	-57.3	-43.1	179.1	-73.6	-165	76.6	0	0	112.1	L406 M410 I423 L434 T435 R440 D441 G442 W443 A445 I471 I473	L406-M438 HydrophobicContact CD2-SD 4Å; M410-M438 HydrophobicContact CG-CE 3.9Å; I423-M438 HydrophobicContact CD1-CE 4.2Å; I423-M438 HydrophobicContact CD1-SD 3.87Å; L434-M438 HydrophobicContact CD1-CG 4.38Å; L434-M438 HydrophobicContact CG-SD 4.5Å; L434-M438 WeakPolarHBondContact O-CG 3.22Å; L434-M438 PolarHBondContact O-N 3.49Å; T435-M438 PolarHBondContact O-N 3.43Å; M438-R440 PolarHBondContact O-N 3.27Å; M438-D441 PolarHBondContact O-N 2.99Å; M438-G442 PolarHBondContact O-N 3.05Å; M438-W443 HydrophobicContact CB-CB 4.07Å; M438-W443 HydrophobicContact CB-CG 4.45Å; M438-W443 HydrophobicContact CE-CB 3.96Å; M438-W443 HydrophobicContact CE-CD2 4.34Å; M438-W443 HydrophobicContact CE-CG 3.86Å; M438-W443 WeakPolarHBondContact O-CB 3.35Å; M438-W443 VanDerWaalsContact O-CD1 3.3Å; M438-W443 PolarHBondContact O-N 3.12Å; M438-A445 HydrophobicContact CB-CB 4.09Å; M438-A445 HydrophobicContact SD-CB 4.47Å; M438-I471 HydrophobicContact CE-CD1 4.37Å; M438-I471 HydrophobicContact CE-CG2 4.41Å; M438-I473 HydrophobicContact SD-CD1 3.78Å
439	R	96.1	Very high	95.2	Very high	147 Å²	147	64.2 Å²	64.2	56%	0.555	29%	0.289	S	S	*	.	H	α-helix	trans	-67.5	-33.2	176.9	-70.4	-178.5	77.4	116.3	-2.7	113.4	T435 R437 D441 G442 A445	T435-R439 HydrophobicContact CG2-CG 4.34Å; T435-R439 WeakPolarHBondContact O-CB 3.18Å; T435-R439 VanDerWaalsContact O-CG 3.28Å; T435-R439 WeakPolarHBondContact O-CG 3.48Å; T435-R439 PolarHBondContact O-N 3.49Å; R437-R439 VanDerWaalsContact C-N 3.3Å; R437-R439 PolarHBondContact O-N 3.15Å; R439-D441 PolarHBondContact O-N 2.65Å; R439-G442 PolarHBondContact O-N 3.35Å; R439-G442 VanDerWaalsContact O-N 3.15Å; R439-A445 VanDerWaalsContact CD-O 3.27Å; R439-A445 WeakPolarHBondContact CD-O 3.42Å; R439-A445 WeakPolarHBondContact CG-O 3.48Å; R439-A445 PolarHBondContact NH1-O 3.49Å
440	R	95.8	Very high	94.8	Very high	221 Å²	221	56.7 Å²	56.7	83%	0.834	27%	0.272	S	S	*	.	H	α-helix	trans	-64.4	-35.2	175	-177.9	179.9	177.3	-177.9	-1.7	111.2	R436 R437 M438 G442	R436-R440 WeakPolarHBondContact O-CB 3.43Å; R436-R440 PolarHBondContact O-N 3.07Å; R437-R440 WeakPolarHBondContact O-CB 3.5Å; R437-R440 PolarHBondContact O-N 3.31Å; M438-R440 PolarHBondContact O-N 3.27Å; R440-G442 PolarHBondContact O-N 3.43Å
441	D	94.2	Very high	94.5	Very high	91 Å²	91	58.5 Å²	58.5	49%	0.487	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.2	0.1	177.3	-57.8	-18.6	0	0	0	112.3	R437 M438 R439	R437-D441 PolarHBondContact O-N 3.34Å; R437-D441 VanDerWaalsContact O-N 3.11Å; M438-D441 PolarHBondContact O-N 2.99Å; R439-D441 PolarHBondContact O-N 2.65Å
442	G	94	Very high	94.3	Very high	63 Å²	63	60.4 Å²	60.4	65%	0.649	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.9	3.6	174.9	0	0	0	0	0	115.3	M438 R439 R440	M438-G442 PolarHBondContact O-N 3.05Å; R439-G442 PolarHBondContact O-N 3.35Å; R439-G442 VanDerWaalsContact O-N 3.15Å; R440-G442 PolarHBondContact O-N 3.43Å
443	W	95.8	Very high	94.1	Very high	45 Å²	45	61.1 Å²	61.1	17%	0.17	30%	0.304	C	S	.	.			trans	-70.9	137.1	177.7	-62	100.5	0	0	0	111.7	I407 M410 E411 M414 M438 A445 I471	I407-W443 HydrophobicContact CG2-CZ2 4.39Å; M410-W443 HydrophobicContact CB-CH2 3.99Å; M410-W443 HydrophobicContact CB-CZ2 4.2Å; M410-W443 HydrophobicContact CB-CZ3 4.17Å; E411-W443 HydrophobicContact CG-CH2 3.83Å; E411-W443 HydrophobicContact CG-CZ2 4.02Å; M414-W443 HydrophobicContact CB-CZ3 3.97Å; M414-W443 HydrophobicContact CG-CE3 4.17Å; M414-W443 HydrophobicContact CG-CZ3 3.66Å; M438-W443 HydrophobicContact CB-CB 4.07Å; M438-W443 HydrophobicContact CB-CG 4.45Å; M438-W443 HydrophobicContact CE-CB 3.96Å; M438-W443 HydrophobicContact CE-CD2 4.34Å; M438-W443 HydrophobicContact CE-CG 3.86Å; M438-W443 WeakPolarHBondContact O-CB 3.35Å; M438-W443 VanDerWaalsContact O-CD1 3.3Å; M438-W443 PolarHBondContact O-N 3.12Å; W443-A445 PolarHBondContact O-N 3.03Å; W443-I471 HydrophobicContact CB-CD1 4.28Å; W443-I471 HydrophobicContact CE3-CD1 4.27Å
444	P	94.2	Very high	93.7	Very high	58 Å²	58	58.3 Å²	58.3	38%	0.377	29%	0.288	S	S	.	.			trans	-77.6	58.6	179.7	34.3	-38	0	0	0	112	M414 P470 I471	M414-P444 HydrophobicContact CE-CG 4.08Å; P444-P470 HydrophobicContact CG-CG 3.87Å; P444-I471 HydrophobicContact CG-CD1 4.12Å
445	A	95.4	Very high	93.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	143	-176.4	0	0	0	0	0	113	M438 R439 W443 I471 I473	M438-A445 HydrophobicContact CB-CB 4.09Å; M438-A445 HydrophobicContact SD-CB 4.47Å; R439-A445 VanDerWaalsContact CD-O 3.27Å; R439-A445 WeakPolarHBondContact CD-O 3.42Å; R439-A445 WeakPolarHBondContact CG-O 3.48Å; R439-A445 PolarHBondContact NH1-O 3.49Å; W443-A445 PolarHBondContact O-N 3.03Å; A445-I471 WeakPolarHBondContact CA-O 3.29Å; A445-I471 HydrophobicContact CB-CB 4.09Å; A445-I471 HydrophobicContact CB-CG2 3.81Å; A445-I473 HydrophobicContact CB-CD1 4Å
446	M	95.4	Very high	93.2	Very high	14 Å²	14	65.4 Å²	65.4	7%	0.069	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	155.5	170.8	-61.6	-166.8	-63.2	0	0	110.5	W459 V460 E463 A469 I471 I473	M446-W459 HydrophobicContact SD-CE3 4.47Å; M446-W459 HydrophobicContact SD-CH2 3.89Å; M446-W459 HydrophobicContact SD-CZ3 3.61Å; M446-V460 HydrophobicContact CB-CG1 3.82Å; M446-V460 HydrophobicContact CB-CG2 4.35Å; M446-V460 HydrophobicContact CE-CB 4.48Å; M446-V460 HydrophobicContact CE-CG1 4.11Å; M446-V460 HydrophobicContact SD-CG2 4.28Å; M446-E463 HydrophobicContact CE-CB 3.45Å; M446-E463 VanDerWaalsContact CE-CB 3.45Å; M446-E463 HydrophobicContact CE-CG 4.34Å; M446-A469 HydrophobicContact CE-CB 3.14Å; M446-A469 HydrophobicContact CG-CB 4.28Å; M446-A469 HydrophobicContact SD-CB 4.17Å; M446-I471 PolarHBondContact N-O 3.05Å; M446-I471 VanDerWaalsContact N-O 3.08Å; M446-I473 PolarHBondContact O-N 3.26Å
447	C	94.7	Very high	92.9	Very high	10 Å²	10	57.9 Å²	57.9	7%	0.068	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	150.3	178.8	50.9	0	0	0	0	114.2	C431 D432 T435 K452 I473	C431-C447 VanDerWaalsContact SG-CB 3.51Å; D432-C447 PolarHBondContact OD1-SG 3.34Å; T435-C447 HydrophobicContact CG2-CB 4.12Å; T435-C447 VanDerWaalsContact OG1-CB 3.26Å; T435-C447 WeakPolarHBondContact OG1-CB 3.35Å; C447-K452 WeakPolarHBondContact SG-CE 3.5Å; C447-I473 CarbonylContact C-O 3.5Å; C447-I473 WeakPolarHBondContact CA-O 3.22Å
448	I	92.4	Very high	92.6	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.005	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	124.2	168.7	-169.9	171.4	0	0	0	111	R457 V460 L472 I473 A474 T475 A478	I448-R457 HydrophobicContact CD1-CB 4.05Å; I448-R457 HydrophobicContact CD1-CG 4.41Å; I448-R457 HydrophobicContact CG1-CB 4.24Å; I448-R457 HydrophobicContact CG1-CG 4.07Å; I448-V460 HydrophobicContact CB-CG1 4.46Å; I448-L472 HydrophobicContact CB-CD1 4.26Å; I448-L472 HydrophobicContact CG2-CD1 3.74Å; I448-L472 HydrophobicContact CG2-CD2 4.15Å; I448-L472 HydrophobicContact CG2-CG 4.09Å; I448-I473 PolarHBondContact N-O 3.34Å; I448-A474 HydrophobicContact CG2-CB 3.68Å; I448-A474 WeakPolarHBondContact O-CA 3.45Å; I448-T475 PolarHBondContact O-N 3.36Å; I448-A478 HydrophobicContact CB-CB 4.23Å; I448-A478 HydrophobicContact CD1-CB 4.09Å; I448-A478 HydrophobicContact CG1-CB 3.78Å; I448-A478 HydrophobicContact CG2-CB 3.66Å
449	H	91.9	Very high	92.5	Very high	2 Å²	2	60 Å²	60	1%	0.009	31%	0.311	C	S	.	.			trans	-156.7	170.7	175.4	57.4	94	0	0	0	110.9	K428 D432 D451 K452 T475	K428-H449 HydrophobicContact CB-CB 4.33Å; K428-H449 HydrophobicContact CG-CB 4.17Å; D432-H449 VanDerWaalsContact CG-NE2 3.33Å; D432-H449 IonicContact OD1-CE1 3.82Å; D432-H449 IonicContact OD1-NE2 3.45Å; D432-H449 PolarHBondContact OD1-NE2 3.31Å; D432-H449 VanDerWaalsContact OD1-NE2 3.09Å; D432-H449 IonicContact OD2-CE1 2.66Å; D432-H449 PolarHBondContact OD2-CE1 3.24Å; D432-H449 IonicContact OD2-NE2 3.16Å; D432-H449 PolarHBondContact OD2-NE2 2.94Å; H449-D451 PolarHBondContact ND1-N 3.45Å; H449-D451 PolarHBondContact O-N 3.2Å; H449-D451 VanDerWaalsContact O-N 3.12Å; H449-K452 WeakPolarHBondContact NE2-CE 3.39Å; H449-K452 WeakPolarHBondContact NE2-CG 3.24Å; H449-K452 WeakPolarHBondContact O-CB 3.49Å; H449-K452 PolarHBondContact O-N 3.32Å; H449-K452 VanDerWaalsContact O-N 3.17Å; H449-T475 HydrophobicContact CB-CG2 3.83Å; H449-T475 WeakPolarHBondContact CB-OG1 3.34Å
450	G	86.8	Confident	92.3	Very high	34 Å²	34	53.3 Å²	53.3	35%	0.351	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.8	-9.3	-171	0	0	0	0	0	117
451	D	90.6	Very high	92	Very high	112 Å²	112	43.2 Å²	43.2	60%	0.599	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-8.3	176.8	-65	-12.2	0	0	0	112.5	K428 H449	K428-D451 HydrophobicContact CD-CB 4.28Å; K428-D451 WeakPolarHBondContact CD-OD1 3.49Å; K428-D451 WeakPolarHBondContact CD-OD2 3.43Å; K428-D451 IonicContact NZ-OD1 2.84Å; K428-D451 PolarHBondContact NZ-OD1 3.37Å; K428-D451 IonicContact NZ-OD2 2.8Å; H449-D451 PolarHBondContact ND1-N 3.45Å; H449-D451 PolarHBondContact O-N 3.2Å; H449-D451 VanDerWaalsContact O-N 3.12Å
452	K	90.6	Very high	91.8	Very high	41 Å²	41	43.3 Å²	43.3	18%	0.178	25%	0.249	C	C	.	.	S	Bend	trans	-72.7	145.4	173.5	-62.2	-64.1	-161.8	155.4	0	110.4	D432 C447 H449 E456 R457	D432-K452 IonicContact OD1-NZ 3.19Å; C447-K452 WeakPolarHBondContact SG-CE 3.5Å; H449-K452 WeakPolarHBondContact NE2-CE 3.39Å; H449-K452 WeakPolarHBondContact NE2-CG 3.24Å; H449-K452 WeakPolarHBondContact O-CB 3.49Å; H449-K452 PolarHBondContact O-N 3.32Å; H449-K452 VanDerWaalsContact O-N 3.17Å; K452-E456 WeakPolarHBondContact CD-OE1 3.26Å; K452-E456 IonicContact NZ-OE1 2.88Å; K452-E456 PolarHBondContact NZ-OE1 2.98Å; K452-R457 HydrophobicContact CB-CG 3.63Å
453	S	91.8	Very high	91.8	Very high	64 Å²	64	42.1 Å²	42.1	45%	0.448	23%	0.227	S	C	.	.			trans	-64.7	149.3	175.1	74	0	0	0	0	110.6	E456 R457	S453-E456 WeakPolarHBondContact O-CB 3.29Å; S453-E456 PolarHBondContact O-N 2.86Å; S453-E456 VanDerWaalsContact O-N 3.11Å; S453-E456 VanDerWaalsContact OG-CB 3.29Å; S453-E456 WeakPolarHBondContact OG-CB 3.43Å; S453-E456 PolarHBondContact OG-N 3.33Å; S453-R457 WeakPolarHBondContact O-CG 3.42Å; S453-R457 PolarHBondContact O-N 3.38Å
454	Q	88	Confident	91.6	Very high	7 Å²	7	40 Å²	40	3%	0.033	22%	0.219	C	C	.	.	H	α-helix	trans	-57.7	-44.2	-179.1	-167.2	62.1	39	0	0	113.1	E255 Y279 E456 R457 D458	E255-Q454 PolarHBondContact OE1-NE2 3.19Å; Y279-Q454 HydrophobicContact CE2-CG 4.13Å; Q454-E456 VanDerWaalsContact C-N 3.26Å; Q454-E456 PolarHBondContact O-N 3.46Å; Q454-R457 PolarHBondContact O-N 3.02Å; Q454-R457 VanDerWaalsContact O-N 3.13Å; Q454-D458 PolarHBondContact NE2-OD1 3.41Å; Q454-D458 VanDerWaalsContact O-CG 3.24Å; Q454-D458 PolarHBondContact O-N 3.5Å
455	P	91.1	Very high	91.3	Very high	94 Å²	94	41.3 Å²	41.3	61%	0.61	22%	0.216	S	C	*	.	H	α-helix	trans	-59.2	-36	176.1	-24.7	35.7	0	0	0	113.4	W459	P455-W459 VanDerWaalsContact O-CB 3.29Å; P455-W459 WeakPolarHBondContact O-CB 3.48Å; P455-W459 PolarHBondContact O-N 2.91Å
456	E	92.1	Very high	91.1	Very high	72 Å²	72	44.6 Å²	44.6	34%	0.336	24%	0.239	S	C	.	.	H	α-helix	trans	-69.2	-41	176.3	-173.5	-178.3	177.9	0	0	111.6	K452 S453 Q454 W459 V460	K452-E456 WeakPolarHBondContact CD-OE1 3.26Å; K452-E456 IonicContact NZ-OE1 2.88Å; K452-E456 PolarHBondContact NZ-OE1 2.98Å; S453-E456 WeakPolarHBondContact O-CB 3.29Å; S453-E456 PolarHBondContact O-N 2.86Å; S453-E456 VanDerWaalsContact O-N 3.11Å; S453-E456 VanDerWaalsContact OG-CB 3.29Å; S453-E456 WeakPolarHBondContact OG-CB 3.43Å; S453-E456 PolarHBondContact OG-N 3.33Å; Q454-E456 VanDerWaalsContact C-N 3.26Å; Q454-E456 PolarHBondContact O-N 3.46Å; E456-W459 PolarHBondContact O-N 3.44Å; E456-V460 WeakPolarHBondContact O-CB 3.29Å; E456-V460 VanDerWaalsContact O-CG2 3.31Å; E456-V460 WeakPolarHBondContact O-CG2 3.41Å; E456-V460 PolarHBondContact O-N 3.44Å
457	R	90.1	Very high	90.8	Very high	11 Å²	11	45.7 Å²	45.7	4%	0.042	25%	0.254	C	S	.	.	H	α-helix	trans	-62.1	-46.2	176.1	-65.6	178.6	71.9	-155.3	1.4	111.4	E255 I448 K452 S453 Q454 W459 V460 L461	E255-R457 VanDerWaalsContact CD-CZ 3.4Å; E255-R457 IonicContact OE1-CZ 2.74Å; E255-R457 IonicContact OE1-NE 3.87Å; E255-R457 PolarHBondContact OE1-NE 2.96Å; E255-R457 IonicContact OE1-NH1 3.52Å; E255-R457 PolarHBondContact OE1-NH1 3.47Å; E255-R457 IonicContact OE1-NH2 2.69Å; E255-R457 PolarHBondContact OE1-NH2 3.34Å; E255-R457 IonicContact OE2-CZ 3.76Å; E255-R457 IonicContact OE2-NH1 2.66Å; E255-R457 IonicContact OE2-NH2 2.81Å; E255-R457 PolarHBondContact OE2-NH2 3.3Å; I448-R457 HydrophobicContact CD1-CB 4.05Å; I448-R457 HydrophobicContact CD1-CG 4.41Å; I448-R457 HydrophobicContact CG1-CB 4.24Å; I448-R457 HydrophobicContact CG1-CG 4.07Å; K452-R457 HydrophobicContact CB-CG 3.63Å; S453-R457 WeakPolarHBondContact O-CG 3.42Å; S453-R457 PolarHBondContact O-N 3.38Å; Q454-R457 PolarHBondContact O-N 3.02Å; Q454-R457 VanDerWaalsContact O-N 3.13Å; R457-W459 VanDerWaalsContact C-N 3.35Å; R457-V460 PolarHBondContact O-N 3.31Å; R457-L461 WeakPolarHBondContact O-CB 3.23Å; R457-L461 PolarHBondContact O-N 3.25Å
458	D	88.5	Confident	90.7	Very high	34 Å²	34	52.1 Å²	52.1	18%	0.182	28%	0.281	C	S	.	.	H	α-helix	trans	-63.3	-42.6	178	-60.6	-19.7	0	0	0	110.4	Q258 Q454 L461 N462	Q258-D458 PolarHBondContact NE2-OD1 2.72Å; Q454-D458 PolarHBondContact NE2-OD1 3.41Å; Q454-D458 VanDerWaalsContact O-CG 3.24Å; Q454-D458 PolarHBondContact O-N 3.5Å; D458-L461 PolarHBondContact O-N 3.41Å; D458-N462 WeakPolarHBondContact O-CB 3.4Å; D458-N462 PolarHBondContact O-N 3.37Å; D458-N462 PolarHBondContact O-ND2 2.93Å
459	W	92.6	Very high	90.7	Very high	140 Å²	140	52.4 Å²	52.4	53%	0.53	28%	0.284	S	S	.	.	H	α-helix	trans	-63.2	-49.6	176.9	-179	76.5	0	0	0	112.6	M446 P455 E456 R457 L461 N462 E463	M446-W459 HydrophobicContact SD-CE3 4.47Å; M446-W459 HydrophobicContact SD-CH2 3.89Å; M446-W459 HydrophobicContact SD-CZ3 3.61Å; P455-W459 VanDerWaalsContact O-CB 3.29Å; P455-W459 WeakPolarHBondContact O-CB 3.48Å; P455-W459 PolarHBondContact O-N 2.91Å; E456-W459 PolarHBondContact O-N 3.44Å; R457-W459 VanDerWaalsContact C-N 3.35Å; W459-L461 VanDerWaalsContact C-N 3.31Å; W459-L461 PolarHBondContact O-N 2.88Å; W459-N462 PolarHBondContact O-N 3.39Å; W459-E463 HydrophobicContact CD2-CG 4.14Å; W459-E463 HydrophobicContact CH2-CG 4.42Å; W459-E463 HydrophobicContact CZ2-CG 3.87Å; W459-E463 WeakPolarHBondContact O-CG 3.21Å; W459-E463 PolarHBondContact O-N 3.15Å
460	V	92.8	Very high	90.9	Very high	6 Å²	6	53.1 Å²	53.1	4%	0.036	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-43.3	178.6	168.7	0	0	0	0	111.1	M446 I448 E456 R457 E463 F464 L472	M446-V460 HydrophobicContact CB-CG1 3.82Å; M446-V460 HydrophobicContact CB-CG2 4.35Å; M446-V460 HydrophobicContact CE-CB 4.48Å; M446-V460 HydrophobicContact CE-CG1 4.11Å; M446-V460 HydrophobicContact SD-CG2 4.28Å; I448-V460 HydrophobicContact CB-CG1 4.46Å; E456-V460 WeakPolarHBondContact O-CB 3.29Å; E456-V460 VanDerWaalsContact O-CG2 3.31Å; E456-V460 WeakPolarHBondContact O-CG2 3.41Å; E456-V460 PolarHBondContact O-N 3.44Å; R457-V460 PolarHBondContact O-N 3.31Å; V460-E463 PolarHBondContact O-N 2.97Å; V460-F464 WeakPolarHBondContact O-CB 3.41Å; V460-F464 PolarHBondContact O-N 3.3Å; V460-L472 HydrophobicContact CG1-CD1 3.55Å
461	L	89.1	Confident	91.3	Very high	8 Å²	8	51.5 Å²	51.5	4%	0.042	27%	0.272	C	S	.	.	H	α-helix	trans	-66	-39.8	179.3	-175.1	63.6	0	0	0	111.7	E255 R457 D458 W459 F464 R465 L482 V484	E255-L461 HydrophobicContact CB-CD2 4.05Å; E255-L461 HydrophobicContact CG-CD2 4.04Å; R457-L461 WeakPolarHBondContact O-CB 3.23Å; R457-L461 PolarHBondContact O-N 3.25Å; D458-L461 PolarHBondContact O-N 3.41Å; W459-L461 VanDerWaalsContact C-N 3.31Å; W459-L461 PolarHBondContact O-N 2.88Å; L461-F464 PolarHBondContact O-N 2.82Å; L461-R465 WeakPolarHBondContact O-CB 3.44Å; L461-R465 VanDerWaalsContact O-CG 3.28Å; L461-R465 WeakPolarHBondContact O-CG 3.14Å; L461-R465 PolarHBondContact O-N 2.83Å; L461-L482 HydrophobicContact CD1-CD1 3.73Å; L461-L482 HydrophobicContact CD1-CD2 3.89Å; L461-L482 HydrophobicContact CD1-CG 4.39Å; L461-L482 HydrophobicContact CD2-CD2 3.62Å; L461-L482 HydrophobicContact CG-CD2 4.43Å; L461-V484 HydrophobicContact CD1-CG2 4.27Å
462	N	90.2	Very high	91.5	Very high	93 Å²	93	46.2 Å²	46.2	50%	0.497	24%	0.243	S	C	.	.	H	α-helix	trans	-66.1	-41.7	176.8	-74.8	-22.4	0	0	0	112.3	D458 W459 F464 R465 S466	D458-N462 WeakPolarHBondContact O-CB 3.4Å; D458-N462 PolarHBondContact O-N 3.37Å; D458-N462 PolarHBondContact O-ND2 2.93Å; W459-N462 PolarHBondContact O-N 3.39Å; N462-F464 VanDerWaalsContact C-N 3.3Å; N462-F464 PolarHBondContact O-N 3.06Å; N462-R465 PolarHBondContact O-N 2.71Å; N462-S466 WeakPolarHBondContact O-CB 3.34Å; N462-S466 PolarHBondContact O-N 3.42Å; N462-S466 PolarHBondContact O-OG 3.2Å
463	E	93.6	Very high	91.7	Very high	38 Å²	38	44.2 Å²	44.2	18%	0.178	24%	0.235	C	C	.	.	H	α-helix	trans	-66.1	-33.1	176.5	-69.9	-72.7	115.5	0	0	112.2	M446 W459 V460 S466 G467 K468 A469	M446-E463 HydrophobicContact CE-CB 3.45Å; M446-E463 VanDerWaalsContact CE-CB 3.45Å; M446-E463 HydrophobicContact CE-CG 4.34Å; W459-E463 HydrophobicContact CD2-CG 4.14Å; W459-E463 HydrophobicContact CH2-CG 4.42Å; W459-E463 HydrophobicContact CZ2-CG 3.87Å; W459-E463 WeakPolarHBondContact O-CG 3.21Å; W459-E463 PolarHBondContact O-N 3.15Å; V460-E463 PolarHBondContact O-N 2.97Å; E463-S466 PolarHBondContact O-OG 3.37Å; E463-G467 PolarHBondContact O-N 2.78Å; E463-K468 VanDerWaalsContact CD-CD 3.48Å; E463-K468 PolarHBondContact O-N 2.76Å; E463-K468 VanDerWaalsContact OE1-CD 3.27Å; E463-K468 WeakPolarHBondContact OE1-CD 3.41Å; E463-K468 IonicContact OE1-NZ 2.7Å; E463-K468 PolarHBondContact OE1-NZ 3.49Å; E463-K468 WeakPolarHBondContact OE2-CD 3.43Å; E463-K468 IonicContact OE2-NZ 2.73Å; E463-A469 PolarHBondContact O-N 2.9Å
464	F	91.7	Very high	91.8	Very high	1 Å²	1	41.2 Å²	41.2	0%	0.004	21%	0.214	C	C	.	.	H	α-helix	trans	-71.1	-44.7	172.4	-176.3	-110.1	0	0	0	112.1	K420 I422 V460 L461 N462 S466 G467 A469 P470 L472 V484 V487	K420-F464 HydrophobicContact CD-CE1 4.27Å; K420-F464 HydrophobicContact CD-CE2 4.26Å; K420-F464 HydrophobicContact CD-CZ 3.98Å; K420-F464 HydrophobicContact CG-CD2 4.34Å; K420-F464 HydrophobicContact CG-CE1 4.34Å; K420-F464 HydrophobicContact CG-CE2 3.56Å; K420-F464 HydrophobicContact CG-CZ 3.55Å; I422-F464 HydrophobicContact CD1-CE1 3.87Å; I422-F464 HydrophobicContact CD1-CZ 4.02Å; I422-F464 HydrophobicContact CG1-CE1 3.81Å; I422-F464 HydrophobicContact CG1-CE2 4.38Å; I422-F464 HydrophobicContact CG1-CZ 3.43Å; I422-F464 VanDerWaalsContact CG1-CZ 3.43Å; V460-F464 WeakPolarHBondContact O-CB 3.41Å; V460-F464 PolarHBondContact O-N 3.3Å; L461-F464 PolarHBondContact O-N 2.82Å; N462-F464 VanDerWaalsContact C-N 3.3Å; N462-F464 PolarHBondContact O-N 3.06Å; F464-S466 VanDerWaalsContact C-N 3.35Å; F464-S466 PolarHBondContact O-N 2.84Å; F464-G467 PolarHBondContact O-N 2.94Å; F464-G467 VanDerWaalsContact O-N 3.09Å; F464-A469 VanDerWaalsContact CD2-O 3.28Å; F464-A469 WeakPolarHBondContact CD2-O 3.34Å; F464-P470 WeakPolarHBondContact CE2-O 3.25Å; F464-L472 HydrophobicContact CD1-CB 4.27Å; F464-L472 HydrophobicContact CD1-CD2 3.78Å; F464-L472 HydrophobicContact CD2-CB 3.53Å; F464-L472 HydrophobicContact CE1-CB 4.3Å; F464-L472 HydrophobicContact CE1-CD2 4.02Å; F464-L472 HydrophobicContact CE2-CB 3.56Å; F464-L472 HydrophobicContact CG-CB 3.9Å; F464-L472 HydrophobicContact CG-CD2 4.06Å; F464-L472 HydrophobicContact CG-CG 4.46Å; F464-L472 HydrophobicContact CZ-CB 3.97Å; F464-L472 HydrophobicContact CZ-CD2 4.48Å; F464-V484 HydrophobicContact CD1-CB 4.39Å; F464-V484 HydrophobicContact CD1-CG1 3.8Å; F464-V484 HydrophobicContact CD1-CG2 4.07Å; F464-V484 HydrophobicContact CE1-CB 4.1Å; F464-V484 HydrophobicContact CE1-CG1 3.68Å; F464-V484 HydrophobicContact CE1-CG2 4.11Å; F464-V487 HydrophobicContact CE1-CG2 3.91Å; F464-V487 HydrophobicContact CZ-CG2 4.01Å
465	R	88.7	Confident	92	Very high	85 Å²	85	41.1 Å²	41.1	32%	0.321	21%	0.214	S	C	.	.	H	α-helix	trans	-58.1	-46	175.2	-76.8	175	-175.2	-83.3	-3.5	111.3	L461 N462 G467 D483 V484	L461-R465 WeakPolarHBondContact O-CB 3.44Å; L461-R465 VanDerWaalsContact O-CG 3.28Å; L461-R465 WeakPolarHBondContact O-CG 3.14Å; L461-R465 PolarHBondContact O-N 2.83Å; N462-R465 PolarHBondContact O-N 2.71Å; R465-G467 PolarHBondContact O-N 2.87Å; R465-D483 PolarHBondContact NH1-O 2.8Å; R465-V484 HydrophobicContact CG-CG1 4.17Å; R465-V484 HydrophobicContact CG-CG2 4.1Å
466	S	90.6	Very high	91.7	Very high	70 Å²	70	37.3 Å²	37.3	49%	0.49	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-5	179	74.6	0	0	0	0	114	N462 E463 F464 K468	N462-S466 WeakPolarHBondContact O-CB 3.34Å; N462-S466 PolarHBondContact O-N 3.42Å; N462-S466 PolarHBondContact O-OG 3.2Å; E463-S466 PolarHBondContact O-OG 3.37Å; F464-S466 VanDerWaalsContact C-N 3.35Å; F464-S466 PolarHBondContact O-N 2.84Å; S466-K468 VanDerWaalsContact C-N 3.27Å; S466-K468 PolarHBondContact O-N 2.84Å; S466-K468 WeakPolarHBondContact OG-CG 3.47Å
467	G	89.8	Confident	90.6	Very high	37 Å²	37	36.8 Å²	36.8	38%	0.381	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.4	9.7	-179.4	0	0	0	0	0	115.2	E463 F464 R465 A469	E463-G467 PolarHBondContact O-N 2.78Å; F464-G467 PolarHBondContact O-N 2.94Å; F464-G467 VanDerWaalsContact O-N 3.09Å; R465-G467 PolarHBondContact O-N 2.87Å; G467-A469 VanDerWaalsContact C-N 3.31Å
468	K	92.2	Very high	89.2	Confident	144 Å²	144	36.3 Å²	36.3	63%	0.626	19%	0.188	S	C	*	.	S	Bend	trans	-70.5	-32.6	177.6	-71.7	173.1	-172.3	173.7	0	111.8	E463 S466	E463-K468 VanDerWaalsContact CD-CD 3.48Å; E463-K468 PolarHBondContact O-N 2.76Å; E463-K468 VanDerWaalsContact OE1-CD 3.27Å; E463-K468 WeakPolarHBondContact OE1-CD 3.41Å; E463-K468 IonicContact OE1-NZ 2.7Å; E463-K468 PolarHBondContact OE1-NZ 3.49Å; E463-K468 WeakPolarHBondContact OE2-CD 3.43Å; E463-K468 IonicContact OE2-NZ 2.73Å; S466-K468 VanDerWaalsContact C-N 3.27Å; S466-K468 PolarHBondContact O-N 2.84Å; S466-K468 WeakPolarHBondContact OG-CG 3.47Å
469	A	92.6	Very high	87.7	Confident	8 Å²	8	34.8 Å²	34.8	7%	0.066	18%	0.18	C	C	.	.	S	Bend	trans	-116.6	109.5	168.2	0	0	0	0	0	108.6	M446 E463 F464 G467 I471	M446-A469 HydrophobicContact CE-CB 3.14Å; M446-A469 HydrophobicContact CG-CB 4.28Å; M446-A469 HydrophobicContact SD-CB 4.17Å; E463-A469 PolarHBondContact O-N 2.9Å; F464-A469 VanDerWaalsContact CD2-O 3.28Å; F464-A469 WeakPolarHBondContact CD2-O 3.34Å; G467-A469 VanDerWaalsContact C-N 3.31Å; A469-I471 VanDerWaalsContact C-N 3.3Å; A469-I471 PolarHBondContact O-N 2.82Å
470	P	94.4	Very high	86.5	Confident	16 Å²	16	28.4 Å²	28.4	10%	0.104	16%	0.156	C	C	.	.			trans	-77.7	-13.9	-177.2	28.7	-32.9	0	0	0	113.2	M414 N419 K420 T421 P444 F464	M414-P470 HydrophobicContact CE-CG 3.93Å; M414-P470 HydrophobicContact SD-CG 4.23Å; N419-P470 WeakPolarHBondContact OD1-CB 3.29Å; K420-P470 CarbonylContact C-O 3.5Å; K420-P470 WeakPolarHBondContact CA-O 3.28Å; T421-P470 PolarHBondContact N-O 2.88Å; P444-P470 HydrophobicContact CG-CG 3.87Å; F464-P470 WeakPolarHBondContact CE2-O 3.25Å
471	I	95.9	Very high	84.9	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	116.9	-174.4	-55.3	163.7	0	0	0	110.4	M410 M414 I423 M438 W443 P444 A445 M446 A469	M410-I471 HydrophobicContact CE-CD1 3.48Å; M410-I471 VanDerWaalsContact CE-CD1 3.48Å; M410-I471 HydrophobicContact CE-CG1 3.67Å; M414-I471 HydrophobicContact SD-CD1 4.06Å; M414-I471 HydrophobicContact SD-CG1 4.2Å; I423-I471 HydrophobicContact CD1-CG2 3.75Å; I423-I471 HydrophobicContact CG1-CG2 4.49Å; M438-I471 HydrophobicContact CE-CD1 4.37Å; M438-I471 HydrophobicContact CE-CG2 4.41Å; W443-I471 HydrophobicContact CB-CD1 4.28Å; W443-I471 HydrophobicContact CE3-CD1 4.27Å; P444-I471 HydrophobicContact CG-CD1 4.12Å; A445-I471 WeakPolarHBondContact CA-O 3.29Å; A445-I471 HydrophobicContact CB-CB 4.09Å; A445-I471 HydrophobicContact CB-CG2 3.81Å; M446-I471 PolarHBondContact N-O 3.05Å; M446-I471 VanDerWaalsContact N-O 3.08Å; A469-I471 VanDerWaalsContact C-N 3.3Å; A469-I471 PolarHBondContact O-N 2.82Å
472	L	94.9	Very high	84.1	Confident	1 Å²	1	28.1 Å²	28.1	1%	0.005	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	119.7	174.6	-178.5	67.2	0	0	0	110.9	T421 I422 I423 I448 V460 F464	T421-L472 PolarHBondContact O-N 2.83Å; I422-L472 CarbonylContact C-O 3.51Å; I422-L472 VanDerWaalsContact CA-O 3.3Å; I422-L472 WeakPolarHBondContact CA-O 3.42Å; I422-L472 HydrophobicContact CG1-CB 4.46Å; I423-L472 PolarHBondContact N-O 2.88Å; I448-L472 HydrophobicContact CB-CD1 4.26Å; I448-L472 HydrophobicContact CG2-CD1 3.74Å; I448-L472 HydrophobicContact CG2-CD2 4.15Å; I448-L472 HydrophobicContact CG2-CG 4.09Å; V460-L472 HydrophobicContact CG1-CD1 3.55Å; F464-L472 HydrophobicContact CD1-CB 4.27Å; F464-L472 HydrophobicContact CD1-CD2 3.78Å; F464-L472 HydrophobicContact CD2-CB 3.53Å; F464-L472 HydrophobicContact CE1-CB 4.3Å; F464-L472 HydrophobicContact CE1-CD2 4.02Å; F464-L472 HydrophobicContact CE2-CB 3.56Å; F464-L472 HydrophobicContact CG-CB 3.9Å; F464-L472 HydrophobicContact CG-CD2 4.06Å; F464-L472 HydrophobicContact CG-CG 4.46Å; F464-L472 HydrophobicContact CZ-CB 3.97Å; F464-L472 HydrophobicContact CZ-CD2 4.48Å
473	I	95.6	Very high	83.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	127.4	172.9	-57.6	163.5	0	0	0	108.4	I423 V425 C431 L434 T435 M438 A445 M446 C447 I448	I423-I473 HydrophobicContact CB-CG1 4.09Å; I423-I473 HydrophobicContact CD1-CG1 4.09Å; I423-I473 CarbonylContact O-C 3.6Å; I423-I473 VanDerWaalsContact O-CA 3.3Å; I423-I473 WeakPolarHBondContact O-CA 3.3Å; V425-I473 HydrophobicContact CG1-CG2 4.22Å; V425-I473 HydrophobicContact CG2-CG2 4.3Å; C431-I473 PolarHBondContact SG-O 2.71Å; L434-I473 HydrophobicContact CD2-CD1 4.43Å; L434-I473 HydrophobicContact CD2-CG2 4.16Å; L434-I473 HydrophobicContact CG-CD1 4.17Å; T435-I473 HydrophobicContact CG2-CD1 4.32Å; T435-I473 WeakPolarHBondContact OG1-CD1 3.41Å; M438-I473 HydrophobicContact SD-CD1 3.78Å; A445-I473 HydrophobicContact CB-CD1 4Å; M446-I473 PolarHBondContact O-N 3.26Å; C447-I473 CarbonylContact C-O 3.5Å; C447-I473 WeakPolarHBondContact CA-O 3.22Å; I448-I473 PolarHBondContact N-O 3.34Å
474	A	94.1	Very high	82.6	Confident	1 Å²	1	25 Å²	25	1%	0.008	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	150.8	-170.6	0	0	0	0	0	113.3	I422 I423 F424 V425 I448	I422-A474 HydrophobicContact CG2-CB 4.45Å; I423-A474 PolarHBondContact O-N 3.49Å; F424-A474 WeakPolarHBondContact CA-O 3.27Å; F424-A474 HydrophobicContact CD1-CB 3.93Å; F424-A474 HydrophobicContact CE1-CB 3.71Å; V425-A474 PolarHBondContact N-O 2.98Å; I448-A474 HydrophobicContact CG2-CB 3.68Å; I448-A474 WeakPolarHBondContact O-CA 3.45Å
475	T	92.3	Very high	81.9	Confident	4 Å²	4	32 Å²	32	3%	0.025	17%	0.173	C	C	.	.			trans	-93.8	166.6	163.5	58.7	0	0	0	0	110.8	V425 K428 C431 I448 H449 V477 A478 S479	V425-T475 HydrophobicContact CG2-CG2 4.24Å; K428-T475 HydrophobicContact CG-CG2 4.34Å; C431-T475 HydrophobicContact CB-CG2 4.03Å; I448-T475 PolarHBondContact O-N 3.36Å; H449-T475 HydrophobicContact CB-CG2 3.83Å; H449-T475 WeakPolarHBondContact CB-OG1 3.34Å; T475-V477 PolarHBondContact O-N 3.12Å; T475-V477 VanDerWaalsContact O-N 3.11Å; T475-A478 PolarHBondContact O-N 2.84Å; T475-S479 PolarHBondContact O-N 3.37Å; T475-S479 VanDerWaalsContact O-N 3.17Å
476	D	84.5	Confident	81.6	Confident	14 Å²	14	31.9 Å²	31.9	8%	0.075	18%	0.178	C	C	.	.	H	α-helix	trans	-56.8	-30.7	179.3	-72.2	-44	0	0	0	115.1	A478 S479 R505	D476-A478 PolarHBondContact O-N 3.18Å; D476-A478 VanDerWaalsContact O-N 3.15Å; D476-S479 VanDerWaalsContact CA-OG 3.31Å; D476-S479 WeakPolarHBondContact CA-OG 3.47Å; D476-S479 PolarHBondContact O-N 3.31Å; D476-S479 VanDerWaalsContact O-N 3.13Å; D476-S479 PolarHBondContact O-OG 3.47Å; D476-R505 IonicContact OD1-CZ 3.09Å; D476-R505 VanDerWaalsContact OD1-CZ 3.24Å; D476-R505 IonicContact OD1-NE 3.47Å; D476-R505 PolarHBondContact OD1-NE 2.83Å; D476-R505 IonicContact OD1-NH2 3.86Å; D476-R505 PolarHBondContact OD1-NH2 2.81Å; D476-R505 IonicContact OD2-CZ 3.33Å; D476-R505 IonicContact OD2-NE 2.98Å; D476-R505 IonicContact OD2-NH2 2.74Å; D476-R505 PolarHBondContact OD2-NH2 2.91Å
477	V	67.5	Low	81.7	Confident	61 Å²	61	29 Å²	29	37%	0.37	16%	0.157	S	C	.	.	H	α-helix	trans	-62.7	-24.4	179.1	-177	0	0	0	0	111.6	T253 T475	T253-V477 VanDerWaalsContact CG2-O 3.3Å; T253-V477 WeakPolarHBondContact CG2-O 3.46Å; T475-V477 PolarHBondContact O-N 3.12Å; T475-V477 VanDerWaalsContact O-N 3.11Å
478	A	61.5	Low	81.9	Confident	2 Å²	2	29.2 Å²	29.2	2%	0.017	15%	0.148	C	C	.	.	H	α-helix	trans	-106.8	-8.1	176.7	0	0	0	0	0	113.3	I448 T475 D476 L482	I448-A478 HydrophobicContact CB-CB 4.23Å; I448-A478 HydrophobicContact CD1-CB 4.09Å; I448-A478 HydrophobicContact CG1-CB 3.78Å; I448-A478 HydrophobicContact CG2-CB 3.66Å; T475-A478 PolarHBondContact O-N 2.84Å; D476-A478 PolarHBondContact O-N 3.18Å; D476-A478 VanDerWaalsContact O-N 3.15Å; A478-L482 WeakPolarHBondContact O-CD1 3.37Å; A478-L482 WeakPolarHBondContact O-CG 3.4Å
479	S	58	Low	82.1	Confident	2 Å²	2	22.8 Å²	22.8	1%	0.014	12%	0.12	C	C	.	.	H	α-helix	trans	-77.8	-33	-174.1	71.4	0	0	0	0	113.4	F424 T475 D476 R508	F424-S479 VanDerWaalsContact CZ-CB 3.41Å; T475-S479 PolarHBondContact O-N 3.37Å; T475-S479 VanDerWaalsContact O-N 3.17Å; D476-S479 VanDerWaalsContact CA-OG 3.31Å; D476-S479 WeakPolarHBondContact CA-OG 3.47Å; D476-S479 PolarHBondContact O-N 3.31Å; D476-S479 VanDerWaalsContact O-N 3.13Å; D476-S479 PolarHBondContact O-OG 3.47Å; S479-R508 VanDerWaalsContact O-CD 3.23Å; S479-R508 WeakPolarHBondContact O-CD 3.32Å; S479-R508 PolarHBondContact O-NE 2.95Å
480	R	66.3	Low	82.2	Confident	5 Å²	5	22.4 Å²	22.4	2%	0.019	12%	0.117	C	C	.	.	S	Bend	trans	-84.8	135.7	-167.7	-67	-179.7	169.1	-131.7	15.6	111.8	T253 D328 L482 D501	T253-R480 PolarHBondContact OG1-O 3.46Å; D328-R480 IonicContact OD2-NH1 3.2Å; R480-L482 VanDerWaalsContact C-N 3.29Å; R480-L482 PolarHBondContact O-N 3.19Å; R480-D501 IonicContact CZ-OD1 2.73Å; R480-D501 IonicContact NE-OD1 3.93Å; R480-D501 PolarHBondContact NE-OD1 3.38Å; R480-D501 IonicContact NH2-OD1 2.8Å; R480-D501 PolarHBondContact NH2-OD1 3.02Å
481	G	59.7	Low	82.3	Confident	3 Å²	3	21.7 Å²	21.7	3%	0.031	11%	0.112	C	C	.	.	S	Bend	trans	81.4	-14.6	175.2	0	0	0	0	0	117.1	L256 Q259 D483	L256-G481 WeakPolarHBondContact CD1-O 3.47Å; Q259-G481 PolarHBondContact NE2-O 3.33Å; G481-D483 PolarHBondContact O-N 3.34Å; G481-D483 VanDerWaalsContact O-N 3.1Å
482	L	71.5	Confident	82.4	Confident	6 Å²	6	21.7 Å²	21.7	3%	0.031	11%	0.112	C	C	.	.			trans	-62.5	115.8	176.5	-65.6	-176	0	0	0	110.9	E255 L461 A478 R480 V484 R508	E255-L482 HydrophobicContact CB-CD2 3.61Å; E255-L482 HydrophobicContact CG-CD2 4.44Å; L461-L482 HydrophobicContact CD1-CD1 3.73Å; L461-L482 HydrophobicContact CD1-CD2 3.89Å; L461-L482 HydrophobicContact CD1-CG 4.39Å; L461-L482 HydrophobicContact CD2-CD2 3.62Å; L461-L482 HydrophobicContact CG-CD2 4.43Å; A478-L482 WeakPolarHBondContact O-CD1 3.37Å; A478-L482 WeakPolarHBondContact O-CG 3.4Å; R480-L482 VanDerWaalsContact C-N 3.29Å; R480-L482 PolarHBondContact O-N 3.19Å; L482-V484 HydrophobicContact CB-CG2 4.42Å; L482-R508 VanDerWaalsContact N-NH1 3.18Å; L482-R508 WeakPolarHBondContact O-CD 3.26Å; L482-R508 PolarHBondContact O-NH1 2.91Å
483	D	71.9	Confident	82.5	Confident	62 Å²	62	22.3 Å²	22.3	33%	0.332	12%	0.115	S	C	.	.			trans	-99.5	95.4	170.6	-164	40.3	0	0	0	107.5	R465 G481 R511	R465-D483 PolarHBondContact NH1-O 2.8Å; G481-D483 PolarHBondContact O-N 3.34Å; G481-D483 VanDerWaalsContact O-N 3.1Å; D483-R511 IonicContact OD1-CZ 2.91Å; D483-R511 VanDerWaalsContact OD1-CZ 3.26Å; D483-R511 IonicContact OD1-NE 2.73Å; D483-R511 PolarHBondContact OD1-NE 2.65Å; D483-R511 IonicContact OD1-NH2 3.69Å; D483-R511 PolarHBondContact OD1-NH2 3.32Å
484	V	80.7	Confident	82.5	Confident	4 Å²	4	22.5 Å²	22.5	2%	0.024	12%	0.116	C	C	.	.			trans	-112.1	121.4	176	-177.2	0	0	0	0	107	K420 L461 F464 R465 L482 V487	K420-V484 HydrophobicContact CD-CG1 4.11Å; L461-V484 HydrophobicContact CD1-CG2 4.27Å; F464-V484 HydrophobicContact CD1-CB 4.39Å; F464-V484 HydrophobicContact CD1-CG1 3.8Å; F464-V484 HydrophobicContact CD1-CG2 4.07Å; F464-V484 HydrophobicContact CE1-CB 4.1Å; F464-V484 HydrophobicContact CE1-CG1 3.68Å; F464-V484 HydrophobicContact CE1-CG2 4.11Å; R465-V484 HydrophobicContact CG-CG1 4.17Å; R465-V484 HydrophobicContact CG-CG2 4.1Å; L482-V484 HydrophobicContact CB-CG2 4.42Å; V484-V487 HydrophobicContact CB-CG2 3.8Å; V484-V487 HydrophobicContact CG1-CG2 3.91Å
485	E	77.7	Confident	82.5	Confident	148 Å²	148	22.7 Å²	22.7	69%	0.692	12%	0.116	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	150.1	175.1	-65.2	179	173.3	0	0	110.4	K420 V487	K420-E485 PolarHBondContact NZ-O 3.45Å; E485-V487 VanDerWaalsContact C-N 3.27Å; E485-V487 PolarHBondContact O-N 3.35Å
486	D	82.4	Confident	82.6	Confident	82 Å²	82	22.6 Å²	22.6	44%	0.439	12%	0.116	S	C	.	.	T	Hydrogen-bonded Turn	trans	62.6	16.2	174.7	-36.1	-46.3	0	0	0	117.4	K420 K488	K420-D486 WeakPolarHBondContact CB-O 3.41Å; K420-D486 IonicContact NZ-OD2 3.75Å; D486-K488 PolarHBondContact O-N 3.48Å; D486-K488 VanDerWaalsContact O-N 3.13Å
487	V	91.9	Very high	82.7	Confident	8 Å²	8	27 Å²	27	5%	0.048	14%	0.139	C	C	.	.			trans	-65.3	116.3	167.3	-178.9	0	0	0	0	107.5	K420 I422 F464 V484 E485 V490 T509	K420-V487 HydrophobicContact CD-CG2 4.14Å; K420-V487 HydrophobicContact CG-CG2 4.48Å; I422-V487 HydrophobicContact CD1-CG1 4.03Å; I422-V487 HydrophobicContact CD1-CG2 4.04Å; I422-V487 HydrophobicContact CG1-CG1 3.98Å; I422-V487 HydrophobicContact CG1-CG2 4.43Å; F464-V487 HydrophobicContact CE1-CG2 3.91Å; F464-V487 HydrophobicContact CZ-CG2 4.01Å; V484-V487 HydrophobicContact CB-CG2 3.8Å; V484-V487 HydrophobicContact CG1-CG2 3.91Å; E485-V487 VanDerWaalsContact C-N 3.27Å; E485-V487 PolarHBondContact O-N 3.35Å; V487-V490 HydrophobicContact CG1-CG2 4.26Å; V487-T509 WeakPolarHBondContact O-CB 3.34Å; V487-T509 PolarHBondContact O-OG1 3.36Å
488	K	94.1	Very high	83.7	Confident	42 Å²	42	25.4 Å²	25.4	18%	0.183	13%	0.131	C	C	.	.			trans	-97	-42	179.4	-66.6	-70.6	163.3	152.4	0	111.2	E418 K420 D486 T509 G516 T517	E418-K488 HydrophobicContact CB-CD 4.29Å; E418-K488 HydrophobicContact CB-CG 3.76Å; E418-K488 VanDerWaalsContact CD-NZ 3.32Å; E418-K488 WeakPolarHBondContact O-CG 3.33Å; E418-K488 IonicContact OE1-NZ 3.63Å; E418-K488 PolarHBondContact OE1-NZ 3.27Å; E418-K488 WeakPolarHBondContact OE2-CE 3.33Å; E418-K488 IonicContact OE2-NZ 3.56Å; E418-K488 PolarHBondContact OE2-NZ 2.98Å; K420-K488 PolarHBondContact O-N 2.97Å; D486-K488 PolarHBondContact O-N 3.48Å; D486-K488 VanDerWaalsContact O-N 3.13Å; K488-T509 PolarHBondContact O-OG1 3.47Å; K488-G516 WeakPolarHBondContact O-CA 3.44Å; K488-T517 PolarHBondContact O-N 3.22Å
489	F	96	Very high	85	Confident	10 Å²	10	25.3 Å²	25.3	4%	0.044	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	133.7	-174.5	-60	-81.8	0	0	0	111.9	I413 E416 K420 T421 I422 T517 Y519	I413-F489 HydrophobicContact CB-CD2 4.34Å; I413-F489 HydrophobicContact CB-CE2 4.38Å; I413-F489 HydrophobicContact CD1-CB 3.96Å; I413-F489 HydrophobicContact CD1-CD1 3.85Å; I413-F489 HydrophobicContact CD1-CD2 4.27Å; I413-F489 HydrophobicContact CD1-CE1 4.43Å; I413-F489 HydrophobicContact CD1-CG 3.76Å; I413-F489 HydrophobicContact CG1-CD1 3.9Å; I413-F489 HydrophobicContact CG1-CD2 4.03Å; I413-F489 HydrophobicContact CG1-CE1 4Å; I413-F489 HydrophobicContact CG1-CE2 4.13Å; I413-F489 HydrophobicContact CG1-CG 3.92Å; I413-F489 HydrophobicContact CG1-CZ 4.11Å; I413-F489 HydrophobicContact CG2-CD2 3.46Å; I413-F489 VanDerWaalsContact CG2-CD2 3.46Å; I413-F489 HydrophobicContact CG2-CE2 3.74Å; I413-F489 HydrophobicContact CG2-CG 4.05Å; E416-F489 WeakPolarHBondContact OE2-CZ 3.4Å; K420-F489 PolarHBondContact O-N 3.17Å; T421-F489 WeakPolarHBondContact CA-O 3.48Å; T421-F489 HydrophobicContact CG2-CB 3.94Å; I422-F489 PolarHBondContact N-O 3.42Å; F489-T517 WeakPolarHBondContact CA-O 3.01Å; F489-T517 HydrophobicContact CD1-CG2 4.41Å; F489-T517 HydrophobicContact CE1-CG2 4.48Å; F489-Y519 HydrophobicContact CD1-CD2 4.45Å; F489-Y519 HydrophobicContact CD1-CE2 4.12Å; F489-Y519 HydrophobicContact CE1-CE2 4.33Å
490	V	95.2	Very high	86.4	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	127.3	166	174.5	0	0	0	0	108.2	I422 F424 V487 R508 T509 T517 A518 Y519	I422-V490 CarbonylContact O-C 3.55Å; I422-V490 WeakPolarHBondContact O-CA 3.32Å; F424-V490 HydrophobicContact CD2-CG1 3.77Å; F424-V490 HydrophobicContact CE2-CG1 3.74Å; V487-V490 HydrophobicContact CG1-CG2 4.26Å; V490-R508 HydrophobicContact CG2-CB 4.01Å; V490-T509 HydrophobicContact CB-CG2 4.4Å; V490-T509 HydrophobicContact CG2-CG2 3.81Å; V490-T517 PolarHBondContact N-O 3.24Å; V490-A518 CarbonylContact O-C 3.5Å; V490-A518 VanDerWaalsContact O-CA 3.25Å; V490-A518 WeakPolarHBondContact O-CA 3.41Å; V490-Y519 PolarHBondContact O-N 3.21Å
491	I	97.2	Very high	87.5	Confident	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	112.4	179.9	-56.2	173.1	0	0	0	108.5	L406 L409 M410 I413 T421 I422 I423 F424 Y493 Y519 F521	L406-I491 HydrophobicContact CD1-CD1 4.09Å; L406-I491 HydrophobicContact CD1-CG2 4.06Å; L409-I491 HydrophobicContact CD2-CD1 3.68Å; L409-I491 HydrophobicContact CD2-CG1 3.93Å; L409-I491 HydrophobicContact CD2-CG2 4.25Å; L409-I491 HydrophobicContact CG-CD1 4.29Å; M410-I491 HydrophobicContact SD-CD1 3.72Å; I413-I491 HydrophobicContact CD1-CD1 3.87Å; T421-I491 HydrophobicContact CG2-CD1 3.66Å; T421-I491 HydrophobicContact CG2-CG1 4.03Å; I422-I491 PolarHBondContact O-N 3.4Å; I423-I491 CarbonylContact C-O 3.55Å; I423-I491 WeakPolarHBondContact CA-O 3.37Å; I423-I491 HydrophobicContact CG1-CB 4.2Å; I423-I491 HydrophobicContact CG1-CD1 4.17Å; I423-I491 HydrophobicContact CG2-CB 4.47Å; F424-I491 PolarHBondContact N-O 2.87Å; I491-Y493 PolarHBondContact O-N 3.37Å; I491-Y519 CarbonylContact C-O 3.6Å; I491-Y519 VanDerWaalsContact CA-O 3.31Å; I491-Y519 WeakPolarHBondContact CA-O 3.23Å; I491-F521 HydrophobicContact CG2-CE2 4.38Å
492	N	97	Very high	89	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	90.8	166.3	-66.7	-53	0	0	0	108.3	D494 R505 Y519 T520 F521	N492-D494 VanDerWaalsContact C-N 3.32Å; N492-R505 WeakPolarHBondContact OD1-CD 3.45Å; N492-R505 PolarHBondContact OD1-NH1 3Å; N492-Y519 PolarHBondContact N-O 3.25Å; N492-T520 HydrophobicContact CB-CG2 3.91Å; N492-T520 PolarHBondContact ND2-OG1 2.8Å; N492-F521 PolarHBondContact O-N 2.85Å
493	Y	97.1	Very high	89.9	Confident	14 Å²	14	27.3 Å²	27.3	6%	0.055	14%	0.139	C	C	.	.	S	Bend	trans	-65.9	-41.3	174	-179.1	-88.7	0	0	0	110.4	K402 D403 L406 F424 V425 R430 L434 I491 F521	K402-Y493 HydrophobicContact CB-CD2 4.33Å; K402-Y493 HydrophobicContact CB-CE1 4.35Å; K402-Y493 HydrophobicContact CB-CE2 3.66Å; K402-Y493 HydrophobicContact CD-CD1 4.38Å; K402-Y493 HydrophobicContact CD-CE1 4.08Å; K402-Y493 WeakPolarHBondContact CD-O 3.45Å; K402-Y493 WeakPolarHBondContact CE-O 3.46Å; K402-Y493 PolarHBondContact NZ-O 3.23Å; K402-Y493 VanDerWaalsContact NZ-O 3.14Å; D403-Y493 PolarHBondContact OD1-OH 2.88Å; L406-Y493 HydrophobicContact CB-CD2 4.22Å; L406-Y493 HydrophobicContact CB-CE2 4.19Å; L406-Y493 HydrophobicContact CD1-CD2 4.45Å; L406-Y493 HydrophobicContact CD2-CD2 3.81Å; L406-Y493 HydrophobicContact CD2-CE2 3.93Å; L406-Y493 HydrophobicContact CG-CD2 4.39Å; F424-Y493 WeakPolarHBondContact O-CB 3.35Å; F424-Y493 PolarHBondContact O-N 3.43Å; V425-Y493 HydrophobicContact CG1-CD1 3.98Å; V425-Y493 HydrophobicContact CG1-CG 4.33Å; R430-Y493 VanDerWaalsContact NH2-CE1 3.3Å; L434-Y493 HydrophobicContact CD1-CE2 4.27Å; L434-Y493 HydrophobicContact CD2-CD1 4.37Å; L434-Y493 HydrophobicContact CD2-CD2 4.24Å; L434-Y493 HydrophobicContact CD2-CE2 4.47Å; L434-Y493 HydrophobicContact CD2-CG 4.18Å; I491-Y493 PolarHBondContact O-N 3.37Å; Y493-F521 HydrophobicContact CD2-CD2 4.06Å; Y493-F521 HydrophobicContact CD2-CE2 4.07Å
494	D	95.9	Very high	90.7	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.021	12%	0.123	C	C	.	.	S	Bend	trans	-113.1	128.6	166.6	-61.1	-39.3	0	0	0	109.6	K402 F424 E426 R430 N492 R505	K402-D494 IonicContact NZ-OD1 3.13Å; K402-D494 PolarHBondContact NZ-OD1 3.11Å; F424-D494 PolarHBondContact O-N 3.24Å; E426-D494 HydrophobicContact CB-CB 3.91Å; E426-D494 PolarHBondContact N-OD2 3.26Å; R430-D494 IonicContact CZ-OD1 3.34Å; R430-D494 IonicContact CZ-OD2 3.51Å; R430-D494 IonicContact NE-OD1 2.85Å; R430-D494 IonicContact NE-OD2 2.63Å; R430-D494 PolarHBondContact NE-OD2 2.81Å; R430-D494 IonicContact NH2-OD1 2.67Å; R430-D494 PolarHBondContact NH2-OD1 3.09Å; R430-D494 IonicContact NH2-OD2 2.71Å; R430-D494 PolarHBondContact NH2-OD2 3.02Å; N492-D494 VanDerWaalsContact C-N 3.32Å; D494-R505 PolarHBondContact O-NH1 2.88Å
495	Y	95	Very high	91.2	Very high	5 Å²	5	24.1 Å²	24.1	2%	0.02	12%	0.122	C	C	.	.			trans	-60.4	136	173.4	-171	-88.6	0	0	0	110.2	Y502 T520 F522 N526 Q529 L533	Y495-Y502 AromaticContact CE2-CD2 3.95Å; Y495-Y502 HydrophobicContact CE2-CD2 3.95Å; Y495-Y502 HydrophobicContact CE2-CE2 4.45Å; Y495-Y502 HydrophobicContact CE2-CG 4.45Å; Y495-T520 HydrophobicContact CD2-CG2 3.69Å; Y495-T520 HydrophobicContact CE2-CG2 4.3Å; Y495-F522 HydrophobicContact CD1-CE2 4.41Å; Y495-F522 AromaticContact CD2-CD2 3.65Å; Y495-F522 HydrophobicContact CD2-CD2 3.65Å; Y495-F522 AromaticContact CD2-CE2 3.94Å; Y495-F522 HydrophobicContact CD2-CE2 3.94Å; Y495-F522 HydrophobicContact CE1-CE2 4.48Å; Y495-F522 HydrophobicContact CE2-CD2 4.04Å; Y495-F522 HydrophobicContact CE2-CE2 4.04Å; Y495-F522 HydrophobicContact CG-CD2 4.05Å; Y495-F522 HydrophobicContact CG-CE2 4.14Å; Y495-N526 HydrophobicContact CD1-CB 4.35Å; Y495-N526 HydrophobicContact CG-CB 4.42Å; Y495-Q529 HydrophobicContact CD1-CB 4.32Å; Y495-Q529 HydrophobicContact CE1-CB 3.55Å; Y495-Q529 HydrophobicContact CE1-CG 3.95Å; Y495-L533 HydrophobicContact CD2-CD2 4.46Å; Y495-L533 HydrophobicContact CE2-CD1 4.04Å; Y495-L533 HydrophobicContact CE2-CD2 3.69Å; Y495-L533 HydrophobicContact CE2-CG 4.3Å
496	P	92.6	Very high	91.9	Very high	2 Å²	2	17.1 Å²	17.1	1%	0.013	9%	0.089	C	C	.	.			trans	-66.2	171.4	-176.8	24.4	-33.2	0	0	0	114	D501 Y502 Q529	P496-D501 HydrophobicContact CB-CB 3.57Å; P496-D501 HydrophobicContact CG-CB 4.31Å; P496-Y502 HydrophobicContact CG-CD2 4.4Å; P496-Q529 PolarHBondContact O-NE2 3.19Å
497	N	88.1	Confident	92.2	Very high	106 Å²	106	13.2 Å²	13.2	57%	0.567	7%	0.068	S	C	*	.	S	Bend	trans	-73.9	-26.1	179.2	-70.3	-41.7	0	0	0	113.6	Q529	N497-Q529 PolarHBondContact O-NE2 3.13Å
498	S	88	Confident	92	Very high	29 Å²	29	13 Å²	13	20%	0.203	7%	0.067	C	C	.	.	S	Bend	trans	-137.7	161.5	179.4	92.6	0	0	0	0	112.3	E500 D501 Y502	S498-E500 VanDerWaalsContact C-N 3.28Å; S498-E500 WeakPolarHBondContact CB-OE2 3.16Å; S498-E500 PolarHBondContact OG-N 2.83Å; S498-E500 PolarHBondContact OG-OE2 3.5Å; S498-D501 PolarHBondContact O-N 3.47Å; S498-D501 PolarHBondContact OG-N 3.49Å; S498-D501 VanDerWaalsContact OG-N 3.13Å; S498-Y502 PolarHBondContact O-N 2.86Å; S498-Y502 VanDerWaalsContact O-N 3.14Å
499	S	88.7	Confident	91.9	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-70.9	-28.1	177.6	-55.9	0	0	0	0	111.6	Y502 V503 E532	S499-Y502 WeakPolarHBondContact O-CB 3.42Å; S499-Y502 PolarHBondContact O-N 3.02Å; S499-V503 WeakPolarHBondContact O-CG2 2.82Å; S499-V503 PolarHBondContact O-N 2.93Å; S499-E532 WeakPolarHBondContact OG-CB 3.36Å; S499-E532 PolarHBondContact OG-OE2 3.36Å
500	E	87	Confident	91.5	Very high	47 Å²	47	10.7 Å²	10.7	22%	0.22	6%	0.057	C	C	.	.	H	α-helix	trans	-65.1	-47.2	171.3	-57.2	77.9	-171.1	0	0	111	T358 L384 S498 Y502 V503 H504	T358-E500 HydrophobicContact CG2-CB 4.02Å; T358-E500 HydrophobicContact CG2-CG 4.1Å; L384-E500 HydrophobicContact CD1-CG 4.27Å; S498-E500 VanDerWaalsContact C-N 3.28Å; S498-E500 WeakPolarHBondContact CB-OE2 3.16Å; S498-E500 PolarHBondContact OG-N 2.83Å; S498-E500 PolarHBondContact OG-OE2 3.5Å; E500-Y502 PolarHBondContact O-N 3.39Å; E500-V503 PolarHBondContact O-N 3.33Å; E500-H504 PolarHBondContact O-CD2 2.98Å; E500-H504 PolarHBondContact O-N 2.96Å
501	D	89.2	Confident	91	Very high	6 Å²	6	12.4 Å²	12.4	3%	0.032	6%	0.063	C	C	.	.	H	α-helix	trans	-56.1	-40.2	173.7	-87.5	-38.8	0	0	0	111	R480 P496 S498 H504 R505	R480-D501 IonicContact CZ-OD1 2.73Å; R480-D501 IonicContact NE-OD1 3.93Å; R480-D501 PolarHBondContact NE-OD1 3.38Å; R480-D501 IonicContact NH2-OD1 2.8Å; R480-D501 PolarHBondContact NH2-OD1 3.02Å; P496-D501 HydrophobicContact CB-CB 3.57Å; P496-D501 HydrophobicContact CG-CB 4.31Å; S498-D501 PolarHBondContact O-N 3.47Å; S498-D501 PolarHBondContact OG-N 3.49Å; S498-D501 VanDerWaalsContact OG-N 3.13Å; D501-H504 PolarHBondContact O-N 3.28Å; D501-R505 WeakPolarHBondContact O-CB 3.46Å; D501-R505 VanDerWaalsContact O-CG 3.28Å; D501-R505 WeakPolarHBondContact O-CG 2.94Å; D501-R505 PolarHBondContact O-N 3.33Å
502	Y	92.3	Very high	90.3	Very high	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-57.7	-52.9	174.4	175	-99.5	0	0	0	112.1	Q392 Y495 P496 S498 S499 E500 H504 R505 I506 T520 L533 V536	Q392-Y502 PolarHBondContact OE1-OH 3.13Å; Y495-Y502 AromaticContact CE2-CD2 3.95Å; Y495-Y502 HydrophobicContact CE2-CD2 3.95Å; Y495-Y502 HydrophobicContact CE2-CE2 4.45Å; Y495-Y502 HydrophobicContact CE2-CG 4.45Å; P496-Y502 HydrophobicContact CG-CD2 4.4Å; S498-Y502 PolarHBondContact O-N 2.86Å; S498-Y502 VanDerWaalsContact O-N 3.14Å; S499-Y502 WeakPolarHBondContact O-CB 3.42Å; S499-Y502 PolarHBondContact O-N 3.02Å; E500-Y502 PolarHBondContact O-N 3.39Å; Y502-H504 VanDerWaalsContact C-N 3.28Å; Y502-H504 PolarHBondContact O-N 2.99Å; Y502-R505 PolarHBondContact O-N 2.64Å; Y502-I506 HydrophobicContact CD1-CD1 4.22Å; Y502-I506 HydrophobicContact CD2-CG2 4.29Å; Y502-I506 HydrophobicContact CE1-CD1 3.66Å; Y502-I506 HydrophobicContact CE1-CG2 4.47Å; Y502-I506 HydrophobicContact CE2-CG2 3.88Å; Y502-I506 WeakPolarHBondContact O-CG1 3.48Å; Y502-I506 PolarHBondContact O-N 2.99Å; Y502-T520 HydrophobicContact CE2-CG2 4.25Å; Y502-T520 WeakPolarHBondContact CE2-OG1 3.16Å; Y502-L533 HydrophobicContact CD1-CD1 3.97Å; Y502-L533 HydrophobicContact CD2-CD1 4.33Å; Y502-L533 HydrophobicContact CE1-CD1 3.59Å; Y502-L533 HydrophobicContact CE2-CD1 3.97Å; Y502-L533 HydrophobicContact CG-CD1 4.33Å; Y502-V536 HydrophobicContact CD1-CG1 4.33Å; Y502-V536 HydrophobicContact CE1-CG1 4.11Å
503	V	90.1	Very high	89.7	Confident	4 Å²	4	22.3 Å²	22.3	2%	0.024	13%	0.127	C	C	.	.	H	α-helix	trans	-57.2	-42.1	178	170	0	0	0	0	111.4	L384 S385 A386 S499 E500 I506 G507 V536	L384-V503 HydrophobicContact CD1-CB 4.38Å; L384-V503 HydrophobicContact CD1-CG2 3.9Å; L384-V503 HydrophobicContact CD2-CG2 4.32Å; L384-V503 HydrophobicContact CG-CG2 3.98Å; S385-V503 WeakPolarHBondContact O-CG1 3.45Å; A386-V503 HydrophobicContact CB-CG2 4.42Å; S499-V503 WeakPolarHBondContact O-CG2 2.82Å; S499-V503 PolarHBondContact O-N 2.93Å; E500-V503 PolarHBondContact O-N 3.33Å; V503-I506 WeakPolarHBondContact O-CG1 3.38Å; V503-G507 PolarHBondContact O-N 2.83Å; V503-V536 HydrophobicContact CG2-CG1 4.1Å
504	H	87.5	Confident	89.4	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-67.5	-39.3	179	-81.4	-71.6	0	0	0	113.9	E326 D328 T358 E500 D501 Y502 R508	E326-H504 IonicContact OE2-CE1 3.95Å; E326-H504 PolarHBondContact OE2-CE1 2.65Å; E326-H504 IonicContact OE2-ND1 2.61Å; D328-H504 IonicContact OD2-NE2 3.27Å; T358-H504 PolarHBondContact OG1-NE2 3.17Å; E500-H504 PolarHBondContact O-CD2 2.98Å; E500-H504 PolarHBondContact O-N 2.96Å; D501-H504 PolarHBondContact O-N 3.28Å; Y502-H504 VanDerWaalsContact C-N 3.28Å; Y502-H504 PolarHBondContact O-N 2.99Å; H504-R508 PolarHBondContact O-NE 3.48Å; H504-R508 VanDerWaalsContact O-NE 3.11Å; H504-R508 PolarHBondContact O-NH2 3.2Å
505	R	91.4	Very high	89.2	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-65	-53	177.4	-77.8	-177.4	-176.4	-171	4.6	110.9	F424 D476 N492 D494 D501 Y502 G507 R508	F424-R505 HydrophobicContact CD1-CG 4.32Å; F424-R505 HydrophobicContact CD2-CB 3.66Å; F424-R505 HydrophobicContact CD2-CG 3.64Å; F424-R505 HydrophobicContact CE2-CB 3.68Å; F424-R505 HydrophobicContact CE2-CG 3.83Å; F424-R505 HydrophobicContact CG-CB 4.41Å; F424-R505 HydrophobicContact CG-CG 3.89Å; F424-R505 HydrophobicContact CZ-CB 4.49Å; F424-R505 HydrophobicContact CZ-CG 4.29Å; D476-R505 IonicContact OD1-CZ 3.09Å; D476-R505 VanDerWaalsContact OD1-CZ 3.24Å; D476-R505 IonicContact OD1-NE 3.47Å; D476-R505 PolarHBondContact OD1-NE 2.83Å; D476-R505 IonicContact OD1-NH2 3.86Å; D476-R505 PolarHBondContact OD1-NH2 2.81Å; D476-R505 IonicContact OD2-CZ 3.33Å; D476-R505 IonicContact OD2-NE 2.98Å; D476-R505 IonicContact OD2-NH2 2.74Å; D476-R505 PolarHBondContact OD2-NH2 2.91Å; N492-R505 WeakPolarHBondContact OD1-CD 3.45Å; N492-R505 PolarHBondContact OD1-NH1 3Å; D494-R505 PolarHBondContact O-NH1 2.88Å; D501-R505 WeakPolarHBondContact O-CB 3.46Å; D501-R505 VanDerWaalsContact O-CG 3.28Å; D501-R505 WeakPolarHBondContact O-CG 2.94Å; D501-R505 PolarHBondContact O-N 3.33Å; Y502-R505 PolarHBondContact O-N 2.64Å; R505-G507 PolarHBondContact O-N 2.68Å; R505-R508 WeakPolarHBondContact O-CB 3.48Å; R505-R508 WeakPolarHBondContact O-CG 3.37Å; R505-R508 PolarHBondContact O-N 2.86Å; R505-R508 VanDerWaalsContact O-N 3.11Å
506	I	92.3	Very high	89.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.6	-31.3	180	68.6	175.7	0	0	0	111.2	A386 I390 Q392 Y502 V503 R508 T509 A518	A386-I506 HydrophobicContact CB-CD1 3.78Å; I390-I506 HydrophobicContact CD1-CB 4.19Å; I390-I506 HydrophobicContact CD1-CD1 4.23Å; I390-I506 HydrophobicContact CD1-CG1 3.89Å; I390-I506 WeakPolarHBondContact CD1-O 3.46Å; Q392-I506 HydrophobicContact CG-CD1 4.29Å; Y502-I506 HydrophobicContact CD1-CD1 4.22Å; Y502-I506 HydrophobicContact CD2-CG2 4.29Å; Y502-I506 HydrophobicContact CE1-CD1 3.66Å; Y502-I506 HydrophobicContact CE1-CG2 4.47Å; Y502-I506 HydrophobicContact CE2-CG2 3.88Å; Y502-I506 WeakPolarHBondContact O-CG1 3.48Å; Y502-I506 PolarHBondContact O-N 2.99Å; V503-I506 WeakPolarHBondContact O-CG1 3.38Å; I506-R508 PolarHBondContact O-N 2.92Å; I506-T509 WeakPolarHBondContact O-CG2 3.34Å; I506-T509 PolarHBondContact O-N 3.45Å; I506-T509 VanDerWaalsContact O-N 3.09Å; I506-A518 HydrophobicContact CB-CB 3.81Å; I506-A518 HydrophobicContact CG2-CB 3.51Å
507	G	88.9	Confident	89.3	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	7	173.2	0	0	0	0	0	116	T217 V503 R505 T509 R511	T217-G507 VanDerWaalsContact OG1-CA 3.26Å; T217-G507 WeakPolarHBondContact OG1-CA 3.2Å; V503-G507 PolarHBondContact O-N 2.83Å; R505-G507 PolarHBondContact O-N 2.68Å; G507-T509 CarbonylContact C-O 3.53Å; G507-R511 VanDerWaalsContact O-CD 3.3Å; G507-R511 WeakPolarHBondContact O-CD 3.33Å; G507-R511 PolarHBondContact O-NH1 3.33Å; G507-R511 VanDerWaalsContact O-NH1 3.14Å
508	R	89	Confident	89.7	Confident	5 Å²	5	28.4 Å²	28.4	2%	0.019	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-26.5	165.2	-67.1	-45.7	97.6	177.5	8.8	113	I422 F424 S479 L482 V490 H504 R505 I506	I422-R508 HydrophobicContact CD1-CB 3.97Å; I422-R508 HydrophobicContact CD1-CG 4.26Å; F424-R508 HydrophobicContact CE2-CG 4.24Å; F424-R508 HydrophobicContact CZ-CG 3.96Å; S479-R508 VanDerWaalsContact O-CD 3.23Å; S479-R508 WeakPolarHBondContact O-CD 3.32Å; S479-R508 PolarHBondContact O-NE 2.95Å; L482-R508 VanDerWaalsContact N-NH1 3.18Å; L482-R508 WeakPolarHBondContact O-CD 3.26Å; L482-R508 PolarHBondContact O-NH1 2.91Å; V490-R508 HydrophobicContact CG2-CB 4.01Å; H504-R508 PolarHBondContact O-NE 3.48Å; H504-R508 VanDerWaalsContact O-NE 3.11Å; H504-R508 PolarHBondContact O-NH2 3.2Å; R505-R508 WeakPolarHBondContact O-CB 3.48Å; R505-R508 WeakPolarHBondContact O-CG 3.37Å; R505-R508 PolarHBondContact O-N 2.86Å; R505-R508 VanDerWaalsContact O-N 3.11Å; I506-R508 PolarHBondContact O-N 2.92Å
509	T	90.7	Very high	90.2	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.006	16%	0.155	C	C	.	.	S	Bend	trans	-94	176	167.5	-172	0	0	0	0	110.1	I390 V487 K488 V490 I506 G507 R511 G516	I390-T509 HydrophobicContact CG1-CG2 4.37Å; I390-T509 HydrophobicContact CG2-CG2 4.29Å; V487-T509 WeakPolarHBondContact O-CB 3.34Å; V487-T509 PolarHBondContact O-OG1 3.36Å; K488-T509 PolarHBondContact O-OG1 3.47Å; V490-T509 HydrophobicContact CB-CG2 4.4Å; V490-T509 HydrophobicContact CG2-CG2 3.81Å; I506-T509 WeakPolarHBondContact O-CG2 3.34Å; I506-T509 PolarHBondContact O-N 3.45Å; I506-T509 VanDerWaalsContact O-N 3.09Å; G507-T509 CarbonylContact C-O 3.53Å; T509-R511 VanDerWaalsContact C-N 3.33Å; T509-R511 PolarHBondContact O-N 3.31Å; T509-G516 WeakPolarHBondContact OG1-CA 3.2Å
510	A	89	Confident	90.6	Very high	1 Å²	1	29.3 Å²	29.3	1%	0.008	16%	0.156	C	C	.	.	S	Bend	trans	54.3	41.9	178.3	0	0	0	0	0	114.6	N387 N389 I390 N514	N387-A510 PolarHBondContact ND2-O 3.32Å; N389-A510 HydrophobicContact CB-CB 4.02Å; I390-A510 HydrophobicContact CD1-CB 4.4Å; I390-A510 HydrophobicContact CG1-CB 3.49Å; I390-A510 VanDerWaalsContact CG1-CB 3.49Å; A510-N514 CarbonylContact C-O 3.59Å; A510-N514 WeakPolarHBondContact CA-O 3.46Å; A510-N514 WeakPolarHBondContact CB-O 3.35Å
511	R	84.4	Confident	91.1	Very high	37 Å²	37	27.3 Å²	27.3	14%	0.14	15%	0.146	C	C	.	.			trans	-76.1	145	177.5	-53.6	-68.9	-80.8	-170.5	-6	110.4	D483 G507 T509 T513 N514	D483-R511 IonicContact OD1-CZ 2.91Å; D483-R511 VanDerWaalsContact OD1-CZ 3.26Å; D483-R511 IonicContact OD1-NE 2.73Å; D483-R511 PolarHBondContact OD1-NE 2.65Å; D483-R511 IonicContact OD1-NH2 3.69Å; D483-R511 PolarHBondContact OD1-NH2 3.32Å; G507-R511 VanDerWaalsContact O-CD 3.3Å; G507-R511 WeakPolarHBondContact O-CD 3.33Å; G507-R511 PolarHBondContact O-NH1 3.33Å; G507-R511 VanDerWaalsContact O-NH1 3.14Å; T509-R511 VanDerWaalsContact C-N 3.33Å; T509-R511 PolarHBondContact O-N 3.31Å; R511-T513 PolarHBondContact O-N 3.43Å; R511-N514 VanDerWaalsContact O-CB 3.31Å; R511-N514 WeakPolarHBondContact O-CB 3.23Å; R511-N514 PolarHBondContact O-N 2.85Å; R511-N514 VanDerWaalsContact O-N 3.12Å
512	S	82.3	Confident	91.4	Very high	85 Å²	85	27 Å²	27	59%	0.594	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	-124.7	-174.4	-171.9	0	0	0	0	111
513	T	85.1	Confident	91.5	Very high	122 Å²	122	27.5 Å²	27.5	75%	0.748	15%	0.148	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.4	0.8	178	54.6	0	0	0	0	113.6	R511	R511-T513 PolarHBondContact O-N 3.43Å
514	N	89.4	Confident	91.6	Very high	70 Å²	70	30.3 Å²	30.3	37%	0.374	17%	0.166	S	C	.	.			trans	-70.8	151.7	-179.3	-68.8	-38	0	0	0	111.6	A510 R511	A510-N514 CarbonylContact C-O 3.59Å; A510-N514 WeakPolarHBondContact CA-O 3.46Å; A510-N514 WeakPolarHBondContact CB-O 3.35Å; R511-N514 VanDerWaalsContact O-CB 3.31Å; R511-N514 WeakPolarHBondContact O-CB 3.23Å; R511-N514 PolarHBondContact O-N 2.85Å; R511-N514 VanDerWaalsContact O-N 3.12Å
515	K	92.4	Very high	91.7	Very high	156 Å²	156	33.6 Å²	33.6	68%	0.678	20%	0.2	S	C	*	.			trans	-95.7	158.7	169.2	-64.6	-172.5	177.1	-173.7	0	110.8
516	G	93.8	Very high	91.7	Very high	7 Å²	7	34.9 Å²	34.9	7%	0.072	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	162.7	-176.5	0	0	0	0	0	112.7	N389 I390 L391 K488 T509	N389-G516 PolarHBondContact O-N 2.66Å; I390-G516 CarbonylContact C-O 3.59Å; I390-G516 WeakPolarHBondContact CA-O 3.4Å; L391-G516 PolarHBondContact N-O 3.46Å; K488-G516 WeakPolarHBondContact O-CA 3.44Å; T509-G516 WeakPolarHBondContact OG1-CA 3.2Å
517	T	96.3	Very high	91.6	Very high	26 Å²	26	37.1 Å²	37.1	16%	0.16	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	132.2	176.6	-53.8	0	0	0	0	110.1	L391 I393 K488 F489 V490 Y519	L391-T517 HydrophobicContact CB-CG2 4.3Å; L391-T517 HydrophobicContact CD2-CG2 4.13Å; L391-T517 HydrophobicContact CG-CG2 4.28Å; L391-T517 CarbonylContact O-C 3.55Å; L391-T517 WeakPolarHBondContact O-CA 3.31Å; I393-T517 HydrophobicContact CD1-CG2 4.07Å; K488-T517 PolarHBondContact O-N 3.22Å; F489-T517 WeakPolarHBondContact CA-O 3.01Å; F489-T517 HydrophobicContact CD1-CG2 4.41Å; F489-T517 HydrophobicContact CE1-CG2 4.48Å; V490-T517 PolarHBondContact N-O 3.24Å; T517-Y519 HydrophobicContact CG2-CD2 3.9Å; T517-Y519 HydrophobicContact CG2-CE2 3.45Å; T517-Y519 VanDerWaalsContact CG2-CE2 3.45Å
518	A	96.7	Very high	91.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	118.1	175.4	0	0	0	0	0	110.3	I390 L391 I393 V490 I506	I390-A518 HydrophobicContact CG2-CB 3.72Å; L391-A518 PolarHBondContact O-N 3.23Å; I393-A518 PolarHBondContact N-O 2.81Å; V490-A518 CarbonylContact O-C 3.5Å; V490-A518 VanDerWaalsContact O-CA 3.25Å; V490-A518 WeakPolarHBondContact O-CA 3.41Å; I506-A518 HydrophobicContact CB-CB 3.81Å; I506-A518 HydrophobicContact CG2-CB 3.51Å
519	Y	97.6	Very high	91.8	Very high	48 Å²	48	46.7 Å²	46.7	19%	0.188	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	135.1	171.9	-74.6	-85.9	0	0	0	110	I393 L409 F489 V490 I491 N492 T517	I393-Y519 HydrophobicContact CB-CD1 3.78Å; I393-Y519 HydrophobicContact CB-CE1 3.89Å; I393-Y519 HydrophobicContact CD1-CD1 4.15Å; I393-Y519 HydrophobicContact CD1-CE1 3.4Å; I393-Y519 HydrophobicContact CD1-CE2 4.35Å; I393-Y519 HydrophobicContact CG1-CE1 4.23Å; I393-Y519 HydrophobicContact CG2-CD1 3.74Å; I393-Y519 HydrophobicContact CG2-CE1 3.75Å; I393-Y519 CarbonylContact O-C 3.47Å; I393-Y519 WeakPolarHBondContact O-CA 3.23Å; L409-Y519 HydrophobicContact CD1-CD1 3.86Å; L409-Y519 HydrophobicContact CD1-CD2 3.88Å; L409-Y519 HydrophobicContact CD1-CE1 3.71Å; L409-Y519 HydrophobicContact CD1-CE2 3.73Å; L409-Y519 HydrophobicContact CD1-CG 3.94Å; L409-Y519 HydrophobicContact CD2-CD1 4.06Å; L409-Y519 HydrophobicContact CD2-CD2 3.91Å; L409-Y519 HydrophobicContact CD2-CG 3.6Å; L409-Y519 HydrophobicContact CG-CD2 4.39Å; L409-Y519 HydrophobicContact CG-CG 4.4Å; F489-Y519 HydrophobicContact CD1-CD2 4.45Å; F489-Y519 HydrophobicContact CD1-CE2 4.12Å; F489-Y519 HydrophobicContact CE1-CE2 4.33Å; V490-Y519 PolarHBondContact O-N 3.21Å; I491-Y519 CarbonylContact C-O 3.6Å; I491-Y519 VanDerWaalsContact CA-O 3.31Å; I491-Y519 WeakPolarHBondContact CA-O 3.23Å; N492-Y519 PolarHBondContact N-O 3.25Å; T517-Y519 HydrophobicContact CG2-CD2 3.9Å; T517-Y519 HydrophobicContact CG2-CE2 3.45Å; T517-Y519 VanDerWaalsContact CG2-CE2 3.45Å
520	T	97.4	Very high	91.9	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.006	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	118.8	-177.9	-62.2	0	0	0	0	111.3	I393 D395 N492 Y495 Y502 F522	I393-T520 PolarHBondContact O-N 2.92Å; D395-T520 PolarHBondContact N-O 3.16Å; N492-T520 HydrophobicContact CB-CG2 3.91Å; N492-T520 PolarHBondContact ND2-OG1 2.8Å; Y495-T520 HydrophobicContact CD2-CG2 3.69Å; Y495-T520 HydrophobicContact CE2-CG2 4.3Å; Y502-T520 HydrophobicContact CE2-CG2 4.25Å; Y502-T520 WeakPolarHBondContact CE2-OG1 3.16Å; T520-F522 PolarHBondContact O-N 3.46Å
521	F	97.1	Very high	92	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.018	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	112	170.6	-60.8	-29.8	0	0	0	109.4	D395 K402 K405 L406 L409 I491 N492 Y493	D395-F521 HydrophobicContact CB-CD1 4.22Å; K402-F521 HydrophobicContact CB-CD2 4.22Å; K402-F521 HydrophobicContact CG-CB 4.18Å; K402-F521 HydrophobicContact CG-CD2 4.12Å; K402-F521 HydrophobicContact CG-CG 4.43Å; K405-F521 HydrophobicContact CB-CE1 3.83Å; K405-F521 HydrophobicContact CB-CE2 4.35Å; K405-F521 HydrophobicContact CB-CZ 3.71Å; L406-F521 HydrophobicContact CB-CE2 4.03Å; L406-F521 HydrophobicContact CB-CZ 4.45Å; L406-F521 HydrophobicContact CD1-CE2 4.42Å; L409-F521 HydrophobicContact CD2-CZ 4.34Å; I491-F521 HydrophobicContact CG2-CE2 4.38Å; N492-F521 PolarHBondContact O-N 2.85Å; Y493-F521 HydrophobicContact CD2-CD2 4.06Å; Y493-F521 HydrophobicContact CD2-CE2 4.07Å
522	F	96.2	Very high	92.3	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	124.8	-178.8	-163.2	-87.3	0	0	0	109.8	V394 D395 V396 C397 Y495 T520 N526 A530 L533 L548 L551	V394-F522 HydrophobicContact CG1-CB 3.69Å; V394-F522 HydrophobicContact CG1-CG 4.36Å; D395-F522 PolarHBondContact O-N 3.24Å; V396-F522 VanDerWaalsContact CA-O 3.3Å; V396-F522 WeakPolarHBondContact CA-O 3.41Å; C397-F522 PolarHBondContact N-O 2.99Å; Y495-F522 HydrophobicContact CD1-CE2 4.41Å; Y495-F522 AromaticContact CD2-CD2 3.65Å; Y495-F522 HydrophobicContact CD2-CD2 3.65Å; Y495-F522 AromaticContact CD2-CE2 3.94Å; Y495-F522 HydrophobicContact CD2-CE2 3.94Å; Y495-F522 HydrophobicContact CE1-CE2 4.48Å; Y495-F522 HydrophobicContact CE2-CD2 4.04Å; Y495-F522 HydrophobicContact CE2-CE2 4.04Å; Y495-F522 HydrophobicContact CG-CD2 4.05Å; Y495-F522 HydrophobicContact CG-CE2 4.14Å; T520-F522 PolarHBondContact O-N 3.46Å; F522-N526 HydrophobicContact CD1-CB 4.39Å; F522-N526 HydrophobicContact CD2-CB 4.1Å; F522-N526 HydrophobicContact CE1-CB 3.93Å; F522-N526 HydrophobicContact CE2-CB 3.61Å; F522-N526 HydrophobicContact CG-CB 4.47Å; F522-N526 HydrophobicContact CZ-CB 3.52Å; F522-N526 WeakPolarHBondContact CZ-O 3.44Å; F522-A530 HydrophobicContact CE1-CB 4.14Å; F522-A530 HydrophobicContact CZ-CB 3.73Å; F522-L533 HydrophobicContact CD2-CD2 3.73Å; F522-L533 HydrophobicContact CE2-CD2 3.8Å; F522-L548 HydrophobicContact CD1-CD1 3.71Å; F522-L548 HydrophobicContact CD2-CD1 4.47Å; F522-L548 HydrophobicContact CE1-CD1 3.75Å; F522-L548 HydrophobicContact CE2-CD1 4.5Å; F522-L548 HydrophobicContact CG-CD1 4.08Å; F522-L548 HydrophobicContact CZ-CD1 4.14Å; F522-L551 HydrophobicContact CD1-CD1 4.21Å; F522-L551 HydrophobicContact CE1-CD1 4.28Å
523	T	94.3	Very high	92.8	Very high	11 Å²	11	52.1 Å²	52.1	7%	0.067	27%	0.272	C	S	.	.			trans	-107.6	160.9	-179.3	74.9	0	0	0	0	111.5	C397 K402 G525 N526	C397-T523 WeakPolarHBondContact O-CA 3.4Å; K402-T523 VanDerWaalsContact CE-CG2 3.46Å; T523-G525 PolarHBondContact O-N 3.49Å; T523-G525 VanDerWaalsContact O-N 3.09Å; T523-G525 PolarHBondContact OG1-N 3.28Å; T523-N526 PolarHBondContact N-OD1 3.37Å; T523-N526 WeakPolarHBondContact O-CB 3.2Å; T523-N526 PolarHBondContact O-N 2.93Å; T523-N526 PolarHBondContact OG1-OD1 3.37Å
524	P	91.5	Very high	93.2	Very high	62 Å²	62	47 Å²	47	40%	0.403	24%	0.24	S	C	.	.	G	3₁₀ helix	trans	-55.9	-24.4	170.9	-26.4	35.6	0	0	0	113.7	M398 N526 L527	M398-P524 HydrophobicContact SD-CG 4.05Å; P524-N526 PolarHBondContact O-N 3.29Å; P524-L527 VanDerWaalsContact O-CB 3.31Å; P524-L527 WeakPolarHBondContact O-CB 3.48Å; P524-L527 PolarHBondContact O-N 3Å
525	G	90.8	Very high	93.3	Very high	69 Å²	69	50 Å²	50	71%	0.711	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-63.4	-25.8	173.8	0	0	0	0	0	113.5	T523 L527	T523-G525 PolarHBondContact O-N 3.49Å; T523-G525 VanDerWaalsContact O-N 3.09Å; T523-G525 PolarHBondContact OG1-N 3.28Å; G525-L527 VanDerWaalsContact C-N 3.33Å; G525-L527 PolarHBondContact O-N 2.9Å
526	N	91.2	Very high	93.3	Very high	27 Å²	27	42.7 Å²	42.7	14%	0.144	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-89	5.8	-178.7	-55.5	109.7	0	0	0	113.3	Y495 F522 T523 P524 K528 Q529	Y495-N526 HydrophobicContact CD1-CB 4.35Å; Y495-N526 HydrophobicContact CG-CB 4.42Å; F522-N526 HydrophobicContact CD1-CB 4.39Å; F522-N526 HydrophobicContact CD2-CB 4.1Å; F522-N526 HydrophobicContact CE1-CB 3.93Å; F522-N526 HydrophobicContact CE2-CB 3.61Å; F522-N526 HydrophobicContact CG-CB 4.47Å; F522-N526 HydrophobicContact CZ-CB 3.52Å; F522-N526 WeakPolarHBondContact CZ-O 3.44Å; T523-N526 PolarHBondContact N-OD1 3.37Å; T523-N526 WeakPolarHBondContact O-CB 3.2Å; T523-N526 PolarHBondContact O-N 2.93Å; T523-N526 PolarHBondContact OG1-OD1 3.37Å; P524-N526 PolarHBondContact O-N 3.29Å; N526-K528 PolarHBondContact O-N 3.37Å; N526-Q529 PolarHBondContact O-N 3.42Å
527	L	89.8	Confident	93.2	Very high	47 Å²	47	42.5 Å²	42.5	25%	0.246	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-29.4	-172.9	-177.9	65	0	0	0	114.6	P524 G525 Q529 A530 L551	P524-L527 VanDerWaalsContact O-CB 3.31Å; P524-L527 WeakPolarHBondContact O-CB 3.48Å; P524-L527 PolarHBondContact O-N 3Å; G525-L527 VanDerWaalsContact C-N 3.33Å; G525-L527 PolarHBondContact O-N 2.9Å; L527-Q529 PolarHBondContact O-N 2.82Å; L527-A530 HydrophobicContact CD1-CB 4.47Å; L527-A530 WeakPolarHBondContact O-CB 3.44Å; L527-A530 PolarHBondContact O-N 3.32Å; L527-L551 HydrophobicContact CD1-CB 3.95Å; L527-L551 VanDerWaalsContact CD1-O 3.24Å; L527-L551 WeakPolarHBondContact CD1-O 3.45Å
528	K	90.9	Very high	93	Very high	173 Å²	173	46.1 Å²	46.1	75%	0.752	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-33.6	177.3	-66.3	179.8	-178.1	175.8	0	112.7	N526	N526-K528 PolarHBondContact O-N 3.37Å
529	Q	91.9	Very high	92.7	Very high	33 Å²	33	47.8 Å²	47.8	15%	0.154	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-11.5	-175.8	-64.1	155.7	-38.5	0	0	112.8	Y495 P496 N497 N526 L527 R531 E532 L533	Y495-Q529 HydrophobicContact CD1-CB 4.32Å; Y495-Q529 HydrophobicContact CE1-CB 3.55Å; Y495-Q529 HydrophobicContact CE1-CG 3.95Å; P496-Q529 PolarHBondContact O-NE2 3.19Å; N497-Q529 PolarHBondContact O-NE2 3.13Å; N526-Q529 PolarHBondContact O-N 3.42Å; L527-Q529 PolarHBondContact O-N 2.82Å; Q529-R531 VanDerWaalsContact C-N 3.26Å; Q529-R531 PolarHBondContact O-N 3.09Å; Q529-R531 VanDerWaalsContact O-N 3.16Å; Q529-E532 PolarHBondContact O-N 2.8Å; Q529-E532 VanDerWaalsContact O-N 3.12Å; Q529-L533 PolarHBondContact O-N 3.41Å
530	A	91.8	Very high	92.3	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-55.4	-38	-175.1	0	0	0	0	0	113.3	F522 L527 L533 I534 L548 V552	F522-A530 HydrophobicContact CE1-CB 4.14Å; F522-A530 HydrophobicContact CZ-CB 3.73Å; L527-A530 HydrophobicContact CD1-CB 4.47Å; L527-A530 WeakPolarHBondContact O-CB 3.44Å; L527-A530 PolarHBondContact O-N 3.32Å; A530-L533 PolarHBondContact O-N 3.36Å; A530-I534 WeakPolarHBondContact O-CB 3.38Å; A530-I534 WeakPolarHBondContact O-CD1 3.45Å; A530-I534 WeakPolarHBondContact O-CG1 3.34Å; A530-I534 PolarHBondContact O-N 2.66Å; A530-L548 HydrophobicContact CB-CD1 4.25Å; A530-V552 HydrophobicContact CB-CG2 3.53Å
531	R	91.4	Very high	92.1	Very high	138 Å²	138	52.5 Å²	52.5	52%	0.521	27%	0.267	S	S	.	.	H	α-helix	trans	-65	-41.1	-179.9	-69.8	-178	-178.5	167.6	-1.5	112.8	Q529 K535 V552	Q529-R531 VanDerWaalsContact C-N 3.26Å; Q529-R531 PolarHBondContact O-N 3.09Å; Q529-R531 VanDerWaalsContact O-N 3.16Å; R531-K535 WeakPolarHBondContact O-CG 3.3Å; R531-K535 PolarHBondContact O-N 3.31Å; R531-V552 HydrophobicContact CG-CG1 4.06Å
532	E	91.1	Very high	91.8	Very high	101 Å²	101	54 Å²	54	47%	0.472	27%	0.274	S	S	.	.	H	α-helix	trans	-74.5	-39.3	179.2	-68.3	179.6	-177.3	0	0	110.9	S499 Q529 I534 K535 V536	S499-E532 WeakPolarHBondContact OG-CB 3.36Å; S499-E532 PolarHBondContact OG-OE2 3.36Å; Q529-E532 PolarHBondContact O-N 2.8Å; Q529-E532 VanDerWaalsContact O-N 3.12Å; E532-I534 VanDerWaalsContact C-N 3.33Å; E532-I534 PolarHBondContact O-N 3.22Å; E532-K535 WeakPolarHBondContact O-CB 3.3Å; E532-K535 PolarHBondContact O-N 3.19Å; E532-V536 WeakPolarHBondContact O-CG2 3.36Å; E532-V536 PolarHBondContact O-N 3.49Å
533	L	92.9	Very high	91.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58	-45.1	172.8	-179.6	60.6	0	0	0	111.9	V394 Y495 Y502 F522 Q529 A530 K535 V536 L537 L548	V394-L533 HydrophobicContact CG1-CD2 4.33Å; V394-L533 HydrophobicContact CG2-CD2 4.23Å; Y495-L533 HydrophobicContact CD2-CD2 4.46Å; Y495-L533 HydrophobicContact CE2-CD1 4.04Å; Y495-L533 HydrophobicContact CE2-CD2 3.69Å; Y495-L533 HydrophobicContact CE2-CG 4.3Å; Y502-L533 HydrophobicContact CD1-CD1 3.97Å; Y502-L533 HydrophobicContact CD2-CD1 4.33Å; Y502-L533 HydrophobicContact CE1-CD1 3.59Å; Y502-L533 HydrophobicContact CE2-CD1 3.97Å; Y502-L533 HydrophobicContact CG-CD1 4.33Å; F522-L533 HydrophobicContact CD2-CD2 3.73Å; F522-L533 HydrophobicContact CE2-CD2 3.8Å; Q529-L533 PolarHBondContact O-N 3.41Å; A530-L533 PolarHBondContact O-N 3.36Å; L533-K535 VanDerWaalsContact C-N 3.31Å; L533-K535 PolarHBondContact O-N 3.3Å; L533-V536 PolarHBondContact O-N 3.43Å; L533-L537 HydrophobicContact CD1-CD1 4.43Å; L533-L537 HydrophobicContact CD1-CG 4.36Å; L533-L537 HydrophobicContact CG-CD1 4.1Å; L533-L537 HydrophobicContact CG-CG 4.46Å; L533-L537 WeakPolarHBondContact O-CG 3.42Å; L533-L537 PolarHBondContact O-N 3.3Å; L533-L548 HydrophobicContact CD2-CD2 4.11Å; L533-L548 HydrophobicContact CG-CD2 4.5Å
534	I	93.1	Very high	91.5	Very high	14 Å²	14	60.2 Å²	60.2	7%	0.072	32%	0.32	C	S	.	.	H	α-helix	trans	-57.8	-45.6	177.1	-74.4	164.3	0	0	0	110.5	A530 E532 V536 L537 E538 I544 L548 M549 V552	A530-I534 WeakPolarHBondContact O-CB 3.38Å; A530-I534 WeakPolarHBondContact O-CD1 3.45Å; A530-I534 WeakPolarHBondContact O-CG1 3.34Å; A530-I534 PolarHBondContact O-N 2.66Å; E532-I534 VanDerWaalsContact C-N 3.33Å; E532-I534 PolarHBondContact O-N 3.22Å; I534-V536 VanDerWaalsContact C-N 3.33Å; I534-V536 PolarHBondContact O-N 3.3Å; I534-L537 PolarHBondContact O-N 3.13Å; I534-L537 VanDerWaalsContact O-N 3.13Å; I534-E538 HydrophobicContact CG2-CG 4.17Å; I534-E538 WeakPolarHBondContact O-CB 3.29Å; I534-E538 WeakPolarHBondContact O-CG 3.47Å; I534-E538 PolarHBondContact O-N 3.35Å; I534-I544 HydrophobicContact CG2-CD1 4.27Å; I534-L548 HydrophobicContact CD1-CG 4.35Å; I534-L548 HydrophobicContact CG1-CD2 3.87Å; I534-L548 HydrophobicContact CG1-CG 4.18Å; I534-M549 HydrophobicContact CD1-SD 3.86Å; I534-M549 HydrophobicContact CG1-SD 4.4Å; I534-M549 HydrophobicContact CG2-SD 4.37Å; I534-V552 HydrophobicContact CD1-CB 4.37Å; I534-V552 HydrophobicContact CD1-CG2 3.62Å
535	K	91.4	Very high	91.5	Very high	132 Å²	132	59.1 Å²	59.1	57%	0.574	31%	0.311	S	S	*	.	H	α-helix	trans	-58.7	-42.8	176.3	-71.6	-178.2	174.9	-165.9	0	112.6	R531 E532 L533 L537 E538 E539	R531-K535 WeakPolarHBondContact O-CG 3.3Å; R531-K535 PolarHBondContact O-N 3.31Å; E532-K535 WeakPolarHBondContact O-CB 3.3Å; E532-K535 PolarHBondContact O-N 3.19Å; L533-K535 VanDerWaalsContact C-N 3.31Å; L533-K535 PolarHBondContact O-N 3.3Å; K535-L537 VanDerWaalsContact C-N 3.32Å; K535-L537 PolarHBondContact O-N 3.26Å; K535-E538 PolarHBondContact O-N 3.41Å; K535-E539 VanDerWaalsContact O-CB 3.28Å; K535-E539 WeakPolarHBondContact O-CB 3.39Å; K535-E539 PolarHBondContact O-N 2.87Å
536	V	91.6	Very high	91.5	Very high	4 Å²	4	60 Å²	60	2%	0.024	30%	0.304	C	S	.	.	H	α-helix	trans	-64.4	-37	177.2	175.2	0	0	0	0	111.5	L384 A386 Y502 V503 E532 L533 I534 A540	L384-V536 HydrophobicContact CD2-CG2 3.84Å; L384-V536 HydrophobicContact CG-CG2 4.09Å; A386-V536 HydrophobicContact CB-CG1 3.99Å; Y502-V536 HydrophobicContact CD1-CG1 4.33Å; Y502-V536 HydrophobicContact CE1-CG1 4.11Å; V503-V536 HydrophobicContact CG2-CG1 4.1Å; E532-V536 WeakPolarHBondContact O-CG2 3.36Å; E532-V536 PolarHBondContact O-N 3.49Å; L533-V536 PolarHBondContact O-N 3.43Å; I534-V536 VanDerWaalsContact C-N 3.33Å; I534-V536 PolarHBondContact O-N 3.3Å; V536-A540 WeakPolarHBondContact O-CB 3.45Å; V536-A540 PolarHBondContact O-N 3.23Å
537	L	93	Very high	91.4	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-71.6	-40.5	176.9	-66.8	171.2	0	0	0	112.5	Q392 V394 L533 I534 K535 A540 N541 Q542 I544 L548	Q392-L537 HydrophobicContact CB-CD2 3.62Å; Q392-L537 HydrophobicContact CG-CD2 4.39Å; V394-L537 HydrophobicContact CG2-CD1 3.91Å; V394-L537 HydrophobicContact CG2-CD2 4.41Å; L533-L537 HydrophobicContact CD1-CD1 4.43Å; L533-L537 HydrophobicContact CD1-CG 4.36Å; L533-L537 HydrophobicContact CG-CD1 4.1Å; L533-L537 HydrophobicContact CG-CG 4.46Å; L533-L537 WeakPolarHBondContact O-CG 3.42Å; L533-L537 PolarHBondContact O-N 3.3Å; I534-L537 PolarHBondContact O-N 3.13Å; I534-L537 VanDerWaalsContact O-N 3.13Å; K535-L537 VanDerWaalsContact C-N 3.32Å; K535-L537 PolarHBondContact O-N 3.26Å; L537-A540 PolarHBondContact O-N 3.46Å; L537-N541 PolarHBondContact O-N 3.46Å; L537-Q542 HydrophobicContact CB-CB 4.4Å; L537-Q542 HydrophobicContact CD2-CB 4.11Å; L537-Q542 HydrophobicContact CD2-CG 4.41Å; L537-Q542 PolarHBondContact O-N 2.83Å; L537-I544 HydrophobicContact CB-CG1 4.24Å; L537-L548 HydrophobicContact CD1-CD2 4.05Å
538	E	92.1	Very high	91.4	Very high	103 Å²	103	61.9 Å²	61.9	48%	0.481	31%	0.309	S	S	.	.	H	α-helix	trans	-62.8	-45.1	174.9	-74	176.2	167.5	0	0	110.9	I534 K535 A540 N541 I544	I534-E538 HydrophobicContact CG2-CG 4.17Å; I534-E538 WeakPolarHBondContact O-CB 3.29Å; I534-E538 WeakPolarHBondContact O-CG 3.47Å; I534-E538 PolarHBondContact O-N 3.35Å; K535-E538 PolarHBondContact O-N 3.41Å; E538-A540 VanDerWaalsContact C-N 3.3Å; E538-A540 PolarHBondContact O-N 2.89Å; E538-N541 PolarHBondContact O-N 2.86Å; E538-I544 HydrophobicContact CG-CD1 3.58Å
539	E	90	Very high	91.3	Very high	34 Å²	34	56.9 Å²	56.9	16%	0.159	29%	0.289	C	S	.	.	H	α-helix	trans	-59.7	-41	178.1	-163.2	-74.9	150.6	0	0	111.8	N381 S385 H388 K535 N541	N381-E539 VanDerWaalsContact CB-OE1 3.25Å; N381-E539 WeakPolarHBondContact CB-OE1 3.45Å; N381-E539 WeakPolarHBondContact ND2-CG 3.49Å; N381-E539 PolarHBondContact ND2-OE1 2.9Å; S385-E539 WeakPolarHBondContact CA-OE2 3.38Å; S385-E539 VanDerWaalsContact CB-CD 3.46Å; S385-E539 WeakPolarHBondContact CB-OE2 3.19Å; H388-E539 IonicContact CD2-OE2 3.58Å; H388-E539 IonicContact CE1-OE1 3.43Å; H388-E539 IonicContact NE2-OE1 3.21Å; H388-E539 PolarHBondContact NE2-OE1 3.32Å; H388-E539 IonicContact NE2-OE2 2.81Å; H388-E539 PolarHBondContact NE2-OE2 2.81Å; H388-E539 VanDerWaalsContact NE2-OE2 3.09Å; K535-E539 VanDerWaalsContact O-CB 3.28Å; K535-E539 WeakPolarHBondContact O-CB 3.39Å; K535-E539 PolarHBondContact O-N 2.87Å; E539-N541 VanDerWaalsContact C-N 3.26Å; E539-N541 PolarHBondContact O-N 3.24Å
540	A	89.7	Confident	91	Very high	4 Å²	4	60.4 Å²	60.4	3%	0.033	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	9.4	177.7	0	0	0	0	0	114.2	V536 L537 E538 Q542	V536-A540 WeakPolarHBondContact O-CB 3.45Å; V536-A540 PolarHBondContact O-N 3.23Å; L537-A540 PolarHBondContact O-N 3.46Å; E538-A540 VanDerWaalsContact C-N 3.3Å; E538-A540 PolarHBondContact O-N 2.89Å; A540-Q542 VanDerWaalsContact C-N 3.28Å; A540-Q542 HydrophobicContact CB-CG 3.86Å; A540-Q542 PolarHBondContact O-N 2.76Å; A540-Q542 PolarHBondContact O-NE2 3.42Å
541	N	91.7	Very high	90.6	Very high	144 Å²	144	62.1 Å²	62.1	77%	0.77	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.6	39.4	-179	-60.5	-72.7	0	0	0	114.1	L537 E538 E539	L537-N541 PolarHBondContact O-N 3.46Å; E538-N541 PolarHBondContact O-N 2.86Å; E539-N541 VanDerWaalsContact C-N 3.26Å; E539-N541 PolarHBondContact O-N 3.24Å
542	Q	91.8	Very high	90.3	Very high	35 Å²	35	56.7 Å²	56.7	16%	0.164	30%	0.297	C	S	.	.			trans	-91	153.6	-177.1	-59.4	-65.9	-52.5	0	0	112.1	I390 Q392 L537 A540 I544	I390-Q542 PolarHBondContact O-NE2 2.81Å; Q392-Q542 HydrophobicContact CB-CB 4.48Å; Q392-Q542 HydrophobicContact CB-CG 3.97Å; Q392-Q542 HydrophobicContact CG-CG 4.14Å; L537-Q542 HydrophobicContact CB-CB 4.4Å; L537-Q542 HydrophobicContact CD2-CB 4.11Å; L537-Q542 HydrophobicContact CD2-CG 4.41Å; L537-Q542 PolarHBondContact O-N 2.83Å; A540-Q542 VanDerWaalsContact C-N 3.28Å; A540-Q542 HydrophobicContact CB-CG 3.86Å; A540-Q542 PolarHBondContact O-N 2.76Å; A540-Q542 PolarHBondContact O-NE2 3.42Å; Q542-I544 PolarHBondContact O-N 3.19Å
543	A	92	Very high	89.7	Confident	96 Å²	96	56.6 Å²	56.6	79%	0.793	30%	0.3	S	S	*	.			trans	-72.9	111	175.3	0	0	0	0	0	110.7
544	I	91.5	Very high	88.5	Confident	47 Å²	47	63.8 Å²	63.8	24%	0.241	33%	0.333	C	S	.	.			trans	-78.8	127.6	-177.5	-53.3	172.2	0	0	0	109.7	I534 L537 E538 Q542 P546 L548 M549	I534-I544 HydrophobicContact CG2-CD1 4.27Å; L537-I544 HydrophobicContact CB-CG1 4.24Å; E538-I544 HydrophobicContact CG-CD1 3.58Å; Q542-I544 PolarHBondContact O-N 3.19Å; I544-P546 WeakPolarHBondContact O-CD 3.35Å; I544-L548 HydrophobicContact CG2-CD2 4.35Å; I544-M549 HydrophobicContact CG2-CG 3.88Å; I544-M549 HydrophobicContact CG2-SD 4.15Å
545	N	91	Very high	86.8	Confident	39 Å²	39	69.6 Å²	69.6	21%	0.209	35%	0.354	C	S	.	.			trans	-61.8	123.7	176	-171.4	-31	0	0	0	110.2	V394 K547 L548 M549	V394-N545 WeakPolarHBondContact O-CB 3.49Å; V394-N545 PolarHBondContact O-ND2 3.14Å; N545-K547 PolarHBondContact O-N 3.49Å; N545-K547 VanDerWaalsContact O-N 3.09Å; N545-K547 WeakPolarHBondContact OD1-CB 3.41Å; N545-K547 PolarHBondContact OD1-N 3.22Å; N545-L548 HydrophobicContact CB-CB 4.41Å; N545-L548 VanDerWaalsContact O-CB 3.29Å; N545-L548 WeakPolarHBondContact O-CB 3.5Å; N545-L548 PolarHBondContact O-N 3.39Å; N545-M549 PolarHBondContact O-N 3.23Å
546	P	91.1	Very high	84.9	Confident	87 Å²	87	66.5 Å²	66.5	57%	0.565	36%	0.36	S	S	*	.	H	α-helix	trans	-55.7	-31	179.8	-27.1	34.8	0	0	0	113.8	I544 L548 M549 Q550	I544-P546 WeakPolarHBondContact O-CD 3.35Å; P546-L548 VanDerWaalsContact C-N 3.27Å; P546-L548 PolarHBondContact O-N 2.76Å; P546-M549 PolarHBondContact O-N 3.5Å; P546-Q550 WeakPolarHBondContact O-CG 3.36Å; P546-Q550 PolarHBondContact O-N 2.93Å
547	K	89.5	Confident	82.6	Confident	113 Å²	113	69.2 Å²	69.2	49%	0.491	39%	0.388	S	S	.	.	H	α-helix	trans	-63.7	-33	175.7	-64.8	-178.6	179.1	179.1	0	112.3	V396 N545 L551	V396-K547 HydrophobicContact CB-CB 3.78Å; V396-K547 HydrophobicContact CB-CD 4.26Å; V396-K547 HydrophobicContact CG1-CB 4.18Å; V396-K547 HydrophobicContact CG2-CB 3.9Å; N545-K547 PolarHBondContact O-N 3.49Å; N545-K547 VanDerWaalsContact O-N 3.09Å; N545-K547 WeakPolarHBondContact OD1-CB 3.41Å; N545-K547 PolarHBondContact OD1-N 3.22Å; K547-L551 WeakPolarHBondContact O-CG 3.49Å; K547-L551 PolarHBondContact O-N 3.26Å; K547-L551 VanDerWaalsContact O-N 3.07Å
548	L	89.5	Confident	80.2	Confident	0 Å²	0	73 Å²	73	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-69.6	-41	177.6	-173.6	66.7	0	0	0	110.8	V394 V396 F522 A530 L533 I534 L537 I544 N545 P546 L551 V552	V394-L548 HydrophobicContact CG1-CD2 4.3Å; V396-L548 HydrophobicContact CG2-CB 4.01Å; V396-L548 HydrophobicContact CG2-CD1 4.33Å; F522-L548 HydrophobicContact CD1-CD1 3.71Å; F522-L548 HydrophobicContact CD2-CD1 4.47Å; F522-L548 HydrophobicContact CE1-CD1 3.75Å; F522-L548 HydrophobicContact CE2-CD1 4.5Å; F522-L548 HydrophobicContact CG-CD1 4.08Å; F522-L548 HydrophobicContact CZ-CD1 4.14Å; A530-L548 HydrophobicContact CB-CD1 4.25Å; L533-L548 HydrophobicContact CD2-CD2 4.11Å; L533-L548 HydrophobicContact CG-CD2 4.5Å; I534-L548 HydrophobicContact CD1-CG 4.35Å; I534-L548 HydrophobicContact CG1-CD2 3.87Å; I534-L548 HydrophobicContact CG1-CG 4.18Å; L537-L548 HydrophobicContact CD1-CD2 4.05Å; I544-L548 HydrophobicContact CG2-CD2 4.35Å; N545-L548 HydrophobicContact CB-CB 4.41Å; N545-L548 VanDerWaalsContact O-CB 3.29Å; N545-L548 WeakPolarHBondContact O-CB 3.5Å; N545-L548 PolarHBondContact O-N 3.39Å; P546-L548 VanDerWaalsContact C-N 3.27Å; P546-L548 PolarHBondContact O-N 2.76Å; L548-L551 WeakPolarHBondContact O-CB 3.24Å; L548-L551 PolarHBondContact O-N 3.2Å; L548-V552 PolarHBondContact O-N 3.42Å
549	M	88.6	Confident	77.8	Confident	68 Å²	68	72 Å²	72	34%	0.335	45%	0.445	S	S	.	.	H	α-helix	trans	-62.4	-47.1	174.1	-69.3	-63.4	-69.3	0	0	111.3	I534 I544 N545 P546 L551 V552 D553	I534-M549 HydrophobicContact CD1-SD 3.86Å; I534-M549 HydrophobicContact CG1-SD 4.4Å; I534-M549 HydrophobicContact CG2-SD 4.37Å; I544-M549 HydrophobicContact CG2-CG 3.88Å; I544-M549 HydrophobicContact CG2-SD 4.15Å; N545-M549 PolarHBondContact O-N 3.23Å; P546-M549 PolarHBondContact O-N 3.5Å; M549-L551 VanDerWaalsContact C-N 3.28Å; M549-L551 PolarHBondContact O-N 3.03Å; M549-V552 PolarHBondContact O-N 3.36Å; M549-D553 PolarHBondContact O-N 3.48Å
550	Q	87.6	Confident	75.4	Confident	107 Å²	107	73.6 Å²	73.6	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-58.5	-38.7	177.4	-71.8	172.9	5.9	0	0	112.7	P546 V552 D553 H554	P546-Q550 WeakPolarHBondContact O-CG 3.36Å; P546-Q550 PolarHBondContact O-N 2.93Å; Q550-V552 VanDerWaalsContact C-N 3.29Å; Q550-V552 PolarHBondContact O-N 2.81Å; Q550-D553 PolarHBondContact O-N 3.29Å; Q550-H554 PolarHBondContact O-CD2 3Å; Q550-H554 VanDerWaalsContact O-CG 3.24Å; Q550-H554 PolarHBondContact O-N 3.06Å
551	L	83.3	Confident	73	Confident	36 Å²	36	77.5 Å²	77.5	19%	0.188	51%	0.511	C	S	.	.	H	α-helix	trans	-59.2	-39.8	174.8	-81.1	-179.8	0	0	0	112.2	V396 F522 L527 K547 L548 M549	V396-L551 HydrophobicContact CG1-CD1 3.45Å; V396-L551 VanDerWaalsContact CG1-CD1 3.45Å; V396-L551 HydrophobicContact CG1-CG 4.27Å; V396-L551 HydrophobicContact CG2-CD1 4.33Å; F522-L551 HydrophobicContact CD1-CD1 4.21Å; F522-L551 HydrophobicContact CE1-CD1 4.28Å; L527-L551 HydrophobicContact CD1-CB 3.95Å; L527-L551 VanDerWaalsContact CD1-O 3.24Å; L527-L551 WeakPolarHBondContact CD1-O 3.45Å; K547-L551 WeakPolarHBondContact O-CG 3.49Å; K547-L551 PolarHBondContact O-N 3.26Å; K547-L551 VanDerWaalsContact O-N 3.07Å; L548-L551 WeakPolarHBondContact O-CB 3.24Å; L548-L551 PolarHBondContact O-N 3.2Å; M549-L551 VanDerWaalsContact C-N 3.28Å; M549-L551 PolarHBondContact O-N 3.03Å
552	V	84.9	Confident	70.5	Confident	24 Å²	24	74 Å²	74	15%	0.145	51%	0.51	C	S	.	.	H	α-helix	trans	-74.5	-40.2	178.9	179.5	0	0	0	0	111.7	A530 R531 I534 L548 M549 Q550 H554 R555	A530-V552 HydrophobicContact CB-CG2 3.53Å; R531-V552 HydrophobicContact CG-CG1 4.06Å; I534-V552 HydrophobicContact CD1-CB 4.37Å; I534-V552 HydrophobicContact CD1-CG2 3.62Å; L548-V552 PolarHBondContact O-N 3.42Å; M549-V552 PolarHBondContact O-N 3.36Å; Q550-V552 VanDerWaalsContact C-N 3.29Å; Q550-V552 PolarHBondContact O-N 2.81Å; V552-H554 PolarHBondContact O-N 2.6Å; V552-R555 VanDerWaalsContact O-CB 3.27Å; V552-R555 WeakPolarHBondContact O-CB 3.28Å; V552-R555 PolarHBondContact O-N 3.31Å; V552-R555 VanDerWaalsContact O-N 3.08Å
553	D	78.6	Confident	68	Low	100 Å²	100	75.8 Å²	75.8	54%	0.535	54%	0.537	S	S	.	.	H	α-helix	trans	-65.6	-36.5	-179	-70.7	-22.4	0	0	0	112.5	M549 Q550 R555 G556 G557	M549-D553 PolarHBondContact O-N 3.48Å; Q550-D553 PolarHBondContact O-N 3.29Å; D553-R555 PolarHBondContact O-N 2.91Å; D553-R555 VanDerWaalsContact O-N 3.08Å; D553-G556 PolarHBondContact O-N 2.87Å; D553-G557 PolarHBondContact O-N 3.45Å
554	H	67.5	Low	65.4	Low	151 Å²	151	83.2 Å²	83.2	70%	0.699	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.5	-14.7	174.7	-68	-27.3	0	0	0	113.6	Q550 V552	Q550-H554 PolarHBondContact O-CD2 3Å; Q550-H554 VanDerWaalsContact O-CG 3.24Å; Q550-H554 PolarHBondContact O-N 3.06Å; V552-H554 PolarHBondContact O-N 2.6Å
555	R	56.9	Low	63.2	Low	135 Å²	135	85.8 Å²	85.8	51%	0.509	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-85.5	-13.9	173.3	-150.6	-179	-177.2	-149.7	-2.8	113.3	V552 D553	V552-R555 VanDerWaalsContact O-CB 3.27Å; V552-R555 WeakPolarHBondContact O-CB 3.28Å; V552-R555 PolarHBondContact O-N 3.31Å; V552-R555 VanDerWaalsContact O-N 3.08Å; D553-R555 PolarHBondContact O-N 2.91Å; D553-R555 VanDerWaalsContact O-N 3.08Å
556	G	51.4	Low	60.7	Low	68 Å²	68	95 Å²	95	70%	0.701	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.5	-10	-176	0	0	0	0	0	115.9	D553	D553-G556 PolarHBondContact O-N 2.87Å
557	G	43.5	Very low	58.4	Low	60 Å²	60	101.4 Å²	101.4	62%	0.619	61%	0.613	S	S	*	*			trans	-108.1	4	-167	0	0	0	0	0	118.2	D553 G559	D553-G557 PolarHBondContact O-N 3.45Å; G557-G559 VanDerWaalsContact C-N 3.35Å; G557-G559 PolarHBondContact O-N 3.05Å
558	G	42.7	Very low	56	Low	83 Å²	83	106.7 Å²	106.7	86%	0.856	63%	0.63	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-1.1	-176.5	0	0	0	0	0	116.4	G560	G558-G560 VanDerWaalsContact C-N 3.34Å
559	G	40.4	Very low	53.6	Low	80 Å²	80	112.3 Å²	112.3	83%	0.825	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.8	18	179.3	0	0	0	0	0	114.6	G557 G561	G557-G559 VanDerWaalsContact C-N 3.35Å; G557-G559 PolarHBondContact O-N 3.05Å; G559-G561 PolarHBondContact O-N 3.34Å
560	G	41	Very low	51.2	Low	68 Å²	68	114.9 Å²	114.9	70%	0.701	68%	0.684	S	S	*	*			trans	-68.5	95.6	175.7	0	0	0	0	0	111	G558 G562	G558-G560 VanDerWaalsContact C-N 3.34Å; G560-G562 PolarHBondContact O-N 3.35Å
561	G	38.6	Very low	48.9	Very low	86 Å²	86	115.3 Å²	115.3	89%	0.887	70%	0.699	S	S	*	*			trans	-59.6	75.1	163.2	0	0	0	0	0	111	G559 G563	G559-G561 PolarHBondContact O-N 3.34Å; G561-G563 PolarHBondContact O-N 3.19Å
562	G	40	Very low	46.8	Very low	72 Å²	72	118.7 Å²	118.7	74%	0.742	73%	0.726	S	S	*	*			trans	-81.3	105.4	171.7	0	0	0	0	0	109.9	G560 R564	G560-G562 PolarHBondContact O-N 3.35Å; G562-R564 PolarHBondContact O-N 2.83Å
563	G	38.1	Very low	44.7	Very low	72 Å²	72	121.4 Å²	121.4	74%	0.742	75%	0.751	S	S	*	*			trans	-4.9	102.8	169.9	0	0	0	0	0	118.1	G561 S565	G561-G563 PolarHBondContact O-N 3.19Å; G563-S565 PolarHBondContact O-N 3.3Å
564	R	38.5	Very low	43.2	Very low	251 Å²	251	124.2 Å²	124.2	95%	0.947	77%	0.766	S	S	*	*			trans	-67.8	82	148.8	-92.8	-179.5	170	172.2	-2.3	108.4	G562 R566	G562-R564 PolarHBondContact O-N 2.83Å; R564-R566 PolarHBondContact O-N 2.79Å
565	S	43.6	Very low	42.2	Very low	101 Å²	101	124.3 Å²	124.3	71%	0.706	77%	0.771	S	S	*	*			trans	-65.6	115.4	164.8	-161.4	0	0	0	0	108	G563 Y567	G563-S565 PolarHBondContact O-N 3.3Å; S565-Y567 PolarHBondContact O-N 3.1Å; S565-Y567 VanDerWaalsContact O-N 3.11Å
566	R	38.4	Very low	41.4	Very low	234 Å²	234	123.4 Å²	123.4	88%	0.883	78%	0.783	S	S	*	*			trans	-60.6	106.7	171.4	-66.2	173.5	-167.2	159.6	3.3	108.1	R564	R564-R566 PolarHBondContact O-N 2.79Å
567	Y	43.2	Very low	41.2	Very low	221 Å²	221	127.5 Å²	127.5	87%	0.867	79%	0.789	S	S	*	*			trans	-119.9	102	149.7	-89.9	-83.6	0	0	0	110	S565	S565-Y567 PolarHBondContact O-N 3.1Å; S565-Y567 VanDerWaalsContact O-N 3.11Å
568	R	40.1	Very low	41.3	Very low	224 Å²	224	132.9 Å²	132.9	85%	0.845	80%	0.802	S	S	*	*			trans	-59.6	158.6	163.6	-149.3	-178.9	-159.7	178.2	3.3	108.2
569	T	39	Very low	41.2	Very low	117 Å²	117	136.9 Å²	136.9	72%	0.718	80%	0.801	S	S	*	*			trans	83.5	109.2	157.3	128.6	0	0	0	0	118.8
570	T	38.3	Very low	41.4	Very low	122 Å²	122	143.2 Å²	143.2	75%	0.748	80%	0.801	S	S	*	*				104.6	99.5	120.8	-48.9	0	0	0	0	117.6
571	S	39.4	Very low	41.6	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	81%	0.807	S	S	*	*				57.3	110.9	124.8	-150.9	0	0	0	0	118.9
572	S	38.1	Very low	42	Very low	108 Å²	108	151.2 Å²	151.2	76%	0.755	80%	0.802	S	S	*	*			trans	166.8	96.9	130.2	-163.2	0	0	0	0	106.7
573	A	41.7	Very low	42.2	Very low	81 Å²	81	154.9 Å²	154.9	67%	0.669	80%	0.8	S	S	*	*				61	123.2	94.6	0	0	0	0	0	113.5
574	N	46.8	Very low	42.6	Very low	159 Å²	159	157 Å²	157	85%	0.85	80%	0.802	S	S	*	*			trans	94.1	78.5	167.8	-53.9	-21.6	0	0	0	117.7
575	N	45.5	Very low	43.2	Very low	152 Å²	152	152.7 Å²	152.7	81%	0.813	80%	0.798	S	S	*	*			trans	-154.5	105.2	134	-151.6	-12.2	0	0	0	111.4
576	P	42	Very low	43.5	Very low	117 Å²	117	158.4 Å²	158.4	76%	0.76	80%	0.804	S	S	*	*			trans	-96.9	89.1	177	34	-24.8	0	0	0	109.8
577	N	46.4	Very low	43.8	Very low	153 Å²	153	158.4 Å²	158.4	82%	0.818	80%	0.804	S	S	*	*			trans	-158.5	24.9	167	-119.2	-8.7	0	0	0	116.5
578	L	45.3	Very low	44	Very low	173 Å²	173	156.1 Å²	156.1	91%	0.906	81%	0.806	S	S	*	*			trans	-123.9	78.7	172.8	-89.3	142.8	0	0	0	108.6
579	M	40.2	Very low	44.1	Very low	168 Å²	168	157 Å²	157	83%	0.828	81%	0.809	S	S	*	*			trans	-128.9	34.6	-175	-154.2	-165.7	116.5	0	0	113.2
580	Y	45.9	Very low	43.9	Very low	212 Å²	212	155 Å²	155	83%	0.831	81%	0.812	S	S	*	*	S	Bend	trans	-141.4	17	177.6	-131.1	-93	0	0	0	116.3
581	Q	45.4	Very low	44.1	Very low	177 Å²	177	156 Å²	156	83%	0.827	82%	0.817	S	S	*	*	S	Bend	trans	-134.1	1.1	-179.9	-122.4	172.9	10.1	0	0	116.5
582	D	45.1	Very low	44.2	Very low	146 Å²	146	158.7 Å²	158.7	78%	0.781	82%	0.815	S	S	*	*	S	Bend	trans	-100.7	6.1	179.4	-102.5	-43.9	0	0	0	114.4
583	E	45.8	Very low	44.4	Very low	149 Å²	149	160.7 Å²	160.7	70%	0.696	82%	0.817	S	S	*	*	S	Bend	trans	-90.7	-1.3	-174.8	-85.9	-170	130.1	0	0	115.9
584	C	46.9	Very low	44.3	Very low	117 Å²	117	160.2 Å²	160.2	79%	0.791	82%	0.82	S	S	*	*	S	Bend	trans	-94	-21.2	179.9	-59.3	0	0	0	0	114
585	D	49.9	Very low	43.9	Very low	160 Å²	160	156.1 Å²	156.1	86%	0.856	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.6	14.2	-169.5	-96.3	-25.5	0	0	0	115.9
586	R	49.7	Very low	43.6	Very low	221 Å²	221	159.5 Å²	159.5	83%	0.834	82%	0.817	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	1.1	176.3	-80.1	-170.1	-165	179.8	7.7	116.6	L588	R586-L588 VanDerWaalsContact C-N 3.34Å; R586-L588 PolarHBondContact O-N 3.34Å
587	R	44.7	Very low	43.4	Very low	234 Å²	234	163.3 Å²	163.3	88%	0.883	82%	0.816	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	16.3	-173.9	-74.5	-172.9	177.6	166.3	2.5	116.6
588	L	48.3	Very low	43	Very low	173 Å²	173	162.5 Å²	162.5	91%	0.906	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	13.4	177.4	-90.3	156.4	0	0	0	115.7	R586	R586-L588 VanDerWaalsContact C-N 3.34Å; R586-L588 PolarHBondContact O-N 3.34Å
589	R	41.8	Very low	42.8	Very low	241 Å²	241	159.7 Å²	159.7	91%	0.909	81%	0.806	S	S	*	*	S	Bend	trans	-143.3	113.4	171	-87.2	-171.3	176	-164.4	-1	113.6
590	G	35.8	Very low	42.8	Very low	75 Å²	75	155.9 Å²	155.9	77%	0.773	80%	0.802	S	S	*	*			trans	98.1	94	140.3	0	0	0	0	0	117.2
591	V	42.7	Very low	42.5	Very low	143 Å²	143	150.7 Å²	150.7	87%	0.867	80%	0.797	S	S	*	*			trans	-127.8	101.4	144.1	-177.9	0	0	0	0	104.3
592	K	39.8	Very low	42.4	Very low	173 Å²	173	151.3 Å²	151.3	75%	0.752	79%	0.793	S	S	*	*				89.2	130.4	64.1	-162.4	-173.8	-174.8	-173.6	0	110.9
593	D	43.1	Very low	42.3	Very low	150 Å²	150	154.2 Å²	154.2	80%	0.802	79%	0.793	S	S	*	*			trans	68.7	135.7	170.2	-67.3	-37.3	0	0	0	116.7
594	G	38.8	Very low	42.3	Very low	72 Å²	72	153 Å²	153	74%	0.742	79%	0.791	S	S	*	*			cis	159.6	148.3	7.2	0	0	0	0	0	108.3
595	G	38.5	Very low	42	Very low	73 Å²	73	157.1 Å²	157.1	75%	0.753	79%	0.79	S	S	*	*			trans	87.5	110.5	166.6	0	0	0	0	0	115.8
596	R	39.5	Very low	41.7	Very low	222 Å²	222	153.6 Å²	153.6	84%	0.838	78%	0.778	S	S	*	*				80.8	116.8	80	-86.1	-167.3	-175.2	-177.1	4.2	115.4
597	R	38.7	Very low	41.5	Very low	197 Å²	197	150.2 Å²	150.2	74%	0.743	77%	0.771	S	S	*	*			trans	72	116.4	137.8	-70.8	-170.9	177.9	169.5	-2.6	121.3
598	D	38	Very low	41.6	Very low	137 Å²	137	144 Å²	144	73%	0.733	76%	0.76	S	S	*	*				56	136	118.1	-52.4	-34.3	0	0	0	122.7
599	S	40.5	Very low	41.3	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	75%	0.749	S	S	*	*			trans	88.2	111.3	143.5	-66.8	0	0	0	0	120.3
600	A	39.6	Very low	41.2	Very low	89 Å²	89	140.9 Å²	140.9	74%	0.736	75%	0.745	S	S	*	*				70.3	136.5	121	0	0	0	0	0	121
601	S	40.5	Very low	41.4	Very low	103 Å²	103	142.2 Å²	142.2	72%	0.72	75%	0.749	S	S	*	*			trans	95.3	113.5	139.3	71.2	0	0	0	0	120
602	Y	43	Very low	41.3	Very low	190 Å²	190	138.7 Å²	138.7	75%	0.745	74%	0.742	S	S	*	*				95.2	123.4	125.8	-93.3	-111.7	0	0	0	121.6
603	R	43.3	Very low	41.3	Very low	207 Å²	207	141.5 Å²	141.5	78%	0.781	75%	0.75	S	S	*	*			trans	83.3	113.2	145.9	-75.8	170.5	-179.5	142.1	3.2	117.9
604	D	45	Very low	41.1	Very low	124 Å²	124	138.8 Å²	138.8	66%	0.663	75%	0.748	S	S	*	*				107.6	126.3	71	-164.2	47.5	0	0	0	105.3
605	R	40.6	Very low	41.1	Very low	203 Å²	203	143.6 Å²	143.6	77%	0.766	76%	0.757	S	S	*	*			cis	-156.9	132.7	30.8	-112.1	142.4	-169.8	-161.8	-0.8	104.8
606	S	44.6	Very low	41.1	Very low	85 Å²	85	143.5 Å²	143.5	59%	0.594	76%	0.756	S	S	*	*				57.4	137.6	69.2	105	0	0	0	0	112.2
607	E	44.6	Very low	41	Very low	150 Å²	150	139 Å²	139	70%	0.701	76%	0.759	S	S	*	*			cis	-176	132.6	22.6	-132.7	161.2	126.7	0	0	105.6
608	T	46.3	Very low	41	Very low	105 Å²	105	133.2 Å²	133.2	64%	0.644	76%	0.76	S	S	*	*				77.7	152	105.4	59.9	0	0	0	0	115.8
609	D	42.8	Very low	41.1	Very low	127 Å²	127	138.2 Å²	138.2	68%	0.679	77%	0.77	S	S	*	*			cis	-168.5	166.3	18.5	-126.4	-25.7	0	0	0	111.8
610	R	39.3	Very low	40.9	Very low	220 Å²	220	136.8 Å²	136.8	83%	0.83	77%	0.774	S	S	*	*			trans	75.2	99.9	144.2	-88.5	178.2	162.1	146.7	-3.3	123.1
611	A	40.5	Very low	41	Very low	103 Å²	103	138 Å²	138	85%	0.851	78%	0.777	S	S	*	*				23.6	130.6	112.8	0	0	0	0	0	121
612	G	39.7	Very low	41.5	Very low	70 Å²	70	138.3 Å²	138.3	72%	0.722	78%	0.776	S	S	*	*			trans	171.3	100.6	160.4	0	0	0	0	0	115.3
613	Y	40.4	Very low	41.4	Very low	231 Å²	231	137.3 Å²	137.3	91%	0.906	78%	0.784	S	S	*	*			trans	7.1	133.7	153.3	-57.9	-87.6	0	0	0	122.6
614	A	39.5	Very low	41.2	Very low	93 Å²	93	132.9 Å²	132.9	77%	0.769	78%	0.784	S	S	*	*			trans	69.7	118.4	130.1	0	0	0	0	0	122.2
615	N	38.8	Very low	41.1	Very low	174 Å²	174	132.2 Å²	132.2	93%	0.93	80%	0.796	S	S	*	*			trans	80.9	131.4	135.5	-138.6	3.4	0	0	0	119.4
616	G	38.3	Very low	40.8	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	81%	0.806	S	S	*	*			trans	131.6	103.4	161.6	0	0	0	0	0	115.7
617	S	37.8	Very low	40.6	Very low	128 Å²	128	132.4 Å²	132.4	90%	0.895	81%	0.812	S	S	*	*			trans	-57.3	149.3	174.2	-42.5	0	0	0	0	114.9
618	G	38.2	Very low	40.4	Very low	75 Å²	75	129.8 Å²	129.8	77%	0.773	82%	0.816	S	S	*	*			trans	173.6	102.4	168	0	0	0	0	0	115.2
619	Y	38.9	Very low	40	Very low	241 Å²	241	133.8 Å²	133.8	95%	0.945	83%	0.827	S	S	*	*			trans	-36.4	146	175.6	-61	-96	0	0	0	119.3
620	G	37.4	Very low	39.8	Very low	84 Å²	84	132.4 Å²	132.4	87%	0.866	83%	0.834	S	S	*	*			trans	177	115	159.8	0	0	0	0	0	113.7
621	S	40.9	Very low	39.6	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	83%	0.832	S	S	*	*			trans	-110.3	-167.8	179.2	-164.5	0	0	0	0	109.2
622	P	52.4	Low	39.6	Very low	108 Å²	108	128 Å²	128	70%	0.701	83%	0.825	S	S	*	*				-122.3	178.9	-74.9	35.4	-19.5	0	0	0	112.6
623	N	40.6	Very low	39.4	Very low	170 Å²	170	133.8 Å²	133.8	91%	0.909	83%	0.827	S	S	*	*			trans	-161.4	148.2	147.8	-119.5	-1.2	0	0	0	114
624	S	38.2	Very low	39.2	Very low	113 Å²	113	129 Å²	129	79%	0.79	82%	0.822	S	S	*	*			trans	-127.2	153.7	-164.1	43.9	0	0	0	0	112.5
625	A	42.6	Very low	39	Very low	110 Å²	110	135.7 Å²	135.7	91%	0.909	83%	0.829	S	S	*	*			trans	-160.9	156.1	163.7	0	0	0	0	0	112.1
626	F	35.3	Very low	38.8	Very low	224 Å²	224	131 Å²	131	98%	0.982	82%	0.821	S	S	*	*			trans	-133.1	157.1	-148	-142.7	-90.4	0	0	0	112.8
627	G	40.8	Very low	38.7	Very low	69 Å²	69	136.9 Å²	136.9	71%	0.711	83%	0.83	S	S	*	*			trans	113.9	162.1	154.5	0	0	0	0	0	117
628	A	39.1	Very low	38.6	Very low	95 Å²	95	133.7 Å²	133.7	79%	0.785	82%	0.817	S	S	*	*			cis	-171.9	151.7	-35.9	0	0	0	0	0	107.9
629	Q	38.8	Very low	38.4	Very low	189 Å²	189	136.3 Å²	136.3	88%	0.883	82%	0.819	S	S	*	*			trans	97.9	117.2	138.9	-151.1	156.5	-0	0	0	124.3
630	A	38.3	Very low	38.3	Very low	98 Å²	98	135.4 Å²	135.4	81%	0.81	82%	0.815	S	S	*	*			trans	90.4	126.9	131.1	0	0	0	0	0	126.9
631	G	36.3	Very low	38.4	Very low	77 Å²	77	134.9 Å²	134.9	79%	0.794	81%	0.809	S	S	*	*			trans	87.2	142.4	144.3	0	0	0	0	0	118.2
632	Q	38.5	Very low	38.1	Very low	152 Å²	152	134.6 Å²	134.6	71%	0.71	81%	0.814	S	S	*	*			cis	-172.6	147	4.3	-119.5	177.2	-12.7	0	0	109.4
633	Y	36.4	Very low	37.3	Very low	192 Å²	192	133.9 Å²	133.9	75%	0.753	82%	0.817	S	S	*	*			trans	53.6	117.6	154.7	-47.5	-59.3	0	0	0	125.1
634	T	36	Very low	36.8	Very low	132 Å²	132	130.1 Å²	130.1	81%	0.81	81%	0.809	S	S	*	*				158.5	134.6	102.6	-64.8	0	0	0	0	113.6
635	Y	34.6	Very low	36.7	Very low	232 Å²	232	135.6 Å²	135.6	91%	0.91	82%	0.815	S	S	*	*			trans	-15.5	141.5	172.1	-81.9	-100.4	0	0	0	122.8
636	G	35.2	Very low	36.6	Very low	75 Å²	75	133.8 Å²	133.8	77%	0.773	81%	0.806	S	S	*	*			trans	158.6	103.5	147.1	0	0	0	0	0	117.4
637	Q	36.7	Very low	36.5	Very low	195 Å²	195	129.8 Å²	129.8	91%	0.911	80%	0.8	S	S	*	*			trans	67.9	107.8	148.3	-134	-179.5	18.3	0	0	120.6
638	G	35.3	Very low	36.4	Very low	61 Å²	61	130.6 Å²	130.6	63%	0.629	80%	0.795	S	S	*	*			trans	-85.2	134.5	172	0	0	0	0	0	113.5
639	T	34.4	Very low	36	Very low	131 Å²	131	131.4 Å²	131.4	80%	0.804	80%	0.795	S	S	*	*			trans	-121.8	123.8	167.1	-58.4	0	0	0	0	107.5
640	Y	37.6	Very low	36	Very low	222 Å²	222	132.3 Å²	132.3	87%	0.871	79%	0.792	S	S	*	*			trans	-92.4	111.5	178.6	-35.9	-75	0	0	0	109.3
641	G	38	Very low	35.8	Very low	72 Å²	72	134.3 Å²	134.3	74%	0.742	79%	0.794	S	S	*	*			trans	-85.9	155	175.7	0	0	0	0	0	113.2
642	A	34.9	Very low	35.7	Very low	110 Å²	110	135.1 Å²	135.1	91%	0.909	79%	0.794	S	S	*	*			trans	-63.5	141.4	174.3	0	0	0	0	0	112.4
643	A	35	Very low	35.5	Very low	92 Å²	92	136.7 Å²	136.7	76%	0.76	80%	0.801	S	S	*	*			trans	-104.9	117.4	171	0	0	0	0	0	110
644	A	30.5	Very low	35.3	Very low	91 Å²	91	136 Å²	136	75%	0.752	81%	0.805	S	S	*	*			trans	-119.4	114.9	162.6	0	0	0	0	0	107.5
645	Y	37.5	Very low	35.5	Very low	229 Å²	229	140.3 Å²	140.3	90%	0.898	81%	0.808	S	S	*	*			trans	-152.5	136.1	167.3	-62.2	-81.5	0	0	0	105.3
646	G	38.9	Very low	35.5	Very low	71 Å²	71	133 Å²	133	73%	0.732	80%	0.802	S	S	*	*			cis	152.2	128.9	17.4	0	0	0	0	0	104.5
647	T	33.9	Very low	35.4	Very low	140 Å²	140	134.6 Å²	134.6	86%	0.859	81%	0.808	S	S	*	*			trans	-73.4	150	-177.2	68.8	0	0	0	0	110
648	S	37.9	Very low	35.5	Very low	87 Å²	87	128.9 Å²	128.9	61%	0.608	80%	0.802	S	S	*	*			trans	-150.1	117.1	165.7	-76.9	0	0	0	0	110.8	Y650	S648-Y650 VanDerWaalsContact CB-OH 3.26Å; S648-Y650 WeakPolarHBondContact CB-OH 3.45Å; S648-Y650 PolarHBondContact OG-OH 2.78Å
649	S	32.2	Very low	35.3	Very low	112 Å²	112	131 Å²	131	78%	0.783	80%	0.802	S	S	*	*			trans	-91.1	134.7	172	39.7	0	0	0	0	110
650	Y	38.9	Very low	35.4	Very low	208 Å²	208	135 Å²	135	82%	0.816	80%	0.804	S	S	*	*			trans	-142	122.7	165.6	-44	-75.7	0	0	0	110.3	S648	S648-Y650 VanDerWaalsContact CB-OH 3.26Å; S648-Y650 WeakPolarHBondContact CB-OH 3.45Å; S648-Y650 PolarHBondContact OG-OH 2.78Å
651	T	34.2	Very low	35.3	Very low	140 Å²	140	128.2 Å²	128.2	86%	0.859	80%	0.803	S	S	*	*			trans	-99.5	137.1	173.7	40.5	0	0	0	0	111.2
652	A	32.8	Very low	35	Very low	94 Å²	94	130 Å²	130	78%	0.777	81%	0.81	S	S	*	*			trans	53.1	118.5	144.2	0	0	0	0	0	120.9
653	Q	35.5	Very low	35.2	Very low	185 Å²	185	130.2 Å²	130.2	86%	0.864	81%	0.805	S	S	*	*				-164.4	141.3	121.8	-111.6	167.5	-16.7	0	0	112
654	E	32.2	Very low	35.3	Very low	178 Å²	178	131 Å²	131	83%	0.832	81%	0.805	S	S	*	*			trans	-109.4	132.6	-169.4	-179.1	179.4	-149.7	0	0	108.4
655	Y	38.6	Very low	35.6	Very low	222 Å²	222	133.7 Å²	133.7	87%	0.871	81%	0.812	S	S	*	*			trans	-154.7	120.8	164	-87.2	-74.3	0	0	0	111.8
656	G	35.7	Very low	35.5	Very low	77 Å²	77	129 Å²	129	79%	0.794	81%	0.807	S	S	*	*				81	111.1	115.7	0	0	0	0	0	119.6
657	A	32.6	Very low	35.6	Very low	109 Å²	109	131.3 Å²	131.3	90%	0.901	81%	0.812	S	S	*	*			trans	-65.4	156.3	174	0	0	0	0	0	115.5
658	G	38.4	Very low	35.7	Very low	75 Å²	75	131.4 Å²	131.4	77%	0.773	81%	0.813	S	S	*	*			trans	-161.3	118.3	166.8	0	0	0	0	0	110.6
659	T	31.7	Very low	35.7	Very low	105 Å²	105	130.8 Å²	130.8	64%	0.644	82%	0.821	S	S	*	*			trans	-94.1	-178.1	-170.2	-52	0	0	0	0	110.8
660	Y	36.3	Very low	36	Very low	215 Å²	215	137.2 Å²	137.2	84%	0.843	83%	0.828	S	S	*	*			trans	73.7	124.1	159.9	22.5	-96.7	0	0	0	121.2
661	G	35	Very low	35.8	Very low	81 Å²	81	132.9 Å²	132.9	84%	0.835	83%	0.828	S	S	*	*			trans	158	86	157.9	0	0	0	0	0	114.7
662	A	33.5	Very low	36	Very low	108 Å²	108	132 Å²	132	89%	0.893	83%	0.827	S	S	*	*			trans	-75	148.3	174.3	0	0	0	0	0	112.6
663	S	38.2	Very low	36.4	Very low	116 Å²	116	136.9 Å²	136.9	81%	0.811	83%	0.834	S	S	*	*			trans	-152	109.6	155.2	53.4	0	0	0	0	110.7
664	S	36.1	Very low	36.6	Very low	108 Å²	108	133.1 Å²	133.1	76%	0.755	83%	0.828	S	S	*	*			trans	-71.7	140.4	167.9	49.2	0	0	0	0	111.7
665	T	37.4	Very low	36.8	Very low	147 Å²	147	129.5 Å²	129.5	90%	0.902	82%	0.822	S	S	*	*			trans	-143	108	152.6	5.6	0	0	0	0	110
666	T	36.1	Very low	36.7	Very low	130 Å²	130	124 Å²	124	80%	0.798	82%	0.817	S	S	*	*			trans	-81.3	131.6	168.7	-13.8	0	0	0	0	108.3
667	S	39.8	Very low	36.9	Very low	120 Å²	120	129.9 Å²	129.9	84%	0.839	82%	0.823	S	S	*	*			trans	-125.4	104.7	161.2	62.8	0	0	0	0	109.3
668	T	37.3	Very low	37	Very low	142 Å²	142	133.6 Å²	133.6	87%	0.871	82%	0.822	S	S	*	*			trans	-68.4	138	167.3	26.6	0	0	0	0	110.8
669	G	38.3	Very low	36.8	Very low	75 Å²	75	139.7 Å²	139.7	77%	0.773	83%	0.828	S	S	*	*			trans	-163.8	73.2	-179.8	0	0	0	0	0	113.5
670	R	36.6	Very low	37	Very low	246 Å²	246	138.9 Å²	138.9	93%	0.928	83%	0.826	S	S	*	*			trans	30.2	119.1	153.3	-75	178.8	170.9	176.8	-3.4	120.9
671	S	35.9	Very low	37.1	Very low	118 Å²	118	131.9 Å²	131.9	83%	0.825	82%	0.82	S	S	*	*			trans	-63.7	141.5	150.7	49.4	0	0	0	0	113.7
672	S	39.2	Very low	37.2	Very low	121 Å²	121	136.2 Å²	136.2	85%	0.846	82%	0.822	S	S	*	*			trans	-148.9	111.8	151.7	53.1	0	0	0	0	110
673	Q	40.2	Very low	37.3	Very low	197 Å²	197	134.3 Å²	134.3	92%	0.921	81%	0.813	S	S	*	*			trans	-69.7	140.3	160.5	-73.2	168.2	-27.7	0	0	109.3
674	S	38.7	Very low	37.3	Very low	106 Å²	106	141 Å²	141	74%	0.741	82%	0.821	S	S	*	*			trans	-175.3	123.5	134.3	67.1	0	0	0	0	112.2
675	S	37.1	Very low	37.2	Very low	101 Å²	101	142 Å²	142	71%	0.706	83%	0.827	S	S	*	*			trans	48	117.8	134.8	62	0	0	0	0	121.6
676	S	36.1	Very low	37.3	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	82%	0.82	S	S	*	*			trans	-20.3	135.4	139.2	52.9	0	0	0	0	117.1
677	Q	39.9	Very low	37.4	Very low	199 Å²	199	140.4 Å²	140.4	93%	0.93	82%	0.82	S	S	*	*			trans	-167.5	137.1	137.2	-106.9	171.1	49	0	0	111.9
678	Q	34.6	Very low	37.5	Very low	188 Å²	188	142.5 Å²	142.5	88%	0.879	82%	0.817	S	S	*	*			trans	-84.4	137.9	170.4	-66.3	164.4	-42.1	0	0	110.1
679	F	35.1	Very low	37.5	Very low	202 Å²	202	141.1 Å²	141.1	89%	0.886	81%	0.81	S	S	*	*			trans	180	112.1	149.7	-135.8	-123.9	0	0	0	107.4
680	S	35.4	Very low	37.3	Very low	88 Å²	88	146 Å²	146	62%	0.615	81%	0.813	S	S	*	*				98.2	147.6	76	80.2	0	0	0	0	113.2
681	G	37.7	Very low	37.9	Very low	69 Å²	69	139.7 Å²	139.7	71%	0.711	80%	0.803	S	S	*	*			trans	146.7	71.5	178.8	0	0	0	0	0	111.1
682	I	37.6	Very low	38.1	Very low	172 Å²	172	141.2 Å²	141.2	88%	0.882	80%	0.801	S	S	*	*				64	114.5	88.6	-57.6	174.4	0	0	0	113.7
683	G	36.9	Very low	38.1	Very low	68 Å²	68	143 Å²	143	70%	0.701	80%	0.799	S	S	*	*			trans	125.7	95.1	131.1	0	0	0	0	0	118.3
684	R	36.9	Very low	38	Very low	256 Å²	256	138.4 Å²	138.4	97%	0.966	79%	0.788	S	S	*	*				129.8	106.2	125.3	-77.8	-171.2	168.6	-171.6	-2.4	114.7
685	S	34.9	Very low	38	Very low	128 Å²	128	142 Å²	142	90%	0.895	79%	0.793	S	S	*	*			trans	-95.7	136.7	160.6	43.8	0	0	0	0	110.2
686	G	39	Very low	38	Very low	72 Å²	72	146.3 Å²	146.3	74%	0.742	80%	0.802	S	S	*	*			trans	-163.1	96.5	165.3	0	0	0	0	0	106.8
687	Q	38.3	Very low	38.2	Very low	173 Å²	173	151 Å²	151	81%	0.808	81%	0.809	S	S	*	*				70.8	125.7	92.1	-107.1	-167.5	35.4	0	0	115.6
688	Q	41.1	Very low	38.4	Very low	164 Å²	164	146 Å²	146	77%	0.766	80%	0.801	S	S	*	*			trans	92.6	155.1	149.3	-67.8	-171.6	25.2	0	0	119
689	P	37.2	Very low	38.7	Very low	112 Å²	112	145.7 Å²	145.7	73%	0.727	80%	0.8	S	S	*	*				-133.9	178.6	-84.6	26.4	-0.5	0	0	0	113.5
690	Q	34.9	Very low	39.7	Very low	179 Å²	179	142.2 Å²	142.2	84%	0.836	80%	0.798	S	S	*	*			trans	-60.6	148.9	177.9	-68.1	-82.8	-6.9	0	0	115.4
691	P	49.9	Very low	39.8	Very low	112 Å²	112	144.3 Å²	144.3	73%	0.727	81%	0.809	S	S	*	*			trans	-117.5	117.4	145.4	33.1	-20.8	0	0	0	110.3
692	L	38.5	Very low	39.8	Very low	150 Å²	150	144.7 Å²	144.7	79%	0.785	81%	0.813	S	S	*	*				66.1	108.7	84.2	-154.6	83.8	0	0	0	115.9
693	M	40.2	Very low	40	Very low	160 Å²	160	141.6 Å²	141.6	79%	0.788	81%	0.814	S	S	*	*			trans	67.3	128.3	142.7	-76.7	176.9	149	0	0	123.5
694	S	38	Very low	40.1	Very low	100 Å²	100	144.1 Å²	144.1	70%	0.699	82%	0.815	S	S	*	*			trans	66.1	119.4	135.7	66.6	0	0	0	0	120.1
695	Q	38.5	Very low	40.1	Very low	181 Å²	181	138.6 Å²	138.6	85%	0.846	81%	0.805	S	S	*	*				-174	142.5	98.3	-95.5	-179.8	33.9	0	0	112.1
696	Q	38	Very low	40.3	Very low	192 Å²	192	140 Å²	140	90%	0.897	80%	0.799	S	S	*	*			trans	-92.4	120.2	-175.4	-164.7	171.8	10.4	0	0	107.2	A698	Q696-A698 PolarHBondContact O-N 2.88Å
697	F	40	Very low	40.3	Very low	207 Å²	207	144 Å²	144	91%	0.908	80%	0.802	S	S	*	*			trans	-85.3	109.2	174.8	-90.5	-84.2	0	0	0	110.3
698	A	42.7	Very low	40.2	Very low	92 Å²	92	139 Å²	139	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-81.2	141.6	169.4	0	0	0	0	0	110.9	Q696	Q696-A698 PolarHBondContact O-N 2.88Å
699	Q	42.5	Very low	40.1	Very low	183 Å²	183	141.2 Å²	141.2	86%	0.855	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-73.2	145.6	168.5	-70	-172.7	-12.5	0	0	110.9
700	P	55.5	Low	40.2	Very low	128 Å²	128	144.6 Å²	144.6	83%	0.831	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-84.6	137.8	177	32.2	-30.7	0	0	0	111.9
701	P	36.9	Very low	40.4	Very low	132 Å²	132	139.3 Å²	139.3	86%	0.857	80%	0.802	S	S	*	*			trans	-104.3	143.5	160.2	35.1	-25	0	0	0	111.1
702	G	39	Very low	40	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	81%	0.81	S	S	*	*			trans	127.4	106.8	155.4	0	0	0	0	0	116.4
703	A	41.5	Very low	40	Very low	108 Å²	108	142.1 Å²	142.1	89%	0.893	81%	0.81	S	S	*	*			trans	-149.2	115.5	140.3	0	0	0	0	0	108.3
704	T	37.6	Very low	39.8	Very low	121 Å²	121	139.1 Å²	139.1	74%	0.742	81%	0.811	S	S	*	*			trans	-117.5	145.2	-175	-54.9	0	0	0	0	109.1
705	N	37.7	Very low	40	Very low	139 Å²	139	144.9 Å²	144.9	74%	0.743	82%	0.819	S	S	*	*			trans	84	117.6	163.2	-65.1	-19.4	0	0	0	120.1
706	M	38.2	Very low	40	Very low	158 Å²	158	145.3 Å²	145.3	78%	0.778	82%	0.821	S	S	*	*				174.7	112.4	94.1	-83	-72	-104.8	0	0	112.2
707	I	39.3	Very low	40.9	Very low	155 Å²	155	146.4 Å²	146.4	80%	0.795	82%	0.818	S	S	*	*			trans	47.2	127	134.4	-56.4	170.7	0	0	0	121.3
708	G	37.2	Very low	41.9	Very low	68 Å²	68	141.8 Å²	141.8	70%	0.701	81%	0.809	S	S	*	*			trans	155	69.7	147.2	0	0	0	0	0	121
709	Y	39	Very low	42.7	Very low	211 Å²	211	143 Å²	143	83%	0.827	81%	0.809	S	S	*	*			trans	40.2	125.8	144.2	-88.7	-95.6	0	0	0	125.4
710	M	39.3	Very low	43.8	Very low	183 Å²	183	140 Å²	140	90%	0.901	81%	0.805	S	S	*	*			trans	98.7	117.6	130.5	-106.3	170.3	177.2	0	0	123.1
711	G	38.4	Very low	44.5	Very low	69 Å²	69	139.4 Å²	139.4	71%	0.711	80%	0.802	S	S	*	*			trans	126	85.9	150.8	0	0	0	0	0	116.1
712	Q	41	Very low	46.3	Very low	193 Å²	193	138.8 Å²	138.8	90%	0.902	80%	0.798	S	S	*	*				60.7	125.8	106.6	-75.4	-172.1	7.3	0	0	114.8
713	T	39.2	Very low	47.9	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	80%	0.797	S	S	*	*			cis	-154.4	143.7	24	35.5	0	0	0	0	110.2
714	A	36.2	Very low	49.3	Very low	97 Å²	97	141.2 Å²	141.2	80%	0.802	79%	0.79	S	S	*	*			trans	-120.1	126.2	174.7	0	0	0	0	0	110.5
715	Y	42	Very low	50.9	Low	222 Å²	222	141.1 Å²	141.1	87%	0.871	79%	0.791	S	S	*	*			trans	-87.4	116.6	165.2	-80.6	-84.5	0	0	0	108.9
716	Q	38.9	Very low	52.4	Low	189 Å²	189	140.7 Å²	140.7	88%	0.883	80%	0.796	S	S	*	*			trans	-107.5	111	-179.5	-151.2	165.9	12.5	0	0	108.1
717	Y	55.8	Low	53.5	Low	216 Å²	216	138.8 Å²	138.8	85%	0.847	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75	142	174.2	-81.4	-90.8	0	0	0	110.6
718	P	61.1	Low	53.7	Low	109 Å²	109	143.3 Å²	143.3	71%	0.708	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-73.9	153.1	177.8	30.6	-33.1	0	0	0	111.7
719	P	59.5	Low	54	Low	119 Å²	119	153.6 Å²	153.6	77%	0.773	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-71.7	149.7	178.2	30.2	-33.8	0	0	0	111.7
720	P	66.8	Low	54.8	Low	119 Å²	119	150.7 Å²	150.7	77%	0.773	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-71.4	153.1	178.9	29.3	-33.7	0	0	0	112.3
721	P	70.4	Confident	55.6	Low	116 Å²	116	149 Å²	149	75%	0.753	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-73.9	156.7	-178.1	30.4	-34.3	0	0	0	112.8
722	P	73.5	Confident	56.6	Low	119 Å²	119	153.4 Å²	153.4	77%	0.773	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-71.8	149.8	-179.5	29.5	-34.1	0	0	0	112.5
723	P	74.2	Confident	57.5	Low	120 Å²	120	151.1 Å²	151.1	78%	0.779	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-71.2	151	-179.7	28.6	-33.8	0	0	0	112.6
724	P	69.9	Low	58.6	Low	116 Å²	116	152.6 Å²	152.6	75%	0.753	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71.4	153.9	-178.9	29.5	-33.9	0	0	0	112.4
725	P	71.6	Confident	60.1	Low	118 Å²	118	156.3 Å²	156.3	77%	0.766	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-69.2	146.3	-178.1	28.4	-33.8	0	0	0	111.9	S727	P725-S727 PolarHBondContact O-N 3.08Å
726	P	68.8	Low	61.4	Low	130 Å²	130	151.6 Å²	151.6	84%	0.844	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-69.7	126.2	-178.3	27	-32.2	0	0	0	111.3	R728	P726-R728 PolarHBondContact O-N 3.32Å
727	S	62	Low	63.1	Low	119 Å²	119	148.8 Å²	148.8	83%	0.832	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-66.7	119.6	173.5	47.9	0	0	0	0	111	P725 K729	P725-S727 PolarHBondContact O-N 3.08Å; S727-K729 PolarHBondContact O-N 3.19Å
728	R	43.7	Very low	63.7	Low	250 Å²	250	143.2 Å²	143.2	94%	0.943	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-64.5	116.9	165.8	-86.4	179.2	170.7	-178.3	-3	110	P726	P726-R728 PolarHBondContact O-N 3.32Å
729	K	43.6	Very low	64	Low	283 Å²	283	146.3 Å²	146.3	100%	1.23	84%	0.838	S	S	*	*			trans	-163.6	0	138	-106.2	178.7	-173	-175.9	0	110	S727	S727-K729 PolarHBondContact O-N 3.19Å

Retrieved 729 of 729 residues in 173.9 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).