A0A096NUH6_PAPAN Loading...

Ubiquitin carboxyl-terminal hydrolase

Catalyzes the deubiquitination of SPDL1. Plays a role in the repair of UV-induced DNA damage via deubiquitination of ERCC1, promoting its recruitment to DNA damage sites. May be involved in the maintenance of photoreceptor function. May play a role in normal retinal development. Plays a role in cell migration. Deubiquitinating enzyme that removes conjugated ubiquitin from specific proteins to regulate different cellular processes.

AlphaFold DB , UniProt , Accession A0A096NUH6, Species PAPAN (Papio anubis, Olive baboon), Gene USP45, Length 815 aa.

						>A0A096NUH6_PAPAN|A0A096NUH6|USP45
MRVKDPSKALPEKAKRSKRPTVPHEEDSSDDIAVGLTCQHVSHAISVNHVKRAIAENLWSVCSECLKERRFYDGQPVLPSDIWLCLKCGFQGCGKNSESQHSLKHFKNSRIEPHCIIINLSTWIIWCYECDEKLSTHCNKKVLAQIVDFLQKHASKTQTSAFSRIMKLCEEKCETDEIKKGGKGRSLSSVRGITNLGNTCFFNAVMQNLAQTYTLTDLMNEIKESSTKLKIFPSSDSQLDPLVVELSRPGPLTSALFLFLHSMKETEKGPLSPSVLFNQLCQKAPRFKDFQQQDSQELLHYLLDAVRTEETKRIQASILKAFNNPTTKTADDETRKKVKAYGKEGVKMNFIDRIFIGELTSTVMCEECANISTVKDPFIDISLPIIEERVSKPLLLGKMNKYRSLRETDHDRYNGNVTVENIHQPRAAKKHSSSKDKSQLIHDRKCIRKLSGETVVTYQKKENLEMNGDSLMFARLMNSESPLNESPTDDSEKEASHSESNVDADSEASESESASKQTELFRSSSGSGVHTDGPLYPPSAGELVYTKETDSGDKQMAEAISELHLRSTVTGHQDFDRENQPLSISNNLCFLEGKHLRPHSPQNAFQTLSQTYITTSKECSVQSCLYQFTSMELLMGNNKLLCENCTKNKQKYQEETSFAEKKVEGVYTNARKQLLISAVPAVLILHLKRFHQAGLSLRKVNRHVDFPLMLDLAPFCSATCKNASMGDKVLYGLYGIVEHSGSMREGHYTAYVKVRTPSRKLSEHPTKKKSVPGLKEADSESAGQWVHVSDTYVQVVPESRALSAQAYLLFYERVL
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	27.9	Very low	32.8	Very low	228 Å²	228	156.5 Å²	156.5	100%	1.123	83%	0.826	S	S	*	*				0	139.9	0	-65.3	91.2	88	0	0	108
2	R	31.8	Very low	32.2	Very low	241 Å²	241	157.7 Å²	157.7	91%	0.909	82%	0.824	S	S	*	*				58	126.6	69.5	-92.1	-177	-177	168	1.9	110.9
3	V	30.6	Very low	32	Very low	125 Å²	125	162.3 Å²	162.3	76%	0.758	83%	0.833	S	S	*	*			cis	-147.2	146.9	27.6	177.8	0	0	0	0	114.9
4	K	29.9	Very low	31.6	Very low	192 Å²	192	157.3 Å²	157.3	84%	0.835	83%	0.828	S	S	*	*			trans	-1.6	154.5	159	-54.9	175.8	174.2	-176.5	0	125.7
5	D	32.7	Very low	31.5	Very low	149 Å²	149	160.7 Å²	160.7	80%	0.797	83%	0.833	S	S	*	*			trans	-64.2	-166	154.6	-42	-96.3	0	0	0	114.1
6	P	50.6	Low	31.2	Very low	111 Å²	111	165.1 Å²	165.1	72%	0.721	84%	0.836	S	S	*	*			cis	-150.9	-179.6	8.6	45.1	-23.9	0	0	0	121.2
7	S	30.5	Very low	30.9	Very low	99 Å²	99	160.9 Å²	160.9	69%	0.692	83%	0.825	S	S	*	*			trans	82.6	128.4	139.9	75.8	0	0	0	0	123.1
8	K	31.1	Very low	30.8	Very low	207 Å²	207	162.8 Å²	162.8	90%	0.9	83%	0.827	S	S	*	*				178.5	172.1	107.3	-95.3	176.9	-177.3	179.1	0	111.6
9	A	28.7	Very low	30.5	Very low	88 Å²	88	166.8 Å²	166.8	73%	0.727	83%	0.831	S	S	*	*			trans	-142.8	147.4	-172.5	0	0	0	0	0	114.2
10	L	28.5	Very low	31	Very low	158 Å²	158	163.9 Å²	163.9	83%	0.827	82%	0.824	S	S	*	*			trans	59.7	158.9	155.3	-76.5	171.7	0	0	0	118
11	P	38.1	Very low	30.7	Very low	123 Å²	123	161.6 Å²	161.6	80%	0.799	82%	0.819	S	S	*	*			cis	-137	-177.9	29.4	43.4	-25	0	0	0	117.8
12	E	26.6	Very low	30.7	Very low	171 Å²	171	157 Å²	157	80%	0.799	80%	0.803	S	S	*	*			trans	-75.7	158.6	172.9	-50.8	172	104.9	0	0	114
13	K	29.6	Very low	31.1	Very low	218 Å²	218	150.8 Å²	150.8	95%	0.948	79%	0.794	S	S	*	*			trans	-163.4	162.6	133.3	-107.5	155.4	-171.4	172.8	0	111.2
14	A	26.6	Very low	30.9	Very low	92 Å²	92	153.3 Å²	153.3	76%	0.76	80%	0.797	S	S	*	*			trans	-133	175.3	-156.4	0	0	0	0	0	115.4
15	K	29.1	Very low	31.1	Very low	208 Å²	208	152.1 Å²	152.1	90%	0.904	80%	0.795	S	S	*	*			trans	104.9	156.3	170.3	-61.5	167.1	-179.2	178.5	0	115.1
16	R	27	Very low	31	Very low	231 Å²	231	154.4 Å²	154.4	87%	0.872	80%	0.801	S	S	*	*			cis	-172.1	138.2	-41.5	-157.7	178.3	-173.1	179.3	1.9	108
17	S	26.8	Very low	30.1	Very low	94 Å²	94	157.3 Å²	157.3	66%	0.657	81%	0.81	S	S	*	*			trans	67.3	123	151.8	49.3	0	0	0	0	124.3
18	K	27.8	Very low	30.3	Very low	196 Å²	196	158.4 Å²	158.4	85%	0.852	82%	0.818	S	S	*	*			trans	86.8	110.3	133.4	-70.2	171.9	178.2	-174.7	0	122.6
19	R	25	Very low	30.6	Very low	239 Å²	239	153 Å²	153	90%	0.902	81%	0.806	S	S	*	*				39.1	157	118.5	-87	-167.2	175.3	-174.7	-1.3	121.6
20	P	40.5	Very low	30.7	Very low	107 Å²	107	155.8 Å²	155.8	70%	0.695	81%	0.809	S	S	*	*			cis	-142.6	-164	-18.2	35	-11.2	0	0	0	115.4
21	T	24.5	Very low	31.1	Very low	117 Å²	117	155.6 Å²	155.6	72%	0.718	81%	0.809	S	S	*	*			trans	105	89.8	149.4	-44.9	0	0	0	0	120.5
22	V	28.8	Very low	31	Very low	130 Å²	130	156.6 Å²	156.6	79%	0.788	81%	0.806	S	S	*	*				35.7	143.5	110.7	-174.5	0	0	0	0	119.7
23	P	39.6	Very low	31.4	Very low	112 Å²	112	152.5 Å²	152.5	73%	0.727	80%	0.801	S	S	*	*			cis	-130.9	174.5	-18.5	38.5	-22.4	0	0	0	115.3
24	H	27.9	Very low	31.9	Very low	177 Å²	177	148.6 Å²	148.6	82%	0.819	80%	0.795	S	S	*	*				-157.6	159.2	126.4	-151.1	-85.5	0	0	0	110.8
25	E	32.9	Very low	32.7	Very low	167 Å²	167	146.8 Å²	146.8	78%	0.78	79%	0.785	S	S	*	*			trans	-96.5	157.7	-179.2	-58.6	168.4	158.4	0	0	111.9
26	E	31.6	Very low	33.7	Very low	198 Å²	198	143 Å²	143	93%	0.925	77%	0.774	S	S	*	*				-157.3	156.9	126.5	-77.5	-141.4	143.9	0	0	109.3
27	D	30.4	Very low	35.6	Very low	171 Å²	171	135.6 Å²	135.6	91%	0.914	76%	0.755	S	S	*	*			trans	-86.8	152.7	-162.7	-89.5	-52.4	0	0	0	116.9
28	S	36.2	Very low	38	Very low	122 Å²	122	131.6 Å²	131.6	85%	0.853	73%	0.727	S	S	*	*			trans	-157.1	120.4	142	-173.2	0	0	0	0	110.7
29	S	37.3	Very low	40.5	Very low	95 Å²	95	130.1 Å²	130.1	66%	0.664	72%	0.723	S	S	*	*			trans	-66.6	140.7	178.4	165	0	0	0	0	112.9
30	D	30.4	Very low	43.4	Very low	146 Å²	146	121.6 Å²	121.6	78%	0.781	69%	0.693	S	S	*	*			trans	-162.2	95.9	130.9	-112.5	-4.3	0	0	0	110.5	I32	D30-I32 PolarHBondContact O-N 2.66Å
31	D	36.5	Very low	45.3	Very low	154 Å²	154	117 Å²	117	82%	0.824	66%	0.663	S	S	*	*			trans	-88	88.6	-173.4	-157.3	-7.8	0	0	0	111.6
32	I	36.6	Very low	47.8	Very low	144 Å²	144	115.2 Å²	115.2	74%	0.738	66%	0.656	S	S	*	*			trans	-110	91.6	176.8	-56.4	-178.2	0	0	0	110.1	D30	D30-I32 PolarHBondContact O-N 2.66Å
33	A	34.1	Very low	50.2	Low	85 Å²	85	115.1 Å²	115.1	70%	0.702	65%	0.646	S	S	*	*			trans	24.1	97.7	158.9	0	0	0	0	0	116.3	G35	A33-G35 PolarHBondContact O-N 2.68Å
34	V	39.4	Very low	52.3	Low	136 Å²	136	109.8 Å²	109.8	82%	0.824	61%	0.612	S	S	*	*			trans	-66.6	78.2	172.1	-174	0	0	0	0	110.7	L36	V34-L36 PolarHBondContact O-N 3.39Å; V34-L36 VanDerWaalsContact O-N 3.15Å
35	G	43.6	Very low	55	Low	53 Å²	53	102.4 Å²	102.4	55%	0.546	58%	0.578	S	S	.	*			trans	-63.2	113.3	175.1	0	0	0	0	0	110.2	A33 T37	A33-G35 PolarHBondContact O-N 2.68Å; G35-T37 PolarHBondContact O-N 3.06Å
36	L	50.8	Low	57.6	Low	128 Å²	128	95.7 Å²	95.7	67%	0.67	55%	0.549	S	S	*	.			trans	-52.4	103.1	-175.8	-69.8	165.9	0	0	0	111.4	V34 C38	V34-L36 PolarHBondContact O-N 3.39Å; V34-L36 VanDerWaalsContact O-N 3.15Å; L36-C38 PolarHBondContact O-N 3.32Å
37	T	66.7	Low	60	Low	77 Å²	77	87.8 Å²	87.8	47%	0.472	51%	0.514	S	S	.	.			trans	-88.9	106.6	174.3	46.8	0	0	0	0	108.6	G35 Q39 C138	G35-T37 PolarHBondContact O-N 3.06Å; T37-Q39 PolarHBondContact O-N 3.13Å; T37-C138 HydrophobicContact CG2-CB 4.38Å; T37-C138 WeakPolarHBondContact CG2-O 3.4Å
38	C	78.1	Confident	62.6	Low	10 Å²	10	85.2 Å²	85.2	7%	0.068	50%	0.501	C	S	.	.			trans	-53	108.1	178.2	167.8	0	0	0	0	110.9	L36 H40 V41 C127 L134	L36-C38 PolarHBondContact O-N 3.32Å; C38-H40 PolarHBondContact O-N 2.81Å; C38-H40 VanDerWaalsContact O-N 3.13Å; C38-V41 HydrophobicContact CB-CG2 4.09Å; C38-V41 WeakPolarHBondContact O-CB 3.22Å; C38-V41 VanDerWaalsContact O-CG2 3.24Å; C38-V41 WeakPolarHBondContact O-CG2 3.18Å; C38-V41 PolarHBondContact O-N 2.8Å; C38-V41 VanDerWaalsContact O-N 3.11Å; C38-C127 VanDerWaalsContact SG-SG 3.66Å; C38-L134 HydrophobicContact CB-CD1 4.18Å; C38-L134 HydrophobicContact CB-CD2 3.4Å; C38-L134 VanDerWaalsContact CB-CD2 3.4Å; C38-L134 HydrophobicContact CB-CG 4.45Å
39	Q	79.8	Confident	64.9	Low	165 Å²	165	83.6 Å²	83.6	77%	0.771	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-61	-27.7	-173.4	-61.6	-176.4	8.1	0	0	112.3	T37 V41 S42	T37-Q39 PolarHBondContact O-N 3.13Å; Q39-V41 PolarHBondContact O-N 2.71Å; Q39-V41 VanDerWaalsContact O-N 3.12Å; Q39-S42 PolarHBondContact O-OG 2.71Å
40	H	85	Confident	67.2	Low	59 Å²	59	79.1 Å²	79.1	27%	0.273	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-64	-15.9	178.9	-42.1	116.1	0	0	0	114.2	C38 S42 H43 A44 C115 I116 C127 E129 C130	C38-H40 PolarHBondContact O-N 2.81Å; C38-H40 VanDerWaalsContact O-N 3.13Å; H40-S42 PolarHBondContact O-N 3.06Å; H40-H43 PolarHBondContact O-N 3.16Å; H40-A44 HydrophobicContact CB-CB 4.37Å; H40-A44 VanDerWaalsContact O-CB 3.3Å; H40-A44 WeakPolarHBondContact O-CB 3.36Å; H40-A44 PolarHBondContact O-N 2.8Å; H40-C115 VanDerWaalsContact CB-SG 3.57Å; H40-I116 HydrophobicContact CB-CD1 4.22Å; H40-C127 PolarHBondContact ND1-SG 3.03Å; H40-C127 VanDerWaalsContact ND1-SG 3.39Å; H40-E129 IonicContact CD2-OE2 3.69Å; H40-E129 PolarHBondContact CD2-OE2 3.02Å; H40-E129 VanDerWaalsContact CD2-OE2 3.25Å; H40-E129 IonicContact CE1-OE2 3.49Å; H40-E129 IonicContact CG-OE2 3.54Å; H40-E129 IonicContact ND1-OE2 2.68Å; H40-E129 IonicContact NE2-OE2 3.88Å; H40-C130 VanDerWaalsContact CE1-SG 3.6Å
41	V	80.9	Confident	69.7	Low	12 Å²	12	76.4 Å²	76.4	7%	0.073	43%	0.429	C	S	.	.	G	3₁₀ helix	trans	-59.5	-29	-178.3	170.9	0	0	0	0	113.1	C38 Q39 H43 I45 I116 L134 N139 L143	C38-V41 HydrophobicContact CB-CG2 4.09Å; C38-V41 WeakPolarHBondContact O-CB 3.22Å; C38-V41 VanDerWaalsContact O-CG2 3.24Å; C38-V41 WeakPolarHBondContact O-CG2 3.18Å; C38-V41 PolarHBondContact O-N 2.8Å; C38-V41 VanDerWaalsContact O-N 3.11Å; Q39-V41 PolarHBondContact O-N 2.71Å; Q39-V41 VanDerWaalsContact O-N 3.12Å; V41-H43 VanDerWaalsContact C-N 3.34Å; V41-I45 HydrophobicContact CG1-CD1 3.94Å; V41-I116 HydrophobicContact CB-CD1 4.25Å; V41-I116 HydrophobicContact CG2-CD1 3.67Å; V41-L134 HydrophobicContact CG2-CD1 3.93Å; V41-N139 HydrophobicContact CG1-CB 3.99Å; V41-L143 HydrophobicContact CG1-CD1 3.93Å; V41-L143 HydrophobicContact CG1-CG 4.08Å; V41-L143 HydrophobicContact CG2-CD1 4.03Å
42	S	76.3	Confident	71.8	Confident	79 Å²	79	76.6 Å²	76.6	55%	0.552	42%	0.419	S	S	*	.	G	3₁₀ helix	trans	-74.4	-18.1	177.3	56	0	0	0	0	114.4	Q39 H40	Q39-S42 PolarHBondContact O-OG 2.71Å; H40-S42 PolarHBondContact O-N 3.06Å
43	H	79.6	Confident	74	Confident	128 Å²	128	70.4 Å²	70.4	59%	0.593	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-130.2	-27.7	-165.3	-59.9	-28.7	0	0	0	113.8	H40 V41 I45 K87 P113	H40-H43 PolarHBondContact O-N 3.16Å; V41-H43 VanDerWaalsContact C-N 3.34Å; H43-I45 VanDerWaalsContact C-N 3.35Å; H43-K87 WeakPolarHBondContact O-CD 3.17Å; H43-K87 PolarHBondContact O-NZ 3.1Å; H43-P113 HydrophobicContact CB-CG 4.29Å
44	A	83.1	Confident	76.1	Confident	0 Å²	0	66.5 Å²	66.5	0%	0	36%	0.356	C	S	.	.	S	Bend	trans	-92.3	16.9	178.3	0	0	0	0	0	113.9	H40 L86 K87 P113 C115 I116	H40-A44 HydrophobicContact CB-CB 4.37Å; H40-A44 VanDerWaalsContact O-CB 3.3Å; H40-A44 WeakPolarHBondContact O-CB 3.36Å; H40-A44 PolarHBondContact O-N 2.8Å; A44-L86 CarbonylContact O-C 3.53Å; A44-K87 WeakPolarHBondContact O-CB 3.19Å; A44-K87 PolarHBondContact O-N 3.43Å; A44-P113 WeakPolarHBondContact CA-O 3.43Å; A44-P113 HydrophobicContact CB-CB 4.35Å; A44-P113 VanDerWaalsContact CB-O 3.26Å; A44-P113 WeakPolarHBondContact CB-O 3.37Å; A44-C115 WeakPolarHBondContact CB-SG 3.46Å; A44-I116 HydrophobicContact CB-CB 4.21Å; A44-I116 HydrophobicContact CB-CD1 4.02Å; A44-I116 HydrophobicContact CB-CG1 3.88Å
45	I	85.4	Confident	77.8	Confident	21 Å²	21	63.5 Å²	63.5	11%	0.108	35%	0.345	C	S	.	.			trans	-130.1	132	178.2	-54	-177.5	0	0	0	110.5	V41 H43 L86 I116 V142 L143 I146	V41-I45 HydrophobicContact CG1-CD1 3.94Å; H43-I45 VanDerWaalsContact C-N 3.35Å; I45-L86 CarbonylContact C-O 3.59Å; I45-L86 WeakPolarHBondContact CA-O 3.46Å; I45-L86 HydrophobicContact CD1-CD1 4.26Å; I45-L86 HydrophobicContact CG1-CB 4.06Å; I45-L86 HydrophobicContact CG1-CD1 4.47Å; I45-L86 HydrophobicContact CG2-CB 4.3Å; I45-I116 HydrophobicContact CD1-CD1 4.45Å; I45-I116 HydrophobicContact CG1-CD1 4.36Å; I45-V142 HydrophobicContact CG2-CG1 3.89Å; I45-L143 HydrophobicContact CD1-CD2 3.48Å; I45-L143 VanDerWaalsContact CD1-CD2 3.48Å; I45-L143 HydrophobicContact CD1-CG 3.95Å; I45-I146 HydrophobicContact CG2-CD1 3.95Å
46	S	86.9	Confident	79	Confident	26 Å²	26	66.8 Å²	66.8	18%	0.182	35%	0.346	C	S	.	.			trans	-139	98.7	168.9	179.1	0	0	0	0	110.2	N48 H49 V50 L86 K87	S46-N48 PolarHBondContact O-N 3.05Å; S46-N48 VanDerWaalsContact O-N 3.17Å; S46-H49 PolarHBondContact O-N 2.9Å; S46-H49 VanDerWaalsContact OG-CG 3.23Å; S46-H49 PolarHBondContact OG-N 3.08Å; S46-H49 PolarHBondContact OG-ND1 3.38Å; S46-V50 WeakPolarHBondContact O-CB 3.46Å; S46-V50 WeakPolarHBondContact O-CG2 3.35Å; S46-V50 PolarHBondContact O-N 2.94Å; S46-L86 PolarHBondContact N-O 3.33Å; S46-K87 WeakPolarHBondContact CB-O 3.21Å
47	V	83.6	Confident	79.7	Confident	32 Å²	32	64.2 Å²	64.2	19%	0.194	33%	0.334	C	S	.	.	H	α-helix	trans	-54.3	-36.1	178.2	-177	0	0	0	0	111.4	K51 V142 I146	V47-K51 HydrophobicContact CG1-CD 4Å; V47-K51 HydrophobicContact CG1-CG 4.46Å; V47-K51 VanDerWaalsContact O-CB 3.28Å; V47-K51 WeakPolarHBondContact O-CB 3.26Å; V47-K51 WeakPolarHBondContact O-CG 2.99Å; V47-K51 PolarHBondContact O-N 3.46Å; V47-V142 HydrophobicContact CG2-CG1 4.15Å; V47-I146 HydrophobicContact CB-CD1 4.46Å; V47-I146 HydrophobicContact CG2-CB 4.4Å; V47-I146 HydrophobicContact CG2-CD1 4.09Å; V47-I146 HydrophobicContact CG2-CG1 4.4Å
48	N	84.1	Confident	79.8	Confident	117 Å²	117	62.8 Å²	62.8	63%	0.626	32%	0.323	S	S	*	.	H	α-helix	trans	-74.9	-37.9	-177.6	-68.4	-12.5	0	0	0	112.9	S46 R52	S46-N48 PolarHBondContact O-N 3.05Å; S46-N48 VanDerWaalsContact O-N 3.17Å; N48-R52 PolarHBondContact O-N 2.79Å
49	H	84.8	Confident	79.8	Confident	89 Å²	89	63.4 Å²	63.4	41%	0.412	32%	0.324	S	S	.	.	H	α-helix	trans	-70.8	-44.3	175.5	-62.9	172.9	0	0	0	110.8	S46 K51 R52 A53	S46-H49 PolarHBondContact O-N 2.9Å; S46-H49 VanDerWaalsContact OG-CG 3.23Å; S46-H49 PolarHBondContact OG-N 3.08Å; S46-H49 PolarHBondContact OG-ND1 3.38Å; H49-K51 PolarHBondContact O-N 2.92Å; H49-R52 PolarHBondContact O-N 3.19Å; H49-A53 WeakPolarHBondContact O-CB 3.36Å; H49-A53 PolarHBondContact O-N 3.41Å
50	V	85.4	Confident	79.6	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58	-48	175.6	170.8	0	0	0	0	111.1	S46 R52 I54 L84 L86 I146 L150	S46-V50 WeakPolarHBondContact O-CB 3.46Å; S46-V50 WeakPolarHBondContact O-CG2 3.35Å; S46-V50 PolarHBondContact O-N 2.94Å; V50-R52 VanDerWaalsContact C-N 3.34Å; V50-R52 PolarHBondContact O-N 2.88Å; V50-I54 HydrophobicContact CG1-CD1 3.42Å; V50-I54 VanDerWaalsContact CG1-CD1 3.42Å; V50-I54 HydrophobicContact CG1-CG1 4.45Å; V50-I54 VanDerWaalsContact O-CB 3.26Å; V50-I54 WeakPolarHBondContact O-CB 3.47Å; V50-I54 WeakPolarHBondContact O-CD1 3.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.39Å; V50-I54 PolarHBondContact O-N 2.8Å; V50-L84 HydrophobicContact CG1-CD2 4.16Å; V50-L86 VanDerWaalsContact CG2-C 3.48Å; V50-L86 WeakPolarHBondContact CG2-O 3Å; V50-I146 HydrophobicContact CB-CD1 4.08Å; V50-I146 HydrophobicContact CG1-CD1 4.03Å; V50-I146 HydrophobicContact CG1-CG1 4.42Å; V50-I146 HydrophobicContact CG2-CD1 4.07Å; V50-L150 HydrophobicContact CG1-CD2 4.13Å
51	K	83.1	Confident	79.1	Confident	89 Å²	89	55.4 Å²	55.4	39%	0.387	29%	0.292	S	S	.	.	H	α-helix	trans	-56	-44.2	175.1	-82	174.8	177.1	178.8	0	113.2	V47 H49 A55 F149	V47-K51 HydrophobicContact CG1-CD 4Å; V47-K51 HydrophobicContact CG1-CG 4.46Å; V47-K51 VanDerWaalsContact O-CB 3.28Å; V47-K51 WeakPolarHBondContact O-CB 3.26Å; V47-K51 WeakPolarHBondContact O-CG 2.99Å; V47-K51 PolarHBondContact O-N 3.46Å; H49-K51 PolarHBondContact O-N 2.92Å; K51-A55 PolarHBondContact O-N 3.41Å; K51-F149 HydrophobicContact CD-CE2 4.42Å; K51-F149 HydrophobicContact CD-CZ 4.37Å; K51-F149 HydrophobicContact CG-CD1 4.09Å; K51-F149 HydrophobicContact CG-CE1 3.58Å; K51-F149 HydrophobicContact CG-CE2 4.16Å; K51-F149 HydrophobicContact CG-CZ 3.64Å
52	R	81.3	Confident	79.1	Confident	159 Å²	159	54.9 Å²	54.9	60%	0.6	29%	0.288	S	S	*	.	H	α-helix	trans	-66.8	-55.3	-179.9	-174.6	-175.9	-56.1	176.4	3.2	111.5	N48 H49 V50 I54 A55 E56	N48-R52 PolarHBondContact O-N 2.79Å; H49-R52 PolarHBondContact O-N 3.19Å; V50-R52 VanDerWaalsContact C-N 3.34Å; V50-R52 PolarHBondContact O-N 2.88Å; R52-I54 PolarHBondContact O-N 2.97Å; R52-A55 PolarHBondContact O-N 2.89Å; R52-E56 WeakPolarHBondContact CD-OE1 3.45Å; R52-E56 WeakPolarHBondContact CG-OE1 3.3Å; R52-E56 WeakPolarHBondContact O-CG 3.43Å; R52-E56 PolarHBondContact O-N 3.06Å; R52-E56 VanDerWaalsContact O-N 3.1Å
53	A	81.2	Confident	78.7	Confident	13 Å²	13	52.4 Å²	52.4	11%	0.107	27%	0.271	C	S	.	.	H	α-helix	trans	-59.5	-33.5	-178	0	0	0	0	0	112.7	H49 E56 N57 C88	H49-A53 WeakPolarHBondContact O-CB 3.36Å; H49-A53 PolarHBondContact O-N 3.41Å; A53-E56 PolarHBondContact O-N 3.12Å; A53-N57 WeakPolarHBondContact O-CB 3.15Å; A53-N57 PolarHBondContact O-N 2.85Å; A53-N57 PolarHBondContact O-ND2 3.35Å; A53-C88 WeakPolarHBondContact CB-O 3.48Å
54	I	79.4	Confident	78.4	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.021	25%	0.253	C	S	.	.	H	α-helix	trans	-72	-32.6	176.7	-75.2	168	0	0	0	113.1	V50 R52 E56 W59 L84 L150 H153	V50-I54 HydrophobicContact CG1-CD1 3.42Å; V50-I54 VanDerWaalsContact CG1-CD1 3.42Å; V50-I54 HydrophobicContact CG1-CG1 4.45Å; V50-I54 VanDerWaalsContact O-CB 3.26Å; V50-I54 WeakPolarHBondContact O-CB 3.47Å; V50-I54 WeakPolarHBondContact O-CD1 3.33Å; V50-I54 WeakPolarHBondContact O-CG1 3.39Å; V50-I54 PolarHBondContact O-N 2.8Å; R52-I54 PolarHBondContact O-N 2.97Å; I54-E56 VanDerWaalsContact C-N 3.34Å; I54-W59 HydrophobicContact CD1-CZ3 4.01Å; I54-W59 HydrophobicContact CG1-CZ3 4.36Å; I54-W59 HydrophobicContact CG2-CE3 3.99Å; I54-W59 HydrophobicContact CG2-CZ3 4.13Å; I54-L84 HydrophobicContact CD1-CD1 4.22Å; I54-L84 HydrophobicContact CD1-CD2 3.92Å; I54-L84 HydrophobicContact CG1-CD1 4.23Å; I54-L150 HydrophobicContact CD1-CD2 3.25Å; I54-H153 WeakPolarHBondContact CG2-CE1 3.37Å; I54-H153 WeakPolarHBondContact CG2-ND1 3.42Å; I54-H153 WeakPolarHBondContact CG2-NE2 3.33Å
55	A	73.9	Confident	77.8	Confident	72 Å²	72	50.2 Å²	50.2	60%	0.595	27%	0.265	S	S	*	.	H	α-helix	trans	-71.7	-32.9	173	0	0	0	0	0	111.7	K51 R52	K51-A55 PolarHBondContact O-N 3.41Å; R52-A55 PolarHBondContact O-N 2.89Å
56	E	69.1	Low	76.8	Confident	122 Å²	122	54.1 Å²	54.1	57%	0.57	29%	0.285	S	S	*	.	H	α-helix	trans	-78.9	-41.4	-177.8	-70.3	163.8	179.3	0	0	112.4	R52 A53 I54 R164	R52-E56 WeakPolarHBondContact CD-OE1 3.45Å; R52-E56 WeakPolarHBondContact CG-OE1 3.3Å; R52-E56 WeakPolarHBondContact O-CG 3.43Å; R52-E56 PolarHBondContact O-N 3.06Å; R52-E56 VanDerWaalsContact O-N 3.1Å; A53-E56 PolarHBondContact O-N 3.12Å; I54-E56 VanDerWaalsContact C-N 3.34Å; E56-R164 PolarHBondContact O-NH1 3.33Å
57	N	66.8	Low	75.8	Confident	75 Å²	75	59.4 Å²	59.4	40%	0.401	31%	0.305	S	S	.	.	S	Bend	trans	-96.8	170.4	-173	-66.7	-89.1	0	0	0	113.9	A53	A53-N57 WeakPolarHBondContact O-CB 3.15Å; A53-N57 PolarHBondContact O-N 2.85Å; A53-N57 PolarHBondContact O-ND2 3.35Å
58	L	67.4	Low	74.4	Confident	47 Å²	47	61.5 Å²	61.5	25%	0.246	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-73.3	142.4	170.8	-81	79.4	0	0	0	110.6	V61 Q91 I165	L58-V61 HydrophobicContact CB-CB 4.34Å; L58-V61 HydrophobicContact CB-CG2 4.07Å; L58-V61 HydrophobicContact CD2-CG2 4.45Å; L58-Q91 PolarHBondContact O-NE2 3.07Å; L58-Q91 PolarHBondContact O-OE1 3.4Å; L58-I165 HydrophobicContact CD2-CG1 4.28Å
59	W	78.1	Confident	72.8	Confident	23 Å²	23	65.5 Å²	65.5	9%	0.087	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.4	133.7	178	177.4	-94.3	0	0	0	112.1	I54 L120 W123 L150 H153 A154 T157 A161	I54-W59 HydrophobicContact CD1-CZ3 4.01Å; I54-W59 HydrophobicContact CG1-CZ3 4.36Å; I54-W59 HydrophobicContact CG2-CE3 3.99Å; I54-W59 HydrophobicContact CG2-CZ3 4.13Å; W59-L120 HydrophobicContact CH2-CD1 4.4Å; W59-L120 HydrophobicContact CH2-CD2 3.68Å; W59-L120 HydrophobicContact CZ2-CD1 4.26Å; W59-L120 HydrophobicContact CZ2-CD2 3.89Å; W59-L120 HydrophobicContact CZ2-CG 4.48Å; W59-L120 HydrophobicContact CZ3-CD2 4.41Å; W59-W123 HydrophobicContact CH2-CH2 4.49Å; W59-W123 HydrophobicContact CZ2-CH2 4.24Å; W59-L150 HydrophobicContact CH2-CB 4.33Å; W59-L150 HydrophobicContact CH2-CD2 3.99Å; W59-L150 HydrophobicContact CZ3-CD2 3.96Å; W59-H153 AromaticContact CE3-CE1 3.81Å; W59-H153 AromaticContact CE3-ND1 3.4Å; W59-H153 AromaticContact CZ3-ND1 3.58Å; W59-A154 HydrophobicContact CZ2-CB 3.66Å; W59-T157 HydrophobicContact CB-CG2 3.94Å; W59-A161 HydrophobicContact CB-CB 4.3Å
60	S	75.6	Confident	70.7	Confident	39 Å²	39	68.2 Å²	68.2	27%	0.273	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	60	39.7	178.6	-163.8	0	0	0	0	114.6
61	V	76.1	Confident	68.4	Low	16 Å²	16	74.8 Å²	74.8	10%	0.097	35%	0.354	C	S	.	.			trans	-135.3	137.8	174.9	-167.1	0	0	0	0	110	L58 L66 L78 Q91	L58-V61 HydrophobicContact CB-CB 4.34Å; L58-V61 HydrophobicContact CB-CG2 4.07Å; L58-V61 HydrophobicContact CD2-CG2 4.45Å; V61-L66 HydrophobicContact CG1-CD1 3.68Å; V61-L66 HydrophobicContact CG1-CG 4.15Å; V61-L78 HydrophobicContact CB-CD2 4.46Å; V61-L78 HydrophobicContact CG1-CD2 3.98Å; V61-L78 HydrophobicContact CG1-CG 4.22Å; V61-L78 HydrophobicContact CG2-CD2 3.94Å; V61-Q91 WeakPolarHBondContact O-CB 3.42Å
62	C	79.2	Confident	65.9	Low	1 Å²	1	79.6 Å²	79.6	1%	0.007	37%	0.371	C	S	.	.			trans	-80.6	119.9	174.6	-177.2	0	0	0	0	111.6	E64 C65 L66 I82 Q91 C93	C62-E64 VanDerWaalsContact C-N 3.32Å; C62-E64 PolarHBondContact O-N 3.49Å; C62-C65 HydrophobicContact CB-CB 4.01Å; C62-C65 PolarHBondContact O-N 3.05Å; C62-L66 PolarHBondContact O-N 3.11Å; C62-I82 HydrophobicContact CB-CD1 3.97Å; C62-Q91 WeakPolarHBondContact CA-O 3.3Å; C62-Q91 PolarHBondContact SG-O 2.93Å; C62-C93 HydrophobicContact CB-CB 4.47Å
63	S	69.7	Low	63.6	Low	27 Å²	27	79.6 Å²	79.6	19%	0.189	38%	0.384	C	S	.	.	H	α-helix	trans	-64.7	-32.8	179.8	59.5	0	0	0	0	113.3	K67	S63-K67 VanDerWaalsContact O-CG 3.3Å; S63-K67 WeakPolarHBondContact O-CG 3.35Å; S63-K67 PolarHBondContact O-N 3.09Å; S63-K67 VanDerWaalsContact O-N 3.07Å
64	E	73	Confident	61.5	Low	47 Å²	47	80.8 Å²	80.8	22%	0.22	40%	0.397	C	S	.	.	H	α-helix	trans	-84.4	-28.2	-178	-51.6	-45.2	115.9	0	0	112.5	C62 L66 K67 E68 F90 H101	C62-E64 VanDerWaalsContact C-N 3.32Å; C62-E64 PolarHBondContact O-N 3.49Å; E64-L66 VanDerWaalsContact C-N 3.3Å; E64-L66 PolarHBondContact O-N 3.49Å; E64-K67 PolarHBondContact O-N 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.33Å; E64-K67 IonicContact OE1-NZ 3.2Å; E64-K67 PolarHBondContact OE1-NZ 2.8Å; E64-K67 WeakPolarHBondContact OE2-CD 3.43Å; E64-K67 IonicContact OE2-NZ 2.67Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å; E64-E68 WeakPolarHBondContact O-CB 3.35Å; E64-E68 WeakPolarHBondContact O-CG 3.42Å; E64-E68 PolarHBondContact O-N 3.2Å; E64-F90 HydrophobicContact CG-CE2 3.71Å; E64-F90 HydrophobicContact CG-CZ 3.67Å; E64-H101 HydrophobicContact CB-CB 4.41Å; E64-H101 VanDerWaalsContact CB-CD2 3.45Å; E64-H101 WeakPolarHBondContact CB-CD2 3.26Å
65	C	71	Confident	59.3	Low	35 Å²	35	82.7 Å²	82.7	24%	0.236	41%	0.406	C	S	.	.	H	α-helix	trans	-59.8	-42.1	165.1	-69.3	0	0	0	0	111.3	C62 H101	C62-C65 HydrophobicContact CB-CB 4.01Å; C62-C65 PolarHBondContact O-N 3.05Å; C65-H101 PolarHBondContact SG-ND1 3.37Å; C65-H101 VanDerWaalsContact SG-ND1 3.4Å
66	L	64.3	Low	57.4	Low	103 Å²	103	83.6 Å²	83.6	54%	0.539	41%	0.405	S	S	.	.	H	α-helix	trans	-63.5	-43.3	175.2	-75.4	167.5	0	0	0	112.3	V61 C62 E64	V61-L66 HydrophobicContact CG1-CD1 3.68Å; V61-L66 HydrophobicContact CG1-CG 4.15Å; C62-L66 PolarHBondContact O-N 3.11Å; E64-L66 VanDerWaalsContact C-N 3.3Å; E64-L66 PolarHBondContact O-N 3.49Å
67	K	63.9	Low	56	Low	137 Å²	137	82.9 Å²	82.9	60%	0.596	41%	0.409	S	S	*	.	H	α-helix	trans	-74.5	-42.6	-178.4	-72.4	163.8	178.9	174.9	0	114.1	S63 E64 R69	S63-K67 VanDerWaalsContact O-CG 3.3Å; S63-K67 WeakPolarHBondContact O-CG 3.35Å; S63-K67 PolarHBondContact O-N 3.09Å; S63-K67 VanDerWaalsContact O-N 3.07Å; E64-K67 PolarHBondContact O-N 3.41Å; E64-K67 WeakPolarHBondContact OE1-CE 3.33Å; E64-K67 IonicContact OE1-NZ 3.2Å; E64-K67 PolarHBondContact OE1-NZ 2.8Å; E64-K67 WeakPolarHBondContact OE2-CD 3.43Å; E64-K67 IonicContact OE2-NZ 2.67Å; E64-K67 PolarHBondContact OE2-NZ 3.2Å; K67-R69 PolarHBondContact O-N 3.41Å; K67-R69 VanDerWaalsContact O-N 3.12Å
68	E	55.9	Low	55.1	Low	77 Å²	77	84 Å²	84	36%	0.36	41%	0.414	S	S	.	.	H	α-helix	trans	-67.6	-10.1	-176.4	-75.9	-166.7	-148.9	0	0	112.8	E64 R70 H101 K104	E64-E68 WeakPolarHBondContact O-CB 3.35Å; E64-E68 WeakPolarHBondContact O-CG 3.42Å; E64-E68 PolarHBondContact O-N 3.2Å; E68-R70 HydrophobicContact CB-CG 4.11Å; E68-R70 PolarHBondContact O-N 3.1Å; E68-R70 IonicContact OE2-CZ 3.2Å; E68-R70 IonicContact OE2-NE 2.71Å; E68-R70 PolarHBondContact OE2-NE 3.09Å; E68-R70 IonicContact OE2-NH2 2.8Å; E68-R70 PolarHBondContact OE2-NH2 3.2Å; E68-H101 IonicContact OE1-CD2 2.68Å; E68-H101 IonicContact OE1-CE1 2.95Å; E68-H101 IonicContact OE1-NE2 3.85Å; E68-H101 PolarHBondContact OE1-NE2 3.27Å; E68-K104 IonicContact OE1-NZ 3.3Å
69	R	49.4	Very low	54.4	Low	200 Å²	200	82.9 Å²	82.9	76%	0.755	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.7	39.2	179.1	-64.8	-170.8	179.1	-161.2	1	113.3	K67 F71	K67-R69 PolarHBondContact O-N 3.41Å; K67-R69 VanDerWaalsContact O-N 3.12Å; R69-F71 HydrophobicContact CB-CE2 4.43Å; R69-F71 WeakPolarHBondContact O-CD2 3.43Å; R69-F71 PolarHBondContact O-N 2.93Å
70	R	41.6	Very low	53.3	Low	147 Å²	147	86.3 Å²	86.3	56%	0.555	44%	0.438	S	S	*	.			trans	-72.6	78.3	179.2	-71	-163.7	-170.1	-125	-7.4	111.6	E68 Y72	E68-R70 HydrophobicContact CB-CG 4.11Å; E68-R70 PolarHBondContact O-N 3.1Å; E68-R70 IonicContact OE2-CZ 3.2Å; E68-R70 IonicContact OE2-NE 2.71Å; E68-R70 PolarHBondContact OE2-NE 3.09Å; E68-R70 IonicContact OE2-NH2 2.8Å; E68-R70 PolarHBondContact OE2-NH2 3.2Å; R70-Y72 PolarHBondContact O-N 2.99Å; R70-Y72 VanDerWaalsContact O-N 3.13Å
71	F	35.9	Very low	53.3	Low	137 Å²	137	86.1 Å²	86.1	60%	0.601	43%	0.434	S	S	*	.			trans	-71.8	93.1	159.6	-62.8	-75.6	0	0	0	109.2	R69	R69-F71 HydrophobicContact CB-CE2 4.43Å; R69-F71 WeakPolarHBondContact O-CD2 3.43Å; R69-F71 PolarHBondContact O-N 2.93Å
72	Y	31.9	Very low	53.8	Low	190 Å²	190	85.5 Å²	85.5	75%	0.745	43%	0.429	S	S	*	.	S	Bend	trans	-90.1	124.8	145.1	-88.8	-89.8	0	0	0	106.8	R70 G74	R70-Y72 PolarHBondContact O-N 2.99Å; R70-Y72 VanDerWaalsContact O-N 3.13Å; Y72-G74 PolarHBondContact O-N 3.23Å
73	D	31.9	Very low	54.3	Low	160 Å²	160	86.9 Å²	86.9	86%	0.856	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.7	32.4	-174.9	-90.1	-2.5	0	0	0	117.4	Q75	D73-Q75 PolarHBondContact O-N 3.41Å
74	G	37.1	Very low	55.3	Low	37 Å²	37	85.6 Å²	85.6	38%	0.381	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	0.9	157.9	0	0	0	0	0	116.9	Y72	Y72-G74 PolarHBondContact O-N 3.23Å
75	Q	34.3	Very low	56.2	Low	45 Å²	45	83.4 Å²	83.4	21%	0.21	42%	0.415	C	S	.	.			trans	-105.4	143.9	179.3	-67.5	-167.9	-12.5	0	0	114	D73 V77 K268 P270	D73-Q75 PolarHBondContact O-N 3.41Å; Q75-V77 PolarHBondContact O-N 3.21Å; Q75-K268 PolarHBondContact NE2-O 3.04Å; Q75-P270 PolarHBondContact NE2-O 3.03Å; Q75-P270 PolarHBondContact OE1-O 2.95Å
76	P	33.9	Very low	57.1	Low	90 Å²	90	81.7 Å²	81.7	58%	0.584	40%	0.404	S	S	*	.			trans	-76.1	88.4	165.3	32.6	-32.5	0	0	0	109.5	L78	P76-L78 PolarHBondContact O-N 3.22Å
77	V	39.8	Very low	58.2	Low	108 Å²	108	78.1 Å²	78.1	66%	0.655	38%	0.384	S	S	*	.			trans	-64	100.3	172.2	-178.8	0	0	0	0	109	Q75 P79	Q75-V77 PolarHBondContact O-N 3.21Å; V77-P79 VanDerWaalsContact O-CD 3.25Å; V77-P79 WeakPolarHBondContact O-CD 3.36Å
78	L	47	Very low	59.4	Low	98 Å²	98	73.2 Å²	73.2	51%	0.513	37%	0.367	S	S	.	.			trans	-75.6	111.3	159.6	-85.3	82	0	0	0	107.3	V61 P76 S80	V61-L78 HydrophobicContact CB-CD2 4.46Å; V61-L78 HydrophobicContact CG1-CD2 3.98Å; V61-L78 HydrophobicContact CG1-CG 4.22Å; V61-L78 HydrophobicContact CG2-CD2 3.94Å; P76-L78 PolarHBondContact O-N 3.22Å; L78-S80 PolarHBondContact O-N 3.47Å
79	P	52.3	Low	60.8	Low	23 Å²	23	69.6 Å²	69.6	15%	0.149	35%	0.35	C	S	.	.			trans	-72.9	129.8	178.4	25.8	-25.6	0	0	0	109.5	V77 D81 I82 C93	V77-P79 VanDerWaalsContact O-CD 3.25Å; V77-P79 WeakPolarHBondContact O-CD 3.36Å; P79-D81 PolarHBondContact O-N 3.17Å; P79-I82 HydrophobicContact CG-CD1 3.87Å; P79-I82 VanDerWaalsContact O-CD1 3.32Å; P79-I82 WeakPolarHBondContact O-CD1 3.47Å; P79-I82 WeakPolarHBondContact O-CG1 3.35Å; P79-C93 HydrophobicContact CB-CB 4.11Å; P79-C93 HydrophobicContact CG-CB 3.32Å
80	S	55.6	Low	62.7	Low	96 Å²	96	61.8 Å²	61.8	67%	0.671	32%	0.322	S	S	*	.	S	Bend	trans	-60.9	-10.8	179.7	-45.9	0	0	0	0	114.6	L78 S121	L78-S80 PolarHBondContact O-N 3.47Å; S80-S121 PolarHBondContact O-OG 3.3Å
81	D	75.7	Confident	65	Low	35 Å²	35	55.1 Å²	55.1	19%	0.187	30%	0.297	C	S	.	.			trans	-109.1	73.2	-176.8	-168.1	46	0	0	0	110.4	P79 W83 G94 N119	P79-D81 PolarHBondContact O-N 3.17Å; D81-W83 PolarHBondContact OD1-NE1 3.25Å; D81-W83 PolarHBondContact OD2-NE1 3Å; D81-G94 PolarHBondContact O-N 3.4Å; D81-G94 WeakPolarHBondContact OD2-CA 3.35Å; D81-N119 PolarHBondContact OD1-ND2 3.35Å
82	I	86.4	Confident	67.3	Low	2 Å²	2	48.6 Å²	48.6	1%	0.01	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	127.7	176.1	-56.4	-61.6	0	0	0	110.5	C62 P79 Q91 L120	C62-I82 HydrophobicContact CB-CD1 3.97Å; P79-I82 HydrophobicContact CG-CD1 3.87Å; P79-I82 VanDerWaalsContact O-CD1 3.32Å; P79-I82 WeakPolarHBondContact O-CD1 3.47Å; P79-I82 WeakPolarHBondContact O-CG1 3.35Å; I82-Q91 HydrophobicContact CG2-CB 4.04Å; I82-Q91 HydrophobicContact CG2-CG 4.41Å; I82-L120 HydrophobicContact CG2-CD1 3.9Å; I82-L120 HydrophobicContact CG2-CG 4.48Å; I82-L120 PolarHBondContact O-N 2.87Å
83	W	89.1	Confident	69.9	Low	30 Å²	30	39.6 Å²	39.6	11%	0.114	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	127.5	177.9	-64.7	78.2	0	0	0	110.8	D81 Q91 G92 I117 I118 N119 I124 W126	D81-W83 PolarHBondContact OD1-NE1 3.25Å; D81-W83 PolarHBondContact OD2-NE1 3Å; W83-Q91 WeakPolarHBondContact O-CA 3.49Å; W83-G92 PolarHBondContact N-O 3.17Å; W83-G92 PolarHBondContact O-N 3.35Å; W83-I117 HydrophobicContact CB-CB 4.39Å; W83-I117 HydrophobicContact CB-CD1 4.03Å; W83-I117 HydrophobicContact CD2-CD1 3.72Å; W83-I117 HydrophobicContact CD2-CG1 4.38Å; W83-I117 HydrophobicContact CE3-CB 4.18Å; W83-I117 HydrophobicContact CE3-CD1 3.38Å; W83-I117 HydrophobicContact CE3-CG1 3.58Å; W83-I117 HydrophobicContact CG-CD1 4.03Å; W83-I117 HydrophobicContact CZ3-CD1 4.04Å; W83-I117 HydrophobicContact CZ3-CG1 4.11Å; W83-I118 CarbonylContact C-O 3.55Å; W83-I118 WeakPolarHBondContact CA-O 3.02Å; W83-N119 HydrophobicContact CD2-CB 3.98Å; W83-N119 VanDerWaalsContact CE2-ND2 3.28Å; W83-N119 HydrophobicContact CE3-CB 3.8Å; W83-N119 HydrophobicContact CH2-CB 3.89Å; W83-N119 HydrophobicContact CZ2-CB 4.02Å; W83-N119 WeakPolarHBondContact CZ2-ND2 3.21Å; W83-N119 HydrophobicContact CZ3-CB 3.76Å; W83-I124 HydrophobicContact CH2-CB 4.43Å; W83-I124 HydrophobicContact CH2-CG2 4.08Å; W83-I124 HydrophobicContact CZ3-CG2 4.43Å; W83-I124 WeakPolarHBondContact CZ3-O 3.26Å; W83-W126 HydrophobicContact CH2-CB 4.3Å; W83-W126 HydrophobicContact CZ3-CB 3.81Å
84	L	90.9	Very high	72.2	Confident	0 Å²	0	32 Å²	32	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.1	179	176.1	81.2	0	0	0	110.1	V50 I54 L86 G89 F90 Q91 I117 I118 L120 L150	V50-L84 HydrophobicContact CG1-CD2 4.16Å; I54-L84 HydrophobicContact CD1-CD1 4.22Å; I54-L84 HydrophobicContact CD1-CD2 3.92Å; I54-L84 HydrophobicContact CG1-CD1 4.23Å; L84-L86 HydrophobicContact CD2-CD2 4.36Å; L84-L86 PolarHBondContact O-N 3.21Å; L84-G89 VanDerWaalsContact CD1-O 3.32Å; L84-G89 WeakPolarHBondContact CD1-O 3.39Å; L84-F90 CarbonylContact C-O 3.56Å; L84-F90 WeakPolarHBondContact CA-O 3.41Å; L84-Q91 HydrophobicContact CD1-CG 3.58Å; L84-I117 CarbonylContact O-C 3.57Å; L84-I117 VanDerWaalsContact O-CA 3.26Å; L84-I117 WeakPolarHBondContact O-CA 3.22Å; L84-I118 HydrophobicContact CB-CG2 3.9Å; L84-I118 HydrophobicContact CD2-CG2 3.98Å; L84-I118 HydrophobicContact CG-CG2 4.41Å; L84-I118 PolarHBondContact N-O 2.83Å; L84-I118 PolarHBondContact O-N 2.91Å; L84-L120 HydrophobicContact CB-CD1 4.35Å; L84-L120 HydrophobicContact CB-CD2 3.79Å; L84-L120 HydrophobicContact CB-CG 4.13Å; L84-L120 HydrophobicContact CD2-CD2 4.11Å; L84-L150 HydrophobicContact CD2-CD1 3.7Å; L84-L150 HydrophobicContact CD2-CD2 3.55Å; L84-L150 HydrophobicContact CD2-CG 4.3Å
85	C	91.8	Very high	73.6	Confident	1 Å²	1	34 Å²	34	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	121.9	172.7	-177.4	0	0	0	0	111.2	K87 G89 F90 I117	C85-K87 PolarHBondContact O-N 2.99Å; C85-G89 WeakPolarHBondContact O-CA 2.58Å; C85-G89 PolarHBondContact O-N 3Å; C85-F90 HydrophobicContact CB-CB 4.3Å; C85-F90 PolarHBondContact N-O 2.77Å; C85-I117 HydrophobicContact CB-CG2 4.46Å
86	L	90.1	Very high	75	Confident	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-8.7	-177.5	-63.4	-167.7	0	0	0	113.8	A44 I45 S46 V50 L84 I116 I118 I125 L143 I146 L150	A44-L86 CarbonylContact O-C 3.53Å; I45-L86 CarbonylContact C-O 3.59Å; I45-L86 WeakPolarHBondContact CA-O 3.46Å; I45-L86 HydrophobicContact CD1-CD1 4.26Å; I45-L86 HydrophobicContact CG1-CB 4.06Å; I45-L86 HydrophobicContact CG1-CD1 4.47Å; I45-L86 HydrophobicContact CG2-CB 4.3Å; S46-L86 PolarHBondContact N-O 3.33Å; V50-L86 VanDerWaalsContact CG2-C 3.48Å; V50-L86 WeakPolarHBondContact CG2-O 3Å; L84-L86 HydrophobicContact CD2-CD2 4.36Å; L84-L86 PolarHBondContact O-N 3.21Å; L86-I116 HydrophobicContact CB-CG2 4.38Å; L86-I116 HydrophobicContact CD1-CG2 3.79Å; L86-I116 HydrophobicContact CG-CG2 4.22Å; L86-I116 PolarHBondContact N-O 3.5Å; L86-I118 HydrophobicContact CD2-CB 4.14Å; L86-I118 HydrophobicContact CD2-CG2 3.51Å; L86-I118 HydrophobicContact CG-CG2 4.36Å; L86-I125 HydrophobicContact CD1-CG2 4.43Å; L86-L143 HydrophobicContact CD1-CD2 3.92Å; L86-I146 HydrophobicContact CD1-CG2 4.15Å; L86-I146 HydrophobicContact CD2-CD1 4.2Å; L86-I146 HydrophobicContact CD2-CG2 4.45Å; L86-L150 HydrophobicContact CD2-CD1 4.13Å
87	K	88.6	Confident	76.6	Confident	28 Å²	28	36 Å²	36	12%	0.122	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-35.5	177.2	-174.9	58.5	172.3	-171	0	113.9	H43 A44 S46 C85 E112 H114	H43-K87 WeakPolarHBondContact O-CD 3.17Å; H43-K87 PolarHBondContact O-NZ 3.1Å; A44-K87 WeakPolarHBondContact O-CB 3.19Å; A44-K87 PolarHBondContact O-N 3.43Å; S46-K87 WeakPolarHBondContact CB-O 3.21Å; C85-K87 PolarHBondContact O-N 2.99Å; K87-E112 WeakPolarHBondContact CE-OE2 3.38Å; K87-E112 IonicContact NZ-OE2 2.8Å; K87-E112 PolarHBondContact NZ-OE2 2.94Å; K87-H114 VanDerWaalsContact CG-CD2 3.46Å; K87-H114 WeakPolarHBondContact CG-CD2 3.48Å
88	C	88.6	Confident	77.6	Confident	33 Å²	33	39.7 Å²	39.7	22%	0.223	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-137.9	-9.7	-170	66.7	0	0	0	0	115.1	A53 F90 H105 H114	A53-C88 WeakPolarHBondContact CB-O 3.48Å; C88-F90 VanDerWaalsContact C-N 3.33Å; C88-F90 VanDerWaalsContact SG-CB 3.54Å; C88-F90 PolarHBondContact SG-N 2.77Å; C88-H105 PolarHBondContact SG-NE2 3.41Å; C88-H114 VanDerWaalsContact SG-CE1 3.52Å
89	G	85.9	Confident	78.8	Confident	2 Å²	2	35.9 Å²	35.9	2%	0.021	19%	0.191	C	C	.	.			trans	76.1	11.9	-177.2	0	0	0	0	0	115.6	L84 C85	L84-G89 VanDerWaalsContact CD1-O 3.32Å; L84-G89 WeakPolarHBondContact CD1-O 3.39Å; C85-G89 WeakPolarHBondContact O-CA 2.58Å; C85-G89 PolarHBondContact O-N 3Å
90	F	87.9	Confident	80.3	Confident	36 Å²	36	38.1 Å²	38.1	16%	0.158	20%	0.2	C	C	.	.			trans	-60.5	138.5	169.9	175.2	-93.1	0	0	0	111.2	E64 L84 C85 C88 H105	E64-F90 HydrophobicContact CG-CE2 3.71Å; E64-F90 HydrophobicContact CG-CZ 3.67Å; L84-F90 CarbonylContact C-O 3.56Å; L84-F90 WeakPolarHBondContact CA-O 3.41Å; C85-F90 HydrophobicContact CB-CB 4.3Å; C85-F90 PolarHBondContact N-O 2.77Å; C88-F90 VanDerWaalsContact C-N 3.33Å; C88-F90 VanDerWaalsContact SG-CB 3.54Å; C88-F90 PolarHBondContact SG-N 2.77Å; F90-H105 VanDerWaalsContact CB-CE1 3.46Å; F90-H105 WeakPolarHBondContact CB-CE1 3.38Å; F90-H105 HydrophobicContact CD1-CB 3.7Å; F90-H105 AromaticContact CD1-CD2 3.7Å; F90-H105 AromaticContact CD1-CE1 3.92Å; F90-H105 AromaticContact CD1-CG 3.36Å; F90-H105 AromaticContact CD1-ND1 3.52Å; F90-H105 AromaticContact CD2-ND1 3.78Å; F90-H105 HydrophobicContact CE1-CB 3.48Å; F90-H105 VanDerWaalsContact CE1-CB 3.48Å; F90-H105 AromaticContact CE1-CG 3.67Å; F90-H105 AromaticContact CE1-ND1 3.92Å; F90-H105 HydrophobicContact CG-CB 4.5Å; F90-H105 AromaticContact CG-CE1 3.54Å; F90-H105 AromaticContact CG-CG 3.79Å; F90-H105 AromaticContact CG-ND1 3.43Å; F90-H105 WeakPolarHBondContact CG-ND1 3.24Å; F90-H105 AromaticContact CG-NE2 3.94Å; F90-H105 HydrophobicContact CZ-CB 4.11Å
91	Q	89.4	Confident	81.8	Confident	7 Å²	7	33.8 Å²	33.8	3%	0.033	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	112.7	178.7	-71.4	173.6	84.8	0	0	110.5	L58 V61 C62 I82 W83 L84 L120	L58-Q91 PolarHBondContact O-NE2 3.07Å; L58-Q91 PolarHBondContact O-OE1 3.4Å; V61-Q91 WeakPolarHBondContact O-CB 3.42Å; C62-Q91 WeakPolarHBondContact CA-O 3.3Å; C62-Q91 PolarHBondContact SG-O 2.93Å; I82-Q91 HydrophobicContact CG2-CB 4.04Å; I82-Q91 HydrophobicContact CG2-CG 4.41Å; W83-Q91 WeakPolarHBondContact O-CA 3.49Å; L84-Q91 HydrophobicContact CD1-CG 3.58Å; Q91-L120 HydrophobicContact CG-CD1 4.44Å
92	G	85.9	Confident	82.3	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	150.2	-179.1	0	0	0	0	0	112	W83	W83-G92 PolarHBondContact N-O 3.17Å; W83-G92 PolarHBondContact O-N 3.35Å
93	C	85.8	Confident	82.2	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	144.8	165.3	59.2	0	0	0	0	111.4	C62 P79 S97 S99 Q100 H101 S102	C62-C93 HydrophobicContact CB-CB 4.47Å; P79-C93 HydrophobicContact CB-CB 4.11Å; P79-C93 HydrophobicContact CG-CB 3.32Å; C93-S97 VanDerWaalsContact CB-OG 3.3Å; C93-S97 WeakPolarHBondContact CB-OG 3.44Å; C93-S97 PolarHBondContact SG-OG 3.36Å; C93-S99 PolarHBondContact SG-OG 2.81Å; C93-Q100 CarbonylContact O-C 3.47Å; C93-H101 PolarHBondContact O-N 3.05Å; C93-H101 VanDerWaalsContact SG-CB 3.57Å; C93-H101 PolarHBondContact SG-N 3.23Å; C93-H101 PolarHBondContact SG-ND1 3.49Å; C93-S102 WeakPolarHBondContact O-CB 3.31Å; C93-S102 PolarHBondContact O-N 3.28Å; C93-S102 PolarHBondContact O-OG 3.28Å
94	G	80.7	Confident	82.1	Confident	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.178	C	C	.	.			trans	-81.4	-173.4	-169.9	0	0	0	0	0	116.8	D81 N96 S97	D81-G94 PolarHBondContact O-N 3.4Å; D81-G94 WeakPolarHBondContact OD2-CA 3.35Å; G94-N96 PolarHBondContact O-N 3.1Å; G94-N96 VanDerWaalsContact O-N 3.09Å; G94-S97 PolarHBondContact O-N 3.35Å; G94-S97 VanDerWaalsContact O-N 3.1Å; G94-S97 PolarHBondContact O-OG 3.22Å
95	K	66.3	Low	81.9	Confident	80 Å²	80	37.4 Å²	37.4	35%	0.348	19%	0.186	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.8	-30.7	-176.9	-71	-173.1	178.9	-177.9	0	112.3	S97 Q100 D131	K95-S97 VanDerWaalsContact C-N 3.32Å; K95-S97 PolarHBondContact O-N 3.49Å; K95-Q100 PolarHBondContact O-NE2 3.08Å; K95-D131 VanDerWaalsContact NZ-CG 3.31Å; K95-D131 IonicContact NZ-OD1 3.83Å; K95-D131 PolarHBondContact NZ-OD1 2.8Å; K95-D131 IonicContact NZ-OD2 3.14Å; K95-D131 PolarHBondContact NZ-OD2 2.89Å
96	N	63.5	Low	81.7	Confident	153 Å²	153	39.6 Å²	39.6	82%	0.818	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-82	0.3	-176.4	-63.2	1.4	0	0	0	114.8	G94	G94-N96 PolarHBondContact O-N 3.1Å; G94-N96 VanDerWaalsContact O-N 3.09Å
97	S	67.3	Low	81.3	Confident	23 Å²	23	45.9 Å²	45.9	16%	0.161	22%	0.222	C	C	.	.	S	Bend	trans	-105.4	143.4	176.2	66.3	0	0	0	0	110.7	C93 G94 K95 S99 Q100	C93-S97 VanDerWaalsContact CB-OG 3.3Å; C93-S97 WeakPolarHBondContact CB-OG 3.44Å; C93-S97 PolarHBondContact SG-OG 3.36Å; G94-S97 PolarHBondContact O-N 3.35Å; G94-S97 VanDerWaalsContact O-N 3.1Å; G94-S97 PolarHBondContact O-OG 3.22Å; K95-S97 VanDerWaalsContact C-N 3.32Å; K95-S97 PolarHBondContact O-N 3.49Å; S97-S99 PolarHBondContact O-N 3.14Å; S97-S99 VanDerWaalsContact O-N 3.16Å; S97-Q100 WeakPolarHBondContact O-CG 3.3Å; S97-Q100 PolarHBondContact O-N 2.97Å; S97-Q100 PolarHBondContact OG-N 2.89Å
98	E	61.9	Low	81	Confident	187 Å²	187	50.3 Å²	50.3	87%	0.874	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.3	-33.5	-179.5	-61.1	-174.2	160.4	0	0	113.4
99	S	70.7	Confident	80.2	Confident	17 Å²	17	50.3 Å²	50.3	12%	0.119	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-18	-176	60.7	0	0	0	0	114.1	C93 S97 H101 K104	C93-S99 PolarHBondContact SG-OG 2.81Å; S97-S99 PolarHBondContact O-N 3.14Å; S97-S99 VanDerWaalsContact O-N 3.16Å; S99-H101 VanDerWaalsContact CB-CE1 3.42Å; S99-H101 WeakPolarHBondContact CB-CE1 3.4Å; S99-H101 PolarHBondContact O-N 3.27Å; S99-H101 PolarHBondContact OG-CE1 3.14Å; S99-H101 PolarHBondContact OG-ND1 3.26Å; S99-H101 VanDerWaalsContact OG-ND1 3.11Å; S99-K104 VanDerWaalsContact O-CD 3.26Å; S99-K104 WeakPolarHBondContact O-CD 3.34Å; S99-K104 WeakPolarHBondContact O-CE 3.25Å; S99-K104 PolarHBondContact O-NZ 2.83Å
100	Q	84.3	Confident	79.1	Confident	70 Å²	70	61 Å²	61	33%	0.327	29%	0.287	S	S	.	.			trans	38	46.7	176.6	-57.4	-170	-19.2	0	0	114.6	C93 K95 S97 S102 L103 K104	C93-Q100 CarbonylContact O-C 3.47Å; K95-Q100 PolarHBondContact O-NE2 3.08Å; S97-Q100 WeakPolarHBondContact O-CG 3.3Å; S97-Q100 PolarHBondContact O-N 2.97Å; S97-Q100 PolarHBondContact OG-N 2.89Å; Q100-S102 VanDerWaalsContact C-N 3.25Å; Q100-S102 PolarHBondContact O-N 3.36Å; Q100-L103 HydrophobicContact CB-CB 4.17Å; Q100-L103 PolarHBondContact O-N 2.94Å; Q100-K104 PolarHBondContact O-N 2.89Å
101	H	86.3	Confident	78	Confident	6 Å²	6	67.1 Å²	67.1	3%	0.028	32%	0.32	C	S	.	.	H	α-helix	trans	-62.8	-28.7	-171.2	-71.7	121.9	0	0	0	113.6	E64 C65 E68 C93 S99 H105	E64-H101 HydrophobicContact CB-CB 4.41Å; E64-H101 VanDerWaalsContact CB-CD2 3.45Å; E64-H101 WeakPolarHBondContact CB-CD2 3.26Å; C65-H101 PolarHBondContact SG-ND1 3.37Å; C65-H101 VanDerWaalsContact SG-ND1 3.4Å; E68-H101 IonicContact OE1-CD2 2.68Å; E68-H101 IonicContact OE1-CE1 2.95Å; E68-H101 IonicContact OE1-NE2 3.85Å; E68-H101 PolarHBondContact OE1-NE2 3.27Å; C93-H101 PolarHBondContact O-N 3.05Å; C93-H101 VanDerWaalsContact SG-CB 3.57Å; C93-H101 PolarHBondContact SG-N 3.23Å; C93-H101 PolarHBondContact SG-ND1 3.49Å; S99-H101 VanDerWaalsContact CB-CE1 3.42Å; S99-H101 WeakPolarHBondContact CB-CE1 3.4Å; S99-H101 PolarHBondContact O-N 3.27Å; S99-H101 PolarHBondContact OG-CE1 3.14Å; S99-H101 PolarHBondContact OG-ND1 3.26Å; S99-H101 VanDerWaalsContact OG-ND1 3.11Å; H101-H105 VanDerWaalsContact O-CB 3.26Å; H101-H105 WeakPolarHBondContact O-CB 3.49Å; H101-H105 PolarHBondContact O-N 3.39Å
102	S	86.9	Confident	77.3	Confident	3 Å²	3	71.2 Å²	71.2	2%	0.021	34%	0.339	C	S	.	.	H	α-helix	trans	-65.3	-38.6	172.6	66.2	0	0	0	0	112.3	C93 Q100 F106 Y128	C93-S102 WeakPolarHBondContact O-CB 3.31Å; C93-S102 PolarHBondContact O-N 3.28Å; C93-S102 PolarHBondContact O-OG 3.28Å; Q100-S102 VanDerWaalsContact C-N 3.25Å; Q100-S102 PolarHBondContact O-N 3.36Å; S102-F106 PolarHBondContact O-N 3.45Å; S102-Y128 PolarHBondContact OG-OH 2.76Å
103	L	85.5	Confident	77	Confident	26 Å²	26	73.5 Å²	73.5	14%	0.136	35%	0.354	C	S	.	.	H	α-helix	trans	-76.2	-38.2	178.2	-172.3	69.5	0	0	0	111.8	Q100 H105 F106 K107 Y128	Q100-L103 HydrophobicContact CB-CB 4.17Å; Q100-L103 PolarHBondContact O-N 2.94Å; L103-H105 VanDerWaalsContact C-N 3.31Å; L103-F106 HydrophobicContact CD1-CD1 4.25Å; L103-F106 PolarHBondContact O-N 3.28Å; L103-K107 HydrophobicContact CG-CD 4.26Å; L103-K107 WeakPolarHBondContact O-CB 3.49Å; L103-K107 WeakPolarHBondContact O-CG 3.32Å; L103-K107 PolarHBondContact O-N 2.8Å; L103-Y128 HydrophobicContact CD1-CD1 3.81Å; L103-Y128 HydrophobicContact CD1-CE1 3.6Å; L103-Y128 HydrophobicContact CD1-CE2 4.33Å; L103-Y128 HydrophobicContact CD1-CG 4.29Å; L103-Y128 PolarHBondContact N-OH 2.89Å
104	K	85.6	Confident	77.1	Confident	79 Å²	79	74.6 Å²	74.6	34%	0.343	36%	0.359	S	S	.	.	H	α-helix	trans	-60.6	-41.6	171.6	-73.1	176.4	177.3	160	0	111.5	E68 S99 Q100 K107 N108	E68-K104 IonicContact OE1-NZ 3.3Å; S99-K104 VanDerWaalsContact O-CD 3.26Å; S99-K104 WeakPolarHBondContact O-CD 3.34Å; S99-K104 WeakPolarHBondContact O-CE 3.25Å; S99-K104 PolarHBondContact O-NZ 2.83Å; Q100-K104 PolarHBondContact O-N 2.89Å; K104-K107 PolarHBondContact O-N 3.38Å; K104-N108 WeakPolarHBondContact O-CB 3.11Å; K104-N108 VanDerWaalsContact O-CG 3.27Å; K104-N108 PolarHBondContact O-N 3.28Å
105	H	87.8	Confident	77.4	Confident	35 Å²	35	74.6 Å²	74.6	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-50.8	176.5	178.4	77.3	0	0	0	111.5	C88 F90 H101 L103 K107 N108 S109 H114	C88-H105 PolarHBondContact SG-NE2 3.41Å; F90-H105 VanDerWaalsContact CB-CE1 3.46Å; F90-H105 WeakPolarHBondContact CB-CE1 3.38Å; F90-H105 HydrophobicContact CD1-CB 3.7Å; F90-H105 AromaticContact CD1-CD2 3.7Å; F90-H105 AromaticContact CD1-CE1 3.92Å; F90-H105 AromaticContact CD1-CG 3.36Å; F90-H105 AromaticContact CD1-ND1 3.52Å; F90-H105 AromaticContact CD2-ND1 3.78Å; F90-H105 HydrophobicContact CE1-CB 3.48Å; F90-H105 VanDerWaalsContact CE1-CB 3.48Å; F90-H105 AromaticContact CE1-CG 3.67Å; F90-H105 AromaticContact CE1-ND1 3.92Å; F90-H105 HydrophobicContact CG-CB 4.5Å; F90-H105 AromaticContact CG-CE1 3.54Å; F90-H105 AromaticContact CG-CG 3.79Å; F90-H105 AromaticContact CG-ND1 3.43Å; F90-H105 WeakPolarHBondContact CG-ND1 3.24Å; F90-H105 AromaticContact CG-NE2 3.94Å; F90-H105 HydrophobicContact CZ-CB 4.11Å; H101-H105 VanDerWaalsContact O-CB 3.26Å; H101-H105 WeakPolarHBondContact O-CB 3.49Å; H101-H105 PolarHBondContact O-N 3.39Å; L103-H105 VanDerWaalsContact C-N 3.31Å; H105-K107 PolarHBondContact O-N 3.17Å; H105-N108 PolarHBondContact O-N 3.25Å; H105-S109 PolarHBondContact O-N 3.23Å; H105-S109 PolarHBondContact O-OG 3.28Å; H105-H114 AromaticContact CD2-ND1 3.84Å; H105-H114 AromaticContact CE1-ND1 3.51Å; H105-H114 AromaticContact NE2-CE1 3.82Å; H105-H114 AromaticContact NE2-CG 3.86Å; H105-H114 AromaticContact NE2-ND1 2.89Å; H105-H114 PolarHBondContact NE2-ND1 2.7Å
106	F	86.1	Confident	78.5	Confident	46 Å²	46	70.8 Å²	70.8	20%	0.202	34%	0.343	C	S	.	.	H	α-helix	trans	-55.3	-50.6	173.7	166.7	-119	0	0	0	112.4	S102 L103 N108 S109 C115 Y128 E129	S102-F106 PolarHBondContact O-N 3.45Å; L103-F106 HydrophobicContact CD1-CD1 4.25Å; L103-F106 PolarHBondContact O-N 3.28Å; F106-N108 PolarHBondContact O-N 2.81Å; F106-S109 PolarHBondContact O-N 2.81Å; F106-C115 HydrophobicContact CD2-CB 4.03Å; F106-C115 HydrophobicContact CE2-CB 3.68Å; F106-Y128 HydrophobicContact CB-CD2 3.59Å; F106-Y128 HydrophobicContact CB-CE2 3.92Å; F106-Y128 HydrophobicContact CB-CG 4.5Å; F106-Y128 AromaticContact CD1-CD2 3.78Å; F106-Y128 HydrophobicContact CD1-CD2 3.78Å; F106-Y128 AromaticContact CD1-CG 3.84Å; F106-Y128 HydrophobicContact CD1-CG 3.84Å; F106-Y128 HydrophobicContact CD2-CD2 4.36Å; F106-Y128 HydrophobicContact CE1-CG 4.28Å; F106-Y128 AromaticContact CG-CD2 3.64Å; F106-Y128 HydrophobicContact CG-CD2 3.64Å; F106-Y128 HydrophobicContact CG-CE2 4.43Å; F106-Y128 HydrophobicContact CG-CG 4.14Å; F106-E129 HydrophobicContact CE2-CG 3.85Å; F106-E129 HydrophobicContact CZ-CG 3.71Å
107	K	83.6	Confident	79.7	Confident	132 Å²	132	63.7 Å²	63.7	57%	0.574	31%	0.305	S	S	*	.	H	α-helix	trans	-64	-21.8	-179.3	-72.2	176.1	176.9	179.5	0	114.6	L103 K104 H105	L103-K107 HydrophobicContact CG-CD 4.26Å; L103-K107 WeakPolarHBondContact O-CB 3.49Å; L103-K107 WeakPolarHBondContact O-CG 3.32Å; L103-K107 PolarHBondContact O-N 2.8Å; K104-K107 PolarHBondContact O-N 3.38Å; H105-K107 PolarHBondContact O-N 3.17Å
108	N	81.6	Confident	80.8	Confident	121 Å²	121	62.6 Å²	62.6	65%	0.647	30%	0.297	S	S	*	.	H	α-helix	trans	-94.4	-21.4	-179.5	-73.2	-7.2	0	0	0	113.6	K104 H105 F106 R110	K104-N108 WeakPolarHBondContact O-CB 3.11Å; K104-N108 VanDerWaalsContact O-CG 3.27Å; K104-N108 PolarHBondContact O-N 3.28Å; H105-N108 PolarHBondContact O-N 3.25Å; F106-N108 PolarHBondContact O-N 2.81Å; N108-R110 VanDerWaalsContact C-N 3.26Å; N108-R110 PolarHBondContact O-N 3.06Å
109	S	72.4	Confident	81.9	Confident	33 Å²	33	53.8 Å²	53.8	23%	0.231	26%	0.256	C	S	.	.			trans	-75.3	67.7	178.7	-70.3	0	0	0	0	112.8	H105 F106 I111 H114	H105-S109 PolarHBondContact O-N 3.23Å; H105-S109 PolarHBondContact O-OG 3.28Å; F106-S109 PolarHBondContact O-N 2.81Å; S109-I111 PolarHBondContact O-N 2.04Å; S109-I111 VanDerWaalsContact O-N 3.1Å; S109-H114 VanDerWaalsContact OG-CG 3.3Å; S109-H114 PolarHBondContact OG-ND1 2.81Å
110	R	61.3	Low	82.5	Confident	226 Å²	226	53.5 Å²	53.5	85%	0.853	25%	0.253	S	S	*	.			trans	-73.7	5.5	-175.3	-59.4	-172.1	-176.4	-152.1	2.2	115.9	N108	N108-R110 VanDerWaalsContact C-N 3.26Å; N108-R110 PolarHBondContact O-N 3.06Å
111	I	66.3	Low	82.1	Confident	166 Å²	166	53.4 Å²	53.4	85%	0.851	26%	0.26	S	S	*	.	S	Bend	trans	-123.3	-31.1	-172.3	-56.2	178.4	0	0	0	112.2	S109	S109-I111 PolarHBondContact O-N 2.04Å; S109-I111 VanDerWaalsContact O-N 3.1Å
112	E	73.7	Confident	81.8	Confident	93 Å²	93	56.8 Å²	56.8	44%	0.435	28%	0.281	S	S	.	.	S	Bend	trans	-134.4	144.1	177.1	-71.6	-161.1	-120.8	0	0	111	K87 H114	K87-E112 WeakPolarHBondContact CE-OE2 3.38Å; K87-E112 IonicContact NZ-OE2 2.8Å; K87-E112 PolarHBondContact NZ-OE2 2.94Å; E112-H114 PolarHBondContact O-CD2 3.23Å; E112-H114 PolarHBondContact O-N 3.12Å
113	P	78.8	Confident	81.7	Confident	47 Å²	47	60 Å²	60	31%	0.305	29%	0.293	S	S	.	.			trans	-71.4	101.6	-177	28.6	-34.8	0	0	0	111.1	H43 A44 C115	H43-P113 HydrophobicContact CB-CG 4.29Å; A44-P113 WeakPolarHBondContact CA-O 3.43Å; A44-P113 HydrophobicContact CB-CB 4.35Å; A44-P113 VanDerWaalsContact CB-O 3.26Å; A44-P113 WeakPolarHBondContact CB-O 3.37Å; P113-C115 VanDerWaalsContact C-N 3.3Å
114	H	88.1	Confident	81.6	Confident	23 Å²	23	61.3 Å²	61.3	11%	0.106	30%	0.3	C	S	.	.			trans	-97.4	32.2	176.3	-76.6	-141	0	0	0	111.7	K87 C88 H105 S109 E112	K87-H114 VanDerWaalsContact CG-CD2 3.46Å; K87-H114 WeakPolarHBondContact CG-CD2 3.48Å; C88-H114 VanDerWaalsContact SG-CE1 3.52Å; H105-H114 AromaticContact CD2-ND1 3.84Å; H105-H114 AromaticContact CE1-ND1 3.51Å; H105-H114 AromaticContact NE2-CE1 3.82Å; H105-H114 AromaticContact NE2-CG 3.86Å; H105-H114 AromaticContact NE2-ND1 2.89Å; H105-H114 PolarHBondContact NE2-ND1 2.7Å; S109-H114 VanDerWaalsContact OG-CG 3.3Å; S109-H114 PolarHBondContact OG-ND1 2.81Å; E112-H114 PolarHBondContact O-CD2 3.23Å; E112-H114 PolarHBondContact O-N 3.12Å
115	C	87.1	Confident	81.7	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.284	C	S	.	.			trans	-81.8	-20.1	-168.2	64.1	0	0	0	0	115.2	H40 A44 F106 P113 C127 Y128 E129	H40-C115 VanDerWaalsContact CB-SG 3.57Å; A44-C115 WeakPolarHBondContact CB-SG 3.46Å; F106-C115 HydrophobicContact CD2-CB 4.03Å; F106-C115 HydrophobicContact CE2-CB 3.68Å; P113-C115 VanDerWaalsContact C-N 3.3Å; C115-C127 CarbonylContact O-C 3.49Å; C115-C127 WeakPolarHBondContact O-CA 3.41Å; C115-Y128 PolarHBondContact O-N 2.93Å; C115-E129 HydrophobicContact CB-CB 4.14Å; C115-E129 HydrophobicContact CB-CG 3.58Å; C115-E129 VanDerWaalsContact CB-OE2 3.31Å; C115-E129 WeakPolarHBondContact CB-OE2 3.49Å; C115-E129 PolarHBondContact SG-OE2 2.75Å
116	I	88.9	Confident	81.7	Confident	0 Å²	0	58.8 Å²	58.8	0%	0	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	125.8	-179.5	-58.6	-179.2	0	0	0	111	H40 V41 A44 I45 L86 I125 W126 C127 L134	H40-I116 HydrophobicContact CB-CD1 4.22Å; V41-I116 HydrophobicContact CB-CD1 4.25Å; V41-I116 HydrophobicContact CG2-CD1 3.67Å; A44-I116 HydrophobicContact CB-CB 4.21Å; A44-I116 HydrophobicContact CB-CD1 4.02Å; A44-I116 HydrophobicContact CB-CG1 3.88Å; I45-I116 HydrophobicContact CD1-CD1 4.45Å; I45-I116 HydrophobicContact CG1-CD1 4.36Å; L86-I116 HydrophobicContact CB-CG2 4.38Å; L86-I116 HydrophobicContact CD1-CG2 3.79Å; L86-I116 HydrophobicContact CG-CG2 4.22Å; L86-I116 PolarHBondContact N-O 3.5Å; I116-I125 HydrophobicContact CG2-CG2 3.84Å; I116-W126 WeakPolarHBondContact CA-O 3.43Å; I116-C127 HydrophobicContact CG1-CB 4.25Å; I116-L134 HydrophobicContact CD1-CD1 4.01Å; I116-L134 HydrophobicContact CG1-CD1 4.36Å; I116-L134 HydrophobicContact CG2-CD1 4.2Å
117	I	90.1	Very high	81.9	Confident	4 Å²	4	56.6 Å²	56.6	2%	0.021	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	154.7	-179.8	59.3	171.9	0	0	0	111	W83 L84 C85 I125 W126 Y128	W83-I117 HydrophobicContact CB-CB 4.39Å; W83-I117 HydrophobicContact CB-CD1 4.03Å; W83-I117 HydrophobicContact CD2-CD1 3.72Å; W83-I117 HydrophobicContact CD2-CG1 4.38Å; W83-I117 HydrophobicContact CE3-CB 4.18Å; W83-I117 HydrophobicContact CE3-CD1 3.38Å; W83-I117 HydrophobicContact CE3-CG1 3.58Å; W83-I117 HydrophobicContact CG-CD1 4.03Å; W83-I117 HydrophobicContact CZ3-CD1 4.04Å; W83-I117 HydrophobicContact CZ3-CG1 4.11Å; L84-I117 CarbonylContact O-C 3.57Å; L84-I117 VanDerWaalsContact O-CA 3.26Å; L84-I117 WeakPolarHBondContact O-CA 3.22Å; C85-I117 HydrophobicContact CB-CG2 4.46Å; I117-I125 WeakPolarHBondContact O-CA 3.41Å; I117-I125 WeakPolarHBondContact O-CG2 3.46Å; I117-W126 HydrophobicContact CD1-CB 4.3Å; I117-W126 HydrophobicContact CG1-CB 3.9Å; I117-W126 PolarHBondContact N-O 3.32Å; I117-W126 PolarHBondContact O-N 2.86Å; I117-Y128 HydrophobicContact CD1-CD2 4.37Å; I117-Y128 HydrophobicContact CD1-CE1 4.09Å; I117-Y128 HydrophobicContact CD1-CE2 3.61Å; I117-Y128 VanDerWaalsContact CD1-CZ 3.44Å; I117-Y128 WeakPolarHBondContact CD1-OH 3.25Å; I117-Y128 HydrophobicContact CG1-CE2 4.35Å; I117-Y128 HydrophobicContact CG2-CE2 4.1Å
118	I	89.4	Confident	82	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	137.1	170.4	-170.7	168	0	0	0	111.1	W83 L84 L86 L120 W123 I124 I125 V147 L150	W83-I118 CarbonylContact C-O 3.55Å; W83-I118 WeakPolarHBondContact CA-O 3.02Å; L84-I118 HydrophobicContact CB-CG2 3.9Å; L84-I118 HydrophobicContact CD2-CG2 3.98Å; L84-I118 HydrophobicContact CG-CG2 4.41Å; L84-I118 PolarHBondContact N-O 2.83Å; L84-I118 PolarHBondContact O-N 2.91Å; L86-I118 HydrophobicContact CD2-CB 4.14Å; L86-I118 HydrophobicContact CD2-CG2 3.51Å; L86-I118 HydrophobicContact CG-CG2 4.36Å; I118-L120 HydrophobicContact CG2-CD2 4.41Å; I118-W123 HydrophobicContact CD1-CE3 3.9Å; I118-I124 WeakPolarHBondContact CA-O 3.33Å; I118-I125 HydrophobicContact CB-CG1 4.38Å; I118-I125 HydrophobicContact CD1-CD1 4.22Å; I118-I125 HydrophobicContact CD1-CG1 3.89Å; I118-I125 HydrophobicContact CG1-CG1 3.95Å; I118-V147 HydrophobicContact CD1-CG2 3.8Å; I118-L150 HydrophobicContact CG2-CD1 3.98Å
119	N	85.8	Confident	82.2	Confident	3 Å²	3	49.8 Å²	49.8	2%	0.016	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	124.4	173.4	-168.2	-60.3	0	0	0	110.2	D81 W83 S121 T122 W123 I124	D81-N119 PolarHBondContact OD1-ND2 3.35Å; W83-N119 HydrophobicContact CD2-CB 3.98Å; W83-N119 VanDerWaalsContact CE2-ND2 3.28Å; W83-N119 HydrophobicContact CE3-CB 3.8Å; W83-N119 HydrophobicContact CH2-CB 3.89Å; W83-N119 HydrophobicContact CZ2-CB 4.02Å; W83-N119 WeakPolarHBondContact CZ2-ND2 3.21Å; W83-N119 HydrophobicContact CZ3-CB 3.76Å; N119-S121 VanDerWaalsContact C-N 3.3Å; N119-S121 PolarHBondContact O-N 3.44Å; N119-S121 WeakPolarHBondContact OD1-CA 3.21Å; N119-S121 WeakPolarHBondContact OD1-CB 3.4Å; N119-S121 PolarHBondContact OD1-N 2.8Å; N119-T122 VanDerWaalsContact CB-OG1 3.25Å; N119-T122 WeakPolarHBondContact CB-OG1 3.31Å; N119-T122 PolarHBondContact ND2-OG1 3.41Å; N119-T122 PolarHBondContact OD1-N 3.34Å; N119-T122 PolarHBondContact OD1-OG1 2.75Å; N119-W123 WeakPolarHBondContact O-CA 3.48Å; N119-W123 PolarHBondContact O-N 3.44Å; N119-I124 HydrophobicContact CB-CB 4.35Å; N119-I124 PolarHBondContact N-O 2.71Å
120	L	82.8	Confident	82.8	Confident	11 Å²	11	50.6 Å²	50.6	6%	0.058	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.1	-15.5	-176.8	-62.4	-175	0	0	0	113.8	W59 I82 L84 Q91 I118	W59-L120 HydrophobicContact CH2-CD1 4.4Å; W59-L120 HydrophobicContact CH2-CD2 3.68Å; W59-L120 HydrophobicContact CZ2-CD1 4.26Å; W59-L120 HydrophobicContact CZ2-CD2 3.89Å; W59-L120 HydrophobicContact CZ2-CG 4.48Å; W59-L120 HydrophobicContact CZ3-CD2 4.41Å; I82-L120 HydrophobicContact CG2-CD1 3.9Å; I82-L120 HydrophobicContact CG2-CG 4.48Å; I82-L120 PolarHBondContact O-N 2.87Å; L84-L120 HydrophobicContact CB-CD1 4.35Å; L84-L120 HydrophobicContact CB-CD2 3.79Å; L84-L120 HydrophobicContact CB-CG 4.13Å; L84-L120 HydrophobicContact CD2-CD2 4.11Å; Q91-L120 HydrophobicContact CG-CD1 4.44Å; I118-L120 HydrophobicContact CG2-CD2 4.41Å
121	S	75.8	Confident	83.8	Confident	68 Å²	68	43.9 Å²	43.9	48%	0.476	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95	-42.2	178.7	-55.8	0	0	0	0	111.9	S80 N119	S80-S121 PolarHBondContact O-OG 3.3Å; N119-S121 VanDerWaalsContact C-N 3.3Å; N119-S121 PolarHBondContact O-N 3.44Å; N119-S121 WeakPolarHBondContact OD1-CA 3.21Å; N119-S121 WeakPolarHBondContact OD1-CB 3.4Å; N119-S121 PolarHBondContact OD1-N 2.8Å
122	T	80.2	Confident	84.6	Confident	77 Å²	77	40.2 Å²	40.2	47%	0.472	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-7.5	-173.9	65.3	0	0	0	0	114.6	N119 I124	N119-T122 VanDerWaalsContact CB-OG1 3.25Å; N119-T122 WeakPolarHBondContact CB-OG1 3.31Å; N119-T122 PolarHBondContact ND2-OG1 3.41Å; N119-T122 PolarHBondContact OD1-N 3.34Å; N119-T122 PolarHBondContact OD1-OG1 2.75Å; T122-I124 PolarHBondContact O-N 3.3Å; T122-I124 WeakPolarHBondContact OG1-CG1 3.47Å
123	W	84	Confident	85	Confident	70 Å²	70	42.1 Å²	42.1	27%	0.265	22%	0.215	S	C	.	.			trans	58.3	12.7	-175	-55.1	97.3	0	0	0	115.1	W59 I118 N119 L150 Q151 A154	W59-W123 HydrophobicContact CH2-CH2 4.49Å; W59-W123 HydrophobicContact CZ2-CH2 4.24Å; I118-W123 HydrophobicContact CD1-CE3 3.9Å; N119-W123 WeakPolarHBondContact O-CA 3.48Å; N119-W123 PolarHBondContact O-N 3.44Å; W123-L150 HydrophobicContact CH2-CB 4.23Å; W123-L150 HydrophobicContact CZ3-CB 3.72Å; W123-Q151 HydrophobicContact CD2-CG 3.82Å; W123-Q151 HydrophobicContact CE3-CG 3.74Å; W123-Q151 HydrophobicContact CH2-CB 4.33Å; W123-Q151 HydrophobicContact CH2-CG 3.66Å; W123-Q151 HydrophobicContact CZ2-CG 3.72Å; W123-Q151 HydrophobicContact CZ3-CG 3.67Å; W123-A154 HydrophobicContact CH2-CB 4.12Å; W123-A154 HydrophobicContact CZ2-CB 4.16Å
124	I	84.2	Confident	85.2	Confident	54 Å²	54	40.5 Å²	40.5	28%	0.277	20%	0.204	S	C	.	.			trans	-68.2	130.6	174	-67	175.9	0	0	0	109.5	W83 I118 N119 T122 K133	W83-I124 HydrophobicContact CH2-CB 4.43Å; W83-I124 HydrophobicContact CH2-CG2 4.08Å; W83-I124 HydrophobicContact CZ3-CG2 4.43Å; W83-I124 WeakPolarHBondContact CZ3-O 3.26Å; I118-I124 WeakPolarHBondContact CA-O 3.33Å; N119-I124 HydrophobicContact CB-CB 4.35Å; N119-I124 PolarHBondContact N-O 2.71Å; T122-I124 PolarHBondContact O-N 3.3Å; T122-I124 WeakPolarHBondContact OG1-CG1 3.47Å; I124-K133 HydrophobicContact CG2-CD 3.99Å; I124-K133 HydrophobicContact CG2-CG 4.04Å
125	I	87.9	Confident	84.2	Confident	2 Å²	2	42.2 Å²	42.2	1%	0.01	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	132.8	175.7	-48.1	-175.6	0	0	0	108.4	L86 I116 I117 I118 K133 L134 T136 L143 V147	L86-I125 HydrophobicContact CD1-CG2 4.43Å; I116-I125 HydrophobicContact CG2-CG2 3.84Å; I117-I125 WeakPolarHBondContact O-CA 3.41Å; I117-I125 WeakPolarHBondContact O-CG2 3.46Å; I118-I125 HydrophobicContact CB-CG1 4.38Å; I118-I125 HydrophobicContact CD1-CD1 4.22Å; I118-I125 HydrophobicContact CD1-CG1 3.89Å; I118-I125 HydrophobicContact CG1-CG1 3.95Å; I125-K133 CarbonylContact O-C 3.59Å; I125-K133 WeakPolarHBondContact O-CA 3.06Å; I125-L134 HydrophobicContact CB-CB 4.17Å; I125-L134 HydrophobicContact CG2-CB 4.09Å; I125-L134 HydrophobicContact CG2-CD1 4.04Å; I125-L134 HydrophobicContact CG2-CG 4.3Å; I125-L134 PolarHBondContact O-N 3.01Å; I125-T136 HydrophobicContact CD1-CG2 4.22Å; I125-L143 HydrophobicContact CD1-CD2 3.92Å; I125-L143 HydrophobicContact CG2-CD2 4.36Å; I125-V147 HydrophobicContact CD1-CG2 3.77Å
126	W	87.9	Confident	82.8	Confident	59 Å²	59	45.2 Å²	45.2	22%	0.223	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	144.5	-178.9	-165.9	-90.4	0	0	0	110.6	W83 I116 I117 Y128 D131 K133	W83-W126 HydrophobicContact CH2-CB 4.3Å; W83-W126 HydrophobicContact CZ3-CB 3.81Å; I116-W126 WeakPolarHBondContact CA-O 3.43Å; I117-W126 HydrophobicContact CD1-CB 4.3Å; I117-W126 HydrophobicContact CG1-CB 3.9Å; I117-W126 PolarHBondContact N-O 3.32Å; I117-W126 PolarHBondContact O-N 2.86Å; W126-Y128 AromaticContact CD1-CD1 3.85Å; W126-D131 WeakPolarHBondContact CH2-O 3.44Å; W126-D131 HydrophobicContact CZ2-CB 4.32Å; W126-D131 WeakPolarHBondContact CZ2-O 3.23Å; W126-D131 WeakPolarHBondContact CZ2-OD1 3.28Å; W126-D131 PolarHBondContact NE1-OD1 3.33Å; W126-K133 HydrophobicContact CE3-CB 3.93Å; W126-K133 HydrophobicContact CZ3-CB 3.91Å
127	C	89.6	Confident	81.2	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	118.1	168	-176.6	0	0	0	0	109.9	C38 H40 C115 I116 E129 C130 D131 E132 L134	C38-C127 VanDerWaalsContact SG-SG 3.66Å; H40-C127 PolarHBondContact ND1-SG 3.03Å; H40-C127 VanDerWaalsContact ND1-SG 3.39Å; C115-C127 CarbonylContact O-C 3.49Å; C115-C127 WeakPolarHBondContact O-CA 3.41Å; I116-C127 HydrophobicContact CG1-CB 4.25Å; C127-E129 VanDerWaalsContact C-N 3.26Å; C127-E129 PolarHBondContact O-N 2.89Å; C127-C130 HydrophobicContact CB-CB 4.24Å; C127-C130 PolarHBondContact O-N 3.31Å; C127-D131 WeakPolarHBondContact O-CA 3.3Å; C127-D131 PolarHBondContact O-N 2.84Å; C127-E132 PolarHBondContact N-O 2.98Å; C127-E132 PolarHBondContact O-N 2.71Å; C127-L134 HydrophobicContact CB-CD1 4.28Å; C127-L134 HydrophobicContact CB-CD2 4.07Å; C127-L134 HydrophobicContact CB-CG 4.28Å
128	Y	86.4	Confident	79.3	Confident	19 Å²	19	54.4 Å²	54.4	8%	0.075	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-19.1	178	-74.1	-51.9	0	0	0	114.5	S102 L103 F106 C115 I117 W126	S102-Y128 PolarHBondContact OG-OH 2.76Å; L103-Y128 HydrophobicContact CD1-CD1 3.81Å; L103-Y128 HydrophobicContact CD1-CE1 3.6Å; L103-Y128 HydrophobicContact CD1-CE2 4.33Å; L103-Y128 HydrophobicContact CD1-CG 4.29Å; L103-Y128 PolarHBondContact N-OH 2.89Å; F106-Y128 HydrophobicContact CB-CD2 3.59Å; F106-Y128 HydrophobicContact CB-CE2 3.92Å; F106-Y128 HydrophobicContact CB-CG 4.5Å; F106-Y128 AromaticContact CD1-CD2 3.78Å; F106-Y128 HydrophobicContact CD1-CD2 3.78Å; F106-Y128 AromaticContact CD1-CG 3.84Å; F106-Y128 HydrophobicContact CD1-CG 3.84Å; F106-Y128 HydrophobicContact CD2-CD2 4.36Å; F106-Y128 HydrophobicContact CE1-CG 4.28Å; F106-Y128 AromaticContact CG-CD2 3.64Å; F106-Y128 HydrophobicContact CG-CD2 3.64Å; F106-Y128 HydrophobicContact CG-CE2 4.43Å; F106-Y128 HydrophobicContact CG-CG 4.14Å; C115-Y128 PolarHBondContact O-N 2.93Å; I117-Y128 HydrophobicContact CD1-CD2 4.37Å; I117-Y128 HydrophobicContact CD1-CE1 4.09Å; I117-Y128 HydrophobicContact CD1-CE2 3.61Å; I117-Y128 VanDerWaalsContact CD1-CZ 3.44Å; I117-Y128 WeakPolarHBondContact CD1-OH 3.25Å; I117-Y128 HydrophobicContact CG1-CE2 4.35Å; I117-Y128 HydrophobicContact CG2-CE2 4.1Å; W126-Y128 AromaticContact CD1-CD1 3.85Å
129	E	85.2	Confident	77.7	Confident	90 Å²	90	56.9 Å²	56.9	42%	0.421	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-24.5	179.4	-74.6	166.4	177.2	0	0	112.5	H40 F106 C115 C127	H40-E129 IonicContact CD2-OE2 3.69Å; H40-E129 PolarHBondContact CD2-OE2 3.02Å; H40-E129 VanDerWaalsContact CD2-OE2 3.25Å; H40-E129 IonicContact CE1-OE2 3.49Å; H40-E129 IonicContact CG-OE2 3.54Å; H40-E129 IonicContact ND1-OE2 2.68Å; H40-E129 IonicContact NE2-OE2 3.88Å; F106-E129 HydrophobicContact CE2-CG 3.85Å; F106-E129 HydrophobicContact CZ-CG 3.71Å; C115-E129 HydrophobicContact CB-CB 4.14Å; C115-E129 HydrophobicContact CB-CG 3.58Å; C115-E129 VanDerWaalsContact CB-OE2 3.31Å; C115-E129 WeakPolarHBondContact CB-OE2 3.49Å; C115-E129 PolarHBondContact SG-OE2 2.75Å; C127-E129 VanDerWaalsContact C-N 3.26Å; C127-E129 PolarHBondContact O-N 2.89Å
130	C	84.5	Confident	76.4	Confident	50 Å²	50	65.5 Å²	65.5	34%	0.338	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.9	-15.7	168.3	-56.8	0	0	0	0	112.6	H40 C127 E132	H40-C130 VanDerWaalsContact CE1-SG 3.6Å; C127-C130 HydrophobicContact CB-CB 4.24Å; C127-C130 PolarHBondContact O-N 3.31Å; C130-E132 HydrophobicContact CB-CB 4.05Å; C130-E132 HydrophobicContact CB-CG 4.4Å; C130-E132 PolarHBondContact O-N 3.21Å
131	D	83.1	Confident	75.8	Confident	86 Å²	86	72.3 Å²	72.3	46%	0.46	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	39.6	42.3	-159.1	-143.2	42.6	0	0	0	114.2	K95 W126 C127	K95-D131 VanDerWaalsContact NZ-CG 3.31Å; K95-D131 IonicContact NZ-OD1 3.83Å; K95-D131 PolarHBondContact NZ-OD1 2.8Å; K95-D131 IonicContact NZ-OD2 3.14Å; K95-D131 PolarHBondContact NZ-OD2 2.89Å; W126-D131 WeakPolarHBondContact CH2-O 3.44Å; W126-D131 HydrophobicContact CZ2-CB 4.32Å; W126-D131 WeakPolarHBondContact CZ2-O 3.23Å; W126-D131 WeakPolarHBondContact CZ2-OD1 3.28Å; W126-D131 PolarHBondContact NE1-OD1 3.33Å; C127-D131 WeakPolarHBondContact O-CA 3.3Å; C127-D131 PolarHBondContact O-N 2.84Å
132	E	83.8	Confident	75.7	Confident	88 Å²	88	72.2 Å²	72.2	41%	0.411	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	153.4	-178.5	-79.8	-175.9	160.1	0	0	112.8	C127 C130	C127-E132 PolarHBondContact N-O 2.98Å; C127-E132 PolarHBondContact O-N 2.71Å; C130-E132 HydrophobicContact CB-CB 4.05Å; C130-E132 HydrophobicContact CB-CG 4.4Å; C130-E132 PolarHBondContact O-N 3.21Å
133	K	82.2	Confident	75.6	Confident	134 Å²	134	68.6 Å²	68.6	58%	0.583	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.2	169.8	174.5	174.9	175	-177.4	0	110.3	I124 I125 W126	I124-K133 HydrophobicContact CG2-CD 3.99Å; I124-K133 HydrophobicContact CG2-CG 4.04Å; I125-K133 CarbonylContact O-C 3.59Å; I125-K133 WeakPolarHBondContact O-CA 3.06Å; W126-K133 HydrophobicContact CE3-CB 3.93Å; W126-K133 HydrophobicContact CZ3-CB 3.91Å
134	L	81.6	Confident	75.3	Confident	13 Å²	13	67.6 Å²	67.6	7%	0.068	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	131	178	-52.4	-171.4	0	0	0	111	C38 V41 I116 I125 C127	C38-L134 HydrophobicContact CB-CD1 4.18Å; C38-L134 HydrophobicContact CB-CD2 3.4Å; C38-L134 VanDerWaalsContact CB-CD2 3.4Å; C38-L134 HydrophobicContact CB-CG 4.45Å; V41-L134 HydrophobicContact CG2-CD1 3.93Å; I116-L134 HydrophobicContact CD1-CD1 4.01Å; I116-L134 HydrophobicContact CG1-CD1 4.36Å; I116-L134 HydrophobicContact CG2-CD1 4.2Å; I125-L134 HydrophobicContact CB-CB 4.17Å; I125-L134 HydrophobicContact CG2-CB 4.09Å; I125-L134 HydrophobicContact CG2-CD1 4.04Å; I125-L134 HydrophobicContact CG2-CG 4.3Å; I125-L134 PolarHBondContact O-N 3.01Å; C127-L134 HydrophobicContact CB-CD1 4.28Å; C127-L134 HydrophobicContact CB-CD2 4.07Å; C127-L134 HydrophobicContact CB-CG 4.28Å
135	S	67	Low	75.2	Confident	58 Å²	58	70.6 Å²	70.6	41%	0.406	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-76.1	135.7	170	178.5	0	0	0	0	110.7	H137 C138	S135-H137 PolarHBondContact O-N 3.21Å; S135-H137 PolarHBondContact OG-N 2.89Å; S135-C138 PolarHBondContact O-N 3.01Å; S135-C138 PolarHBondContact O-SG 2.86Å
136	T	59	Low	74.9	Confident	63 Å²	63	70.5 Å²	70.5	39%	0.387	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-18.4	173.5	47	0	0	0	0	113.2	I125	I125-T136 HydrophobicContact CD1-CG2 4.22Å
137	H	54.4	Low	74.7	Confident	152 Å²	152	68.4 Å²	68.4	70%	0.704	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.3	-20.7	-176.4	-62.3	-94.1	0	0	0	114	S135	S135-H137 PolarHBondContact O-N 3.21Å; S135-H137 PolarHBondContact OG-N 2.89Å
138	C	50.6	Low	74.2	Confident	46 Å²	46	71.9 Å²	71.9	31%	0.311	37%	0.368	S	S	.	.	S	Bend	trans	-89.5	-5.3	-170	66.6	0	0	0	0	115.6	T37 S135	T37-C138 HydrophobicContact CG2-CB 4.38Å; T37-C138 WeakPolarHBondContact CG2-O 3.4Å; S135-C138 PolarHBondContact O-N 3.01Å; S135-C138 PolarHBondContact O-SG 2.86Å
139	N	55.4	Low	74.1	Confident	51 Å²	51	73.7 Å²	73.7	27%	0.273	38%	0.377	S	S	.	.	S	Bend	trans	-137.2	89.7	175.3	-113.6	-51.2	0	0	0	112.2	V41 K141 L143	V41-N139 HydrophobicContact CG1-CB 3.99Å; N139-K141 VanDerWaalsContact C-N 3.34Å; N139-K141 PolarHBondContact O-N 3.47Å; N139-L143 HydrophobicContact CB-CD1 3.9Å
140	K	59.5	Low	74	Confident	185 Å²	185	69.4 Å²	69.4	80%	0.804	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.9	3.8	-144	-66.5	-176.1	176.5	177.8	0	119.2
141	K	68.9	Low	73.7	Confident	154 Å²	154	70.9 Å²	70.9	67%	0.67	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.6	-60.8	178.8	-67.8	-171.2	-179.7	179.1	0	115.2	N139 L143 A144 Q145	N139-K141 VanDerWaalsContact C-N 3.34Å; N139-K141 PolarHBondContact O-N 3.47Å; K141-L143 PolarHBondContact O-N 3.36Å; K141-A144 PolarHBondContact O-N 3.02Å; K141-Q145 WeakPolarHBondContact O-CB 3.5Å; K141-Q145 VanDerWaalsContact O-CG 3.29Å; K141-Q145 WeakPolarHBondContact O-CG 3.42Å; K141-Q145 PolarHBondContact O-N 3.25Å
142	V	74.3	Confident	73.4	Confident	66 Å²	66	72.5 Å²	72.5	40%	0.4	36%	0.362	S	S	.	.	H	α-helix	trans	-65.8	-42.8	-168.6	-176.6	0	0	0	0	112.6	I45 V47 Q145 I146	I45-V142 HydrophobicContact CG2-CG1 3.89Å; V47-V142 HydrophobicContact CG2-CG1 4.15Å; V142-Q145 PolarHBondContact O-N 3.4Å; V142-I146 PolarHBondContact O-N 3.25Å
143	L	78.2	Confident	72.9	Confident	1 Å²	1	69.8 Å²	69.8	1%	0.005	35%	0.349	C	S	.	.	H	α-helix	trans	-64.4	-45	176.4	-77.8	170.5	0	0	0	111.8	V41 I45 L86 I125 N139 K141 Q145 I146 V147	V41-L143 HydrophobicContact CG1-CD1 3.93Å; V41-L143 HydrophobicContact CG1-CG 4.08Å; V41-L143 HydrophobicContact CG2-CD1 4.03Å; I45-L143 HydrophobicContact CD1-CD2 3.48Å; I45-L143 VanDerWaalsContact CD1-CD2 3.48Å; I45-L143 HydrophobicContact CD1-CG 3.95Å; L86-L143 HydrophobicContact CD1-CD2 3.92Å; I125-L143 HydrophobicContact CD1-CD2 3.92Å; I125-L143 HydrophobicContact CG2-CD2 4.36Å; N139-L143 HydrophobicContact CB-CD1 3.9Å; K141-L143 PolarHBondContact O-N 3.36Å; L143-Q145 PolarHBondContact O-N 3.02Å; L143-I146 WeakPolarHBondContact O-CG2 3.37Å; L143-I146 PolarHBondContact O-N 3.39Å; L143-V147 WeakPolarHBondContact O-CB 3.24Å; L143-V147 VanDerWaalsContact O-CG2 3.23Å; L143-V147 WeakPolarHBondContact O-CG2 3.38Å; L143-V147 PolarHBondContact O-N 2.81Å
144	A	78	Confident	72.3	Confident	48 Å²	48	63.8 Å²	63.8	40%	0.397	32%	0.324	S	S	.	.	H	α-helix	trans	-60.9	-44	176.6	0	0	0	0	0	112	K141 V147 D148	K141-A144 PolarHBondContact O-N 3.02Å; A144-V147 PolarHBondContact O-N 2.9Å; A144-D148 VanDerWaalsContact O-CB 3.26Å; A144-D148 WeakPolarHBondContact O-CB 3.3Å; A144-D148 PolarHBondContact O-N 2.95Å
145	Q	80.8	Confident	71.4	Confident	117 Å²	117	67.9 Å²	67.9	55%	0.547	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-39.3	178.2	-74.5	173.6	-5.6	0	0	113.3	K141 V142 L143 F149	K141-Q145 WeakPolarHBondContact O-CB 3.5Å; K141-Q145 VanDerWaalsContact O-CG 3.29Å; K141-Q145 WeakPolarHBondContact O-CG 3.42Å; K141-Q145 PolarHBondContact O-N 3.25Å; V142-Q145 PolarHBondContact O-N 3.4Å; L143-Q145 PolarHBondContact O-N 3.02Å; Q145-F149 VanDerWaalsContact O-CB 3.32Å; Q145-F149 WeakPolarHBondContact O-CB 3.39Å; Q145-F149 PolarHBondContact O-N 2.74Å; Q145-F149 VanDerWaalsContact O-N 3.08Å
146	I	82.6	Confident	71.1	Confident	1 Å²	1	72.7 Å²	72.7	1%	0.005	37%	0.368	C	S	.	.	H	α-helix	trans	-75.6	-37.7	179.1	-153.2	168.3	0	0	0	111.3	I45 V47 V50 L86 V142 L143 F149 L150	I45-I146 HydrophobicContact CG2-CD1 3.95Å; V47-I146 HydrophobicContact CB-CD1 4.46Å; V47-I146 HydrophobicContact CG2-CB 4.4Å; V47-I146 HydrophobicContact CG2-CD1 4.09Å; V47-I146 HydrophobicContact CG2-CG1 4.4Å; V50-I146 HydrophobicContact CB-CD1 4.08Å; V50-I146 HydrophobicContact CG1-CD1 4.03Å; V50-I146 HydrophobicContact CG1-CG1 4.42Å; V50-I146 HydrophobicContact CG2-CD1 4.07Å; L86-I146 HydrophobicContact CD1-CG2 4.15Å; L86-I146 HydrophobicContact CD2-CD1 4.2Å; L86-I146 HydrophobicContact CD2-CG2 4.45Å; V142-I146 PolarHBondContact O-N 3.25Å; L143-I146 WeakPolarHBondContact O-CG2 3.37Å; L143-I146 PolarHBondContact O-N 3.39Å; I146-F149 PolarHBondContact O-N 3.34Å; I146-L150 HydrophobicContact CG1-CD1 4.25Å; I146-L150 HydrophobicContact CG1-CG 4.48Å; I146-L150 WeakPolarHBondContact O-CB 3.42Å; I146-L150 WeakPolarHBondContact O-CD1 3.14Å; I146-L150 WeakPolarHBondContact O-CG 3.4Å; I146-L150 PolarHBondContact O-N 3.29Å
147	V	83.1	Confident	70.9	Confident	14 Å²	14	70.7 Å²	70.7	9%	0.085	36%	0.356	C	S	.	.	H	α-helix	trans	-62.2	-50	173.3	172.8	0	0	0	0	111.3	I118 I125 L143 A144 F149 L150 Q151	I118-V147 HydrophobicContact CD1-CG2 3.8Å; I125-V147 HydrophobicContact CD1-CG2 3.77Å; L143-V147 WeakPolarHBondContact O-CB 3.24Å; L143-V147 VanDerWaalsContact O-CG2 3.23Å; L143-V147 WeakPolarHBondContact O-CG2 3.38Å; L143-V147 PolarHBondContact O-N 2.81Å; A144-V147 PolarHBondContact O-N 2.9Å; V147-F149 VanDerWaalsContact C-N 3.33Å; V147-F149 PolarHBondContact O-N 2.67Å; V147-L150 PolarHBondContact O-N 2.76Å; V147-L150 VanDerWaalsContact O-N 3.14Å; V147-Q151 HydrophobicContact CG1-CG 4.31Å; V147-Q151 WeakPolarHBondContact O-CB 3.49Å; V147-Q151 WeakPolarHBondContact O-CG 3.46Å; V147-Q151 PolarHBondContact O-N 3.02Å
148	D	80.3	Confident	70.7	Confident	73 Å²	73	66.6 Å²	66.6	39%	0.39	34%	0.337	S	S	.	.	H	α-helix	trans	-58.5	-43.3	177.4	173.4	71.1	0	0	0	112	A144 K152	A144-D148 VanDerWaalsContact O-CB 3.26Å; A144-D148 WeakPolarHBondContact O-CB 3.3Å; A144-D148 PolarHBondContact O-N 2.95Å; D148-K152 WeakPolarHBondContact O-CB 3.2Å; D148-K152 VanDerWaalsContact O-CG 3.3Å; D148-K152 WeakPolarHBondContact O-CG 3.29Å; D148-K152 PolarHBondContact O-N 3.5Å; D148-K152 WeakPolarHBondContact OD1-CE 3.1Å; D148-K152 IonicContact OD1-NZ 2.74Å; D148-K152 PolarHBondContact OD1-NZ 3.32Å; D148-K152 IonicContact OD2-NZ 2.8Å; D148-K152 PolarHBondContact OD2-NZ 3.32Å
149	F	84	Confident	70.2	Confident	58 Å²	58	68.7 Å²	68.7	25%	0.254	35%	0.348	S	S	.	.	H	α-helix	trans	-61.4	-46.8	173.4	173.7	-96.2	0	0	0	112.1	K51 Q145 I146 V147 K152 H153	K51-F149 HydrophobicContact CD-CE2 4.42Å; K51-F149 HydrophobicContact CD-CZ 4.37Å; K51-F149 HydrophobicContact CG-CD1 4.09Å; K51-F149 HydrophobicContact CG-CE1 3.58Å; K51-F149 HydrophobicContact CG-CE2 4.16Å; K51-F149 HydrophobicContact CG-CZ 3.64Å; Q145-F149 VanDerWaalsContact O-CB 3.32Å; Q145-F149 WeakPolarHBondContact O-CB 3.39Å; Q145-F149 PolarHBondContact O-N 2.74Å; Q145-F149 VanDerWaalsContact O-N 3.08Å; I146-F149 PolarHBondContact O-N 3.34Å; V147-F149 VanDerWaalsContact C-N 3.33Å; V147-F149 PolarHBondContact O-N 2.67Å; F149-K152 PolarHBondContact O-N 2.97Å; F149-H153 HydrophobicContact CE1-CB 4.36Å; F149-H153 HydrophobicContact CZ-CB 4.4Å; F149-H153 VanDerWaalsContact O-CB 3.24Å; F149-H153 WeakPolarHBondContact O-CB 3.1Å; F149-H153 PolarHBondContact O-N 3.44Å
150	L	83.1	Confident	69.4	Low	0 Å²	0	69.2 Å²	69.2	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-67	-37.2	-178.1	-70.2	169.3	0	0	0	112.2	V50 I54 W59 L84 L86 I118 W123 I146 V147 H153 A154	V50-L150 HydrophobicContact CG1-CD2 4.13Å; I54-L150 HydrophobicContact CD1-CD2 3.25Å; W59-L150 HydrophobicContact CH2-CB 4.33Å; W59-L150 HydrophobicContact CH2-CD2 3.99Å; W59-L150 HydrophobicContact CZ3-CD2 3.96Å; L84-L150 HydrophobicContact CD2-CD1 3.7Å; L84-L150 HydrophobicContact CD2-CD2 3.55Å; L84-L150 HydrophobicContact CD2-CG 4.3Å; L86-L150 HydrophobicContact CD2-CD1 4.13Å; I118-L150 HydrophobicContact CG2-CD1 3.98Å; W123-L150 HydrophobicContact CH2-CB 4.23Å; W123-L150 HydrophobicContact CZ3-CB 3.72Å; I146-L150 HydrophobicContact CG1-CD1 4.25Å; I146-L150 HydrophobicContact CG1-CG 4.48Å; I146-L150 WeakPolarHBondContact O-CB 3.42Å; I146-L150 WeakPolarHBondContact O-CD1 3.14Å; I146-L150 WeakPolarHBondContact O-CG 3.4Å; I146-L150 PolarHBondContact O-N 3.29Å; V147-L150 PolarHBondContact O-N 2.76Å; V147-L150 VanDerWaalsContact O-N 3.14Å; L150-H153 PolarHBondContact O-N 2.84Å; L150-A154 WeakPolarHBondContact O-CB 3.38Å; L150-A154 PolarHBondContact O-N 3.23Å
151	Q	78	Confident	68.4	Low	80 Å²	80	60.9 Å²	60.9	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-66.9	-46.9	174.4	-73.3	175.3	-16.8	0	0	111.2	W123 V147 H153 A154 S155	W123-Q151 HydrophobicContact CD2-CG 3.82Å; W123-Q151 HydrophobicContact CE3-CG 3.74Å; W123-Q151 HydrophobicContact CH2-CB 4.33Å; W123-Q151 HydrophobicContact CH2-CG 3.66Å; W123-Q151 HydrophobicContact CZ2-CG 3.72Å; W123-Q151 HydrophobicContact CZ3-CG 3.67Å; V147-Q151 HydrophobicContact CG1-CG 4.31Å; V147-Q151 WeakPolarHBondContact O-CB 3.49Å; V147-Q151 WeakPolarHBondContact O-CG 3.46Å; V147-Q151 PolarHBondContact O-N 3.02Å; Q151-H153 PolarHBondContact O-N 2.85Å; Q151-A154 PolarHBondContact O-N 3.17Å; Q151-S155 PolarHBondContact O-N 3.29Å; Q151-S155 VanDerWaalsContact O-N 3.16Å; Q151-S155 PolarHBondContact O-OG 3.39Å
152	K	76.1	Confident	67.2	Low	121 Å²	121	54.9 Å²	54.9	53%	0.526	30%	0.295	S	S	.	.	H	α-helix	trans	-61.7	-32.5	173.3	-74	167.9	178.7	162.1	0	112.6	D148 F149	D148-K152 WeakPolarHBondContact O-CB 3.2Å; D148-K152 VanDerWaalsContact O-CG 3.3Å; D148-K152 WeakPolarHBondContact O-CG 3.29Å; D148-K152 PolarHBondContact O-N 3.5Å; D148-K152 WeakPolarHBondContact OD1-CE 3.1Å; D148-K152 IonicContact OD1-NZ 2.74Å; D148-K152 PolarHBondContact OD1-NZ 3.32Å; D148-K152 IonicContact OD2-NZ 2.8Å; D148-K152 PolarHBondContact OD2-NZ 3.32Å; F149-K152 PolarHBondContact O-N 2.97Å
153	H	73.6	Confident	65.6	Low	31 Å²	31	53.9 Å²	53.9	14%	0.144	29%	0.292	C	S	.	.	H	α-helix	trans	-72.5	-44.6	174.9	-174.9	-95.1	0	0	0	112	I54 W59 F149 L150 Q151 S155 K156 T157	I54-H153 WeakPolarHBondContact CG2-CE1 3.37Å; I54-H153 WeakPolarHBondContact CG2-ND1 3.42Å; I54-H153 WeakPolarHBondContact CG2-NE2 3.33Å; W59-H153 AromaticContact CE3-CE1 3.81Å; W59-H153 AromaticContact CE3-ND1 3.4Å; W59-H153 AromaticContact CZ3-ND1 3.58Å; F149-H153 HydrophobicContact CE1-CB 4.36Å; F149-H153 HydrophobicContact CZ-CB 4.4Å; F149-H153 VanDerWaalsContact O-CB 3.24Å; F149-H153 WeakPolarHBondContact O-CB 3.1Å; F149-H153 PolarHBondContact O-N 3.44Å; L150-H153 PolarHBondContact O-N 2.84Å; Q151-H153 PolarHBondContact O-N 2.85Å; H153-S155 VanDerWaalsContact C-N 3.3Å; H153-S155 PolarHBondContact O-N 2.88Å; H153-K156 PolarHBondContact O-N 2.88Å; H153-T157 PolarHBondContact CD2-OG1 3.49Å; H153-T157 WeakPolarHBondContact CE1-CB 3.41Å; H153-T157 VanDerWaalsContact CE1-CG2 3.4Å; H153-T157 WeakPolarHBondContact CE1-CG2 3.32Å; H153-T157 PolarHBondContact CE1-OG1 2.74Å; H153-T157 PolarHBondContact NE2-OG1 3.18Å; H153-T157 VanDerWaalsContact O-CB 3.3Å; H153-T157 WeakPolarHBondContact O-CB 3.21Å; H153-T157 PolarHBondContact O-N 3.25Å; H153-T157 PolarHBondContact O-OG1 2.94Å
154	A	69.4	Low	63.9	Low	8 Å²	8	59.7 Å²	59.7	7%	0.066	31%	0.313	C	S	.	.	H	α-helix	trans	-54.6	-46.6	176.4	0	0	0	0	0	111.6	W59 W123 L150 Q151 K156 T157 Q158	W59-A154 HydrophobicContact CZ2-CB 3.66Å; W123-A154 HydrophobicContact CH2-CB 4.12Å; W123-A154 HydrophobicContact CZ2-CB 4.16Å; L150-A154 WeakPolarHBondContact O-CB 3.38Å; L150-A154 PolarHBondContact O-N 3.23Å; Q151-A154 PolarHBondContact O-N 3.17Å; A154-K156 PolarHBondContact O-N 3.42Å; A154-T157 PolarHBondContact O-N 3.25Å; A154-Q158 WeakPolarHBondContact O-CG 3.44Å; A154-Q158 PolarHBondContact O-N 3.37Å
155	S	63.4	Low	62.2	Low	99 Å²	99	60.4 Å²	60.4	69%	0.692	31%	0.31	S	S	*	.	H	α-helix	trans	-66.8	-17.8	178.5	-54.9	0	0	0	0	114.7	Q151 H153	Q151-S155 PolarHBondContact O-N 3.29Å; Q151-S155 VanDerWaalsContact O-N 3.16Å; Q151-S155 PolarHBondContact O-OG 3.39Å; H153-S155 VanDerWaalsContact C-N 3.3Å; H153-S155 PolarHBondContact O-N 2.88Å
156	K	61	Low	60.4	Low	158 Å²	158	55.5 Å²	55.5	69%	0.687	29%	0.287	S	S	*	.	H	α-helix	trans	-97	-37.2	174.7	-73.3	-170.6	172.2	-156.3	0	112.9	H153 A154	H153-K156 PolarHBondContact O-N 2.88Å; A154-K156 PolarHBondContact O-N 3.42Å
157	T	53.2	Low	58.3	Low	22 Å²	22	61.5 Å²	61.5	14%	0.135	31%	0.313	C	S	.	.	H	α-helix	trans	-97.6	-9	-163.7	-61.8	0	0	0	0	113.7	W59 H153 A154 T159 S160 A161	W59-T157 HydrophobicContact CB-CG2 3.94Å; H153-T157 PolarHBondContact CD2-OG1 3.49Å; H153-T157 WeakPolarHBondContact CE1-CB 3.41Å; H153-T157 VanDerWaalsContact CE1-CG2 3.4Å; H153-T157 WeakPolarHBondContact CE1-CG2 3.32Å; H153-T157 PolarHBondContact CE1-OG1 2.74Å; H153-T157 PolarHBondContact NE2-OG1 3.18Å; H153-T157 VanDerWaalsContact O-CB 3.3Å; H153-T157 WeakPolarHBondContact O-CB 3.21Å; H153-T157 PolarHBondContact O-N 3.25Å; H153-T157 PolarHBondContact O-OG1 2.94Å; A154-T157 PolarHBondContact O-N 3.25Å; T157-T159 PolarHBondContact O-N 3.04Å; T157-S160 PolarHBondContact O-N 3.28Å; T157-S160 PolarHBondContact O-OG 3.39Å; T157-A161 VanDerWaalsContact O-CB 3.32Å; T157-A161 WeakPolarHBondContact O-CB 3.5Å; T157-A161 PolarHBondContact O-N 2.91Å
158	Q	51	Low	56.1	Low	65 Å²	65	65.3 Å²	65.3	30%	0.304	33%	0.333	S	S	.	.	H	α-helix	trans	-51.7	-40.7	163.3	-78.6	-177.6	35.4	0	0	111.1	A154 F162	A154-Q158 WeakPolarHBondContact O-CG 3.44Å; A154-Q158 PolarHBondContact O-N 3.37Å; Q158-F162 WeakPolarHBondContact O-CB 3.49Å; Q158-F162 PolarHBondContact O-N 2.95Å
159	T	39.6	Very low	54.1	Low	91 Å²	91	64.3 Å²	64.3	56%	0.558	33%	0.331	S	S	*	.	H	α-helix	trans	-67.8	-38	179.7	-40.2	0	0	0	0	113.8	T157 S163	T157-T159 PolarHBondContact O-N 3.04Å; T159-S163 PolarHBondContact O-N 2.88Å
160	S	39.2	Very low	51.9	Low	62 Å²	62	64.5 Å²	64.5	43%	0.434	33%	0.332	S	S	.	.	H	α-helix	trans	-90.2	-30.9	-175.4	60	0	0	0	0	113.7	T157 F162 S163 R164	T157-S160 PolarHBondContact O-N 3.28Å; T157-S160 PolarHBondContact O-OG 3.39Å; S160-F162 VanDerWaalsContact C-N 3.3Å; S160-S163 WeakPolarHBondContact O-CB 3.33Å; S160-S163 PolarHBondContact O-N 3.36Å; S160-R164 PolarHBondContact O-N 3.41Å; S160-R164 VanDerWaalsContact O-N 3.13Å
161	A	39	Very low	49.5	Very low	10 Å²	10	70.3 Å²	70.3	8%	0.083	36%	0.36	C	S	.	.	H	α-helix	trans	-62.3	-40.9	166.8	0	0	0	0	0	110.7	W59 T157 S163 R164 I165	W59-A161 HydrophobicContact CB-CB 4.3Å; T157-A161 VanDerWaalsContact O-CB 3.32Å; T157-A161 WeakPolarHBondContact O-CB 3.5Å; T157-A161 PolarHBondContact O-N 2.91Å; A161-S163 VanDerWaalsContact C-N 3.33Å; A161-S163 PolarHBondContact O-N 2.76Å; A161-R164 PolarHBondContact O-N 3.42Å; A161-R164 VanDerWaalsContact O-N 3.17Å; A161-I165 WeakPolarHBondContact O-CG1 3.38Å; A161-I165 PolarHBondContact O-N 2.84Å
162	F	44.3	Very low	47.6	Very low	27 Å²	27	72.5 Å²	72.5	12%	0.118	37%	0.368	C	S	.	.	H	α-helix	trans	-61.3	-39	173	-157.7	-72.6	0	0	0	112.2	Q158 S160 R164 I165 M166 S254 A255 L258 V275	Q158-F162 WeakPolarHBondContact O-CB 3.49Å; Q158-F162 PolarHBondContact O-N 2.95Å; S160-F162 VanDerWaalsContact C-N 3.3Å; F162-R164 VanDerWaalsContact C-N 3.33Å; F162-R164 PolarHBondContact O-N 3.08Å; F162-I165 PolarHBondContact O-N 2.95Å; F162-M166 HydrophobicContact CD1-CG 3.78Å; F162-M166 HydrophobicContact CE1-CG 3.78Å; F162-M166 HydrophobicContact CE1-SD 3.91Å; F162-M166 WeakPolarHBondContact O-CG 3.36Å; F162-M166 PolarHBondContact O-N 3.31Å; F162-S254 VanDerWaalsContact CE1-CB 3.45Å; F162-S254 WeakPolarHBondContact CZ-O 3.5Å; F162-A255 HydrophobicContact CE2-CB 4.2Å; F162-L258 HydrophobicContact CE1-CD1 3.65Å; F162-L258 HydrophobicContact CE1-CG 3.97Å; F162-L258 HydrophobicContact CE2-CD1 3.86Å; F162-L258 HydrophobicContact CZ-CB 4.31Å; F162-L258 HydrophobicContact CZ-CD1 3.24Å; F162-L258 HydrophobicContact CZ-CG 3.63Å; F162-V275 HydrophobicContact CE2-CG1 4.43Å
163	S	40.8	Very low	45.6	Very low	46 Å²	46	69.9 Å²	69.9	32%	0.322	36%	0.364	S	S	.	.	H	α-helix	trans	-61.4	-37.7	173.8	-165.1	0	0	0	0	112.9	T159 S160 A161 K167	T159-S163 PolarHBondContact O-N 2.88Å; S160-S163 WeakPolarHBondContact O-CB 3.33Å; S160-S163 PolarHBondContact O-N 3.36Å; A161-S163 VanDerWaalsContact C-N 3.33Å; A161-S163 PolarHBondContact O-N 2.76Å; S163-K167 PolarHBondContact O-N 2.88Å
164	R	41.3	Very low	43.7	Very low	122 Å²	122	75.7 Å²	75.7	46%	0.46	39%	0.391	S	S	.	.	H	α-helix	trans	-68.7	-38.1	171.9	-82	177.1	161.3	170.8	-8.6	112.6	E56 S160 A161 F162 K167 L168	E56-R164 PolarHBondContact O-NH1 3.33Å; S160-R164 PolarHBondContact O-N 3.41Å; S160-R164 VanDerWaalsContact O-N 3.13Å; A161-R164 PolarHBondContact O-N 3.42Å; A161-R164 VanDerWaalsContact O-N 3.17Å; F162-R164 VanDerWaalsContact C-N 3.33Å; F162-R164 PolarHBondContact O-N 3.08Å; R164-K167 PolarHBondContact O-N 3.24Å; R164-L168 WeakPolarHBondContact O-CG 3.25Å; R164-L168 PolarHBondContact O-N 3.33Å; R164-L168 VanDerWaalsContact O-N 3.11Å
165	I	43.5	Very low	42	Very low	63 Å²	63	80 Å²	80	32%	0.323	42%	0.417	S	S	.	.	H	α-helix	trans	-65.3	-44.1	175.6	-68	165.5	0	0	0	110.7	L58 A161 F162 K167 L168 C169 L258	L58-I165 HydrophobicContact CD2-CG1 4.28Å; A161-I165 WeakPolarHBondContact O-CG1 3.38Å; A161-I165 PolarHBondContact O-N 2.84Å; F162-I165 PolarHBondContact O-N 2.95Å; I165-K167 VanDerWaalsContact C-N 3.34Å; I165-K167 PolarHBondContact O-N 2.9Å; I165-L168 PolarHBondContact O-N 3.37Å; I165-L168 VanDerWaalsContact O-N 3.14Å; I165-C169 PolarHBondContact O-N 2.91Å; I165-L258 HydrophobicContact CG2-CD1 4.19Å
166	M	41.1	Very low	40.6	Very low	15 Å²	15	79.6 Å²	79.6	7%	0.074	41%	0.407	C	S	.	.	H	α-helix	trans	-54.5	-47.7	173.3	-74.7	-67.8	-59.3	0	0	111.6	F162 L168 C169 E170 F257 L258	F162-M166 HydrophobicContact CD1-CG 3.78Å; F162-M166 HydrophobicContact CE1-CG 3.78Å; F162-M166 HydrophobicContact CE1-SD 3.91Å; F162-M166 WeakPolarHBondContact O-CG 3.36Å; F162-M166 PolarHBondContact O-N 3.31Å; M166-L168 PolarHBondContact O-N 3.33Å; M166-C169 CarbonylContact O-C 3.48Å; M166-C169 WeakPolarHBondContact O-CB 3.42Å; M166-C169 PolarHBondContact O-N 3.25Å; M166-C169 VanDerWaalsContact O-N 3.09Å; M166-E170 VanDerWaalsContact O-CG 3.25Å; M166-E170 WeakPolarHBondContact O-CG 3.46Å; M166-E170 PolarHBondContact O-N 2.92Å; M166-F257 HydrophobicContact CE-CD1 4.45Å; M166-F257 HydrophobicContact CE-CE1 4.28Å; M166-L258 HydrophobicContact SD-CD1 4.46Å; M166-L258 HydrophobicContact SD-CD2 3.6Å; M166-L258 HydrophobicContact SD-CG 4.01Å
167	K	38.8	Very low	39.3	Very low	127 Å²	127	80 Å²	80	55%	0.552	41%	0.411	S	S	*	.	H	α-helix	trans	-59.7	-40.2	175.6	-83.4	-160.9	163.6	-151.6	0	114.1	S163 R164 I165 C169 E170 E171	S163-K167 PolarHBondContact O-N 2.88Å; R164-K167 PolarHBondContact O-N 3.24Å; I165-K167 VanDerWaalsContact C-N 3.34Å; I165-K167 PolarHBondContact O-N 2.9Å; K167-C169 VanDerWaalsContact C-N 3.25Å; K167-C169 PolarHBondContact O-N 2.88Å; K167-E170 WeakPolarHBondContact CA-OE2 3.43Å; K167-E170 WeakPolarHBondContact CG-OE2 3.39Å; K167-E170 WeakPolarHBondContact O-CB 3.43Å; K167-E170 PolarHBondContact O-N 3.38Å; K167-E170 VanDerWaalsContact O-N 3.16Å; K167-E171 WeakPolarHBondContact O-CG 3.26Å; K167-E171 PolarHBondContact O-N 2.82Å
168	L	36.5	Very low	38.7	Very low	94 Å²	94	85.8 Å²	85.8	49%	0.492	44%	0.44	S	S	.	.	H	α-helix	trans	-69.9	-21.2	176.9	-70	170.4	0	0	0	113.2	R164 I165 M166	R164-L168 WeakPolarHBondContact O-CG 3.25Å; R164-L168 PolarHBondContact O-N 3.33Å; R164-L168 VanDerWaalsContact O-N 3.11Å; I165-L168 PolarHBondContact O-N 3.37Å; I165-L168 VanDerWaalsContact O-N 3.14Å; M166-L168 PolarHBondContact O-N 3.33Å
169	C	38.6	Very low	37.9	Very low	51 Å²	51	91.2 Å²	91.2	35%	0.345	46%	0.463	S	S	.	.	H	α-helix	trans	-82.9	-34.3	167.4	-68.5	0	0	0	0	112.2	I165 M166 K167 C173	I165-C169 PolarHBondContact O-N 2.91Å; M166-C169 CarbonylContact O-C 3.48Å; M166-C169 WeakPolarHBondContact O-CB 3.42Å; M166-C169 PolarHBondContact O-N 3.25Å; M166-C169 VanDerWaalsContact O-N 3.09Å; K167-C169 VanDerWaalsContact C-N 3.25Å; K167-C169 PolarHBondContact O-N 2.88Å; C169-C173 PolarHBondContact O-N 3.38Å
170	E	39.2	Very low	37.5	Very low	62 Å²	62	94.2 Å²	94.2	29%	0.29	47%	0.468	S	S	.	.	H	α-helix	trans	-63.2	-47.8	175.7	-70.8	153.4	-163	0	0	111	M166 K167 K172 C173 E174	M166-E170 VanDerWaalsContact O-CG 3.25Å; M166-E170 WeakPolarHBondContact O-CG 3.46Å; M166-E170 PolarHBondContact O-N 2.92Å; K167-E170 WeakPolarHBondContact CA-OE2 3.43Å; K167-E170 WeakPolarHBondContact CG-OE2 3.39Å; K167-E170 WeakPolarHBondContact O-CB 3.43Å; K167-E170 PolarHBondContact O-N 3.38Å; K167-E170 VanDerWaalsContact O-N 3.16Å; E170-K172 VanDerWaalsContact C-N 3.27Å; E170-K172 PolarHBondContact O-N 2.98Å; E170-C173 WeakPolarHBondContact O-CB 3.48Å; E170-C173 PolarHBondContact O-N 3.37Å; E170-E174 PolarHBondContact O-N 3.24Å
171	E	31.6	Very low	37.1	Very low	123 Å²	123	95.8 Å²	95.8	58%	0.575	49%	0.493	S	S	*	.	H	α-helix	trans	-60.9	-28.7	179.6	-72.9	172.3	-174.1	0	0	114.1	K167 T175	K167-E171 WeakPolarHBondContact O-CG 3.26Å; K167-E171 PolarHBondContact O-N 2.82Å; E171-T175 PolarHBondContact O-OG1 3.12Å
172	K	38.4	Very low	36.6	Very low	126 Å²	126	98.4 Å²	98.4	55%	0.548	52%	0.521	S	S	.	.	H	α-helix	trans	-71.3	-37.1	171.7	-77.5	-175.5	174.3	-175.7	0	112.4	E170 T175 D176	E170-K172 VanDerWaalsContact C-N 3.27Å; E170-K172 PolarHBondContact O-N 2.98Å; K172-T175 PolarHBondContact O-N 3.04Å; K172-T175 PolarHBondContact O-OG1 3.46Å; K172-T175 VanDerWaalsContact O-OG1 3.08Å; K172-D176 PolarHBondContact O-N 2.82Å
173	C	33.9	Very low	36.1	Very low	66 Å²	66	107.9 Å²	107.9	45%	0.446	56%	0.563	S	S	.	*	H	α-helix	trans	-68.3	-43.9	-169.7	-145.6	0	0	0	0	111.3	C169 E170 T175 D176	C169-C173 PolarHBondContact O-N 3.38Å; E170-C173 WeakPolarHBondContact O-CB 3.48Å; E170-C173 PolarHBondContact O-N 3.37Å; C173-T175 VanDerWaalsContact C-N 3.25Å; C173-T175 PolarHBondContact O-N 3.09Å; C173-D176 PolarHBondContact O-N 3.02Å
174	E	34	Very low	35.5	Very low	152 Å²	152	109 Å²	109	71%	0.71	58%	0.582	S	S	*	*	H	α-helix	trans	-67.6	-22.8	178.2	-62.2	-173.8	163.7	0	0	113.3	E170	E170-E174 PolarHBondContact O-N 3.24Å
175	T	33.8	Very low	35.2	Very low	98 Å²	98	112.3 Å²	112.3	60%	0.601	59%	0.594	S	S	*	*	H	α-helix	trans	-88.4	-20.9	-179.1	38.8	0	0	0	0	114.7	E171 K172 C173	E171-T175 PolarHBondContact O-OG1 3.12Å; K172-T175 PolarHBondContact O-N 3.04Å; K172-T175 PolarHBondContact O-OG1 3.46Å; K172-T175 VanDerWaalsContact O-OG1 3.08Å; C173-T175 VanDerWaalsContact C-N 3.25Å; C173-T175 PolarHBondContact O-N 3.09Å
176	D	34.7	Very low	35	Very low	92 Å²	92	114 Å²	114	49%	0.492	61%	0.611	S	S	.	*	H	α-helix	trans	-85.8	-35.1	178.6	-111	-46	0	0	0	113.3	K172 C173 I178 K179 K180	K172-D176 PolarHBondContact O-N 2.82Å; C173-D176 PolarHBondContact O-N 3.02Å; D176-I178 PolarHBondContact O-N 2.8Å; D176-K179 PolarHBondContact O-N 2.86Å; D176-K180 IonicContact OD1-NZ 2.71Å; D176-K180 PolarHBondContact OD1-NZ 2.88Å
177	E	33.9	Very low	35.5	Very low	166 Å²	166	117.1 Å²	117.1	78%	0.776	63%	0.628	S	S	*	*	G	3₁₀ helix	trans	-55.8	-36.4	178.8	-82.3	-73.4	107.4	0	0	112.7	K179	E177-K179 PolarHBondContact O-N 3.17Å
178	I	40	Very low	36.4	Very low	144 Å²	144	113.2 Å²	113.2	74%	0.738	62%	0.616	S	S	*	*	G	3₁₀ helix	trans	-73.4	-8.4	-172.5	-61.2	176.4	0	0	0	112.8	D176	D176-I178 PolarHBondContact O-N 2.8Å
179	K	33.6	Very low	38.1	Very low	179 Å²	179	113.1 Å²	113.1	78%	0.778	62%	0.624	S	S	*	*	G	3₁₀ helix	trans	-123.4	7.9	-166.4	-78.4	-174.9	175.6	175.5	0	118.2	D176 E177	D176-K179 PolarHBondContact O-N 2.86Å; E177-K179 PolarHBondContact O-N 3.17Å
180	K	31.9	Very low	40.4	Very low	154 Å²	154	111.7 Å²	111.7	67%	0.67	61%	0.614	S	S	*	*			trans	-114.2	57	-177.5	-75.5	175.5	-175.8	147.8	0	115.9	D176 G182	D176-K180 IonicContact OD1-NZ 2.71Å; D176-K180 PolarHBondContact OD1-NZ 2.88Å; K180-G182 VanDerWaalsContact C-N 3.33Å; K180-G182 PolarHBondContact O-N 2.92Å; K180-G182 VanDerWaalsContact O-N 3.08Å
181	G	29.8	Very low	42.8	Very low	94 Å²	94	109.3 Å²	109.3	97%	0.969	60%	0.602	S	S	*	*			trans	-75.5	77.2	159	0	0	0	0	0	112.2
182	G	29.8	Very low	45.7	Very low	65 Å²	65	103.6 Å²	103.6	67%	0.67	58%	0.576	S	S	*	*	S	Bend	trans	-170	123.9	-179.2	0	0	0	0	0	114.4	K180 G184	K180-G182 VanDerWaalsContact C-N 3.33Å; K180-G182 PolarHBondContact O-N 2.92Å; K180-G182 VanDerWaalsContact O-N 3.08Å; G182-G184 PolarHBondContact O-N 2.88Å
183	K	32.7	Very low	48.4	Very low	226 Å²	226	97.6 Å²	97.6	98%	0.983	55%	0.55	S	S	*	*			trans	-53.6	124.2	-173.3	-67	173.1	176.9	175.4	0	113.8
184	G	28.6	Very low	51.3	Low	70 Å²	70	96.6 Å²	96.6	72%	0.722	54%	0.542	S	S	*	.			trans	160	93.1	165.2	0	0	0	0	0	113.4	G182 S186	G182-G184 PolarHBondContact O-N 2.88Å; G184-S186 VanDerWaalsContact C-N 3.3Å; G184-S186 PolarHBondContact O-N 3.09Å
185	R	34.8	Very low	54	Low	192 Å²	192	91.6 Å²	91.6	73%	0.725	52%	0.52	S	S	*	.			trans	-72.7	87.1	171.2	-175.4	-173.8	-175.2	-176.6	4.9	108.6	L187	R185-L187 PolarHBondContact O-N 3.11Å
186	S	39.9	Very low	56.6	Low	97 Å²	97	89.5 Å²	89.5	68%	0.678	51%	0.505	S	S	*	.			trans	-54.5	132.8	173.7	-171.2	0	0	0	0	109.6	G184	G184-S186 VanDerWaalsContact C-N 3.3Å; G184-S186 PolarHBondContact O-N 3.09Å
187	L	51.4	Low	59	Low	82 Å²	82	87.4 Å²	87.4	43%	0.429	51%	0.505	S	S	.	.			trans	-63.6	146.2	164.2	-147.9	72.5	0	0	0	108	R185 S189 V754 Q784	R185-L187 PolarHBondContact O-N 3.11Å; L187-S189 PolarHBondContact O-N 2.92Å; L187-S189 VanDerWaalsContact O-N 3.14Å; L187-V754 HydrophobicContact CD1-CG1 4.46Å; L187-V754 HydrophobicContact CD2-CB 4.26Å; L187-V754 HydrophobicContact CD2-CG1 3.64Å; L187-V754 HydrophobicContact CG-CG1 3.67Å; L187-Q784 HydrophobicContact CD2-CB 4.43Å
188	S	58.4	Low	61.7	Low	44 Å²	44	82.2 Å²	82.2	31%	0.308	48%	0.483	S	S	.	.			trans	-68.9	110.7	178.2	52.7	0	0	0	0	109.5	V190	S188-V190 PolarHBondContact O-N 2.82Å
189	S	71.6	Confident	64.3	Low	93 Å²	93	75.4 Å²	75.4	65%	0.65	45%	0.448	S	S	*	.	P	Polyproline II helix	trans	-70	116.3	178.5	-172.3	0	0	0	0	109.9	L187 R191	L187-S189 PolarHBondContact O-N 2.92Å; L187-S189 VanDerWaalsContact O-N 3.14Å; S189-R191 PolarHBondContact O-N 2.94Å
190	V	86.1	Confident	67.3	Low	21 Å²	21	67.1 Å²	67.1	13%	0.127	41%	0.413	C	S	.	.	P	Polyproline II helix	trans	-61.4	128.9	169.6	179.9	0	0	0	0	108.5	S188 V752 V754 V786 V788 V793	S188-V190 PolarHBondContact O-N 2.82Å; V190-V752 HydrophobicContact CG1-CG2 4.11Å; V190-V752 HydrophobicContact CG2-CG2 3.91Å; V190-V754 HydrophobicContact CG2-CG2 3.52Å; V190-V786 HydrophobicContact CB-CG1 4.15Å; V190-V786 HydrophobicContact CG1-CG1 4.23Å; V190-V786 HydrophobicContact CG2-CB 4.31Å; V190-V786 HydrophobicContact CG2-CG1 4.39Å; V190-V786 HydrophobicContact CG2-CG2 4.24Å; V190-V788 HydrophobicContact CG1-CG2 3.68Å; V190-V793 HydrophobicContact CB-CG1 4.4Å; V190-V793 HydrophobicContact CG1-CG1 4.42Å
191	R	90.1	Very high	70.3	Confident	11 Å²	11	60 Å²	60	4%	0.042	38%	0.381	C	S	.	.	P	Polyproline II helix	trans	-95.6	150	172.6	-62.4	-164.3	-169.7	-172.4	16.9	110.5	S189 Q207 S262 M263 E265 E267	S189-R191 PolarHBondContact O-N 2.94Å; R191-Q207 PolarHBondContact O-NE2 3.22Å; R191-S262 VanDerWaalsContact CZ-O 3.28Å; R191-S262 PolarHBondContact NE-O 2.92Å; R191-S262 PolarHBondContact NH2-O 2.85Å; R191-M263 HydrophobicContact CB-SD 4.24Å; R191-E265 PolarHBondContact NE-O 3.5Å; R191-E265 VanDerWaalsContact NH2-C 3.34Å; R191-E265 PolarHBondContact NH2-O 2.8Å; R191-E267 IonicContact CZ-OE2 3.69Å; R191-E267 IonicContact NH1-OE2 3.91Å; R191-E267 PolarHBondContact NH1-OE2 2.81Å; R191-E267 VanDerWaalsContact NH2-CB 3.33Å; R191-E267 IonicContact NH2-OE2 3.65Å; R191-E267 PolarHBondContact NH2-OE2 3.45Å
192	G	92.8	Very high	73.5	Confident	4 Å²	4	55.5 Å²	55.5	4%	0.041	34%	0.335	C	S	.	.	P	Polyproline II helix	trans	-70.2	163.9	164.9	0	0	0	0	0	110.7	P270 L271 D790	G192-P270 CarbonylContact O-C 3.59Å; G192-P270 WeakPolarHBondContact O-CA 3.42Å; G192-L271 PolarHBondContact O-N 2.86Å; G192-D790 CarbonylContact C-O 3.59Å; G192-D790 WeakPolarHBondContact CA-O 3.4Å
193	I	95	Very high	76.7	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	30%	0.304	C	S	.	.	B	Isolated β-bridge	trans	-120.7	130	174.5	-59.5	159.9	0	0	0	108.8	N195 N203 M206 Q207 F259 M263 L271 P273 D790 T791	I193-N195 PolarHBondContact O-N 3.24Å; I193-N203 HydrophobicContact CB-CB 4.16Å; I193-N203 HydrophobicContact CD1-CB 4.31Å; I193-N203 WeakPolarHBondContact CD1-O 3.13Å; I193-N203 HydrophobicContact CG2-CB 4.25Å; I193-N203 WeakPolarHBondContact CG2-OD1 3.18Å; I193-N203 PolarHBondContact O-ND2 3.39Å; I193-M206 HydrophobicContact CD1-CB 4.03Å; I193-Q207 HydrophobicContact CD1-CG 3.93Å; I193-Q207 VanDerWaalsContact CD1-NE2 3.3Å; I193-F259 HydrophobicContact CD1-CE1 4.48Å; I193-F259 HydrophobicContact CD1-CZ 3.75Å; I193-F259 HydrophobicContact CG1-CZ 3.98Å; I193-F259 HydrophobicContact CG2-CZ 4.48Å; I193-M263 HydrophobicContact CD1-CE 4.42Å; I193-M263 HydrophobicContact CG1-CE 4.41Å; I193-M263 HydrophobicContact CG1-SD 4.15Å; I193-L271 CarbonylContact C-O 3.57Å; I193-L271 VanDerWaalsContact CA-O 3.31Å; I193-L271 WeakPolarHBondContact CA-O 3.35Å; I193-P273 HydrophobicContact CG2-CB 3.81Å; I193-P273 HydrophobicContact CG2-CG 3.62Å; I193-D790 PolarHBondContact N-O 2.77Å; I193-D790 CarbonylContact O-C 3.59Å; I193-D790 VanDerWaalsContact O-CA 3.24Å; I193-D790 WeakPolarHBondContact O-CA 3.26Å; I193-D790 WeakPolarHBondContact O-CB 2.77Å; I193-T791 PolarHBondContact O-N 2.95Å
194	T	93.6	Very high	79.8	Confident	45 Å²	45	42 Å²	42	28%	0.276	26%	0.259	S	S	.	.			trans	-67.9	122	179.9	-56.5	0	0	0	0	110.6	L271 P273	T194-L271 PolarHBondContact N-O 3.1Å; T194-P273 WeakPolarHBondContact O-CD 3.43Å; T194-P273 WeakPolarHBondContact O-CG 3.43Å
195	N	91.8	Very high	83.2	Confident	47 Å²	47	38.7 Å²	38.7	25%	0.251	23%	0.225	S	C	.	.			trans	-70.3	130.9	172.4	-166.9	-25.1	0	0	0	110.1	I193 G197 T199 D790	I193-N195 PolarHBondContact O-N 3.24Å; N195-G197 PolarHBondContact OD1-N 2.85Å; N195-G197 PolarHBondContact OD1-O 2.89Å; N195-T199 PolarHBondContact OD1-N 2.99Å; N195-T199 PolarHBondContact OD1-OG1 2.98Å; N195-D790 HydrophobicContact CB-CB 4.06Å; N195-D790 WeakPolarHBondContact CB-OD2 3.15Å; N195-D790 PolarHBondContact ND2-OD2 3.46Å
196	L	87.9	Confident	86.1	Confident	54 Å²	54	29.6 Å²	29.6	28%	0.283	19%	0.19	S	C	.	.			trans	-97.2	11.6	-179.4	-51.9	179.3	0	0	0	113	T199 P273 F277 F290	L196-T199 HydrophobicContact CB-CG2 3.82Å; L196-T199 HydrophobicContact CG-CG2 4.45Å; L196-T199 PolarHBondContact N-OG1 3.31Å; L196-P273 HydrophobicContact CD1-CG 3.89Å; L196-P273 HydrophobicContact CD2-CG 4.49Å; L196-P273 HydrophobicContact CG-CG 3.96Å; L196-F277 HydrophobicContact CD1-CD1 4.48Å; L196-F290 HydrophobicContact CB-CE1 4.18Å
197	G	85.8	Confident	88.8	Confident	48 Å²	48	25.2 Å²	25.2	50%	0.495	16%	0.159	S	C	.	.	S	Bend	trans	147.1	-89.2	-178.9	0	0	0	0	0	109.8	N195	N195-G197 PolarHBondContact OD1-N 2.85Å; N195-G197 PolarHBondContact OD1-O 2.89Å
198	N	90.6	Very high	91	Very high	57 Å²	57	21.3 Å²	21.3	31%	0.305	14%	0.139	S	C	.	.	S	Bend	trans	-110.8	25.6	172.7	-72.3	-65.3	0	0	0	112.6	C200 F201 F290 Q292	N198-C200 PolarHBondContact O-N 2.73Å; N198-C200 VanDerWaalsContact O-N 3.09Å; N198-F201 WeakPolarHBondContact O-CD1 3.29Å; N198-F201 WeakPolarHBondContact O-CE1 3.24Å; N198-F290 WeakPolarHBondContact CB-O 3.3Å; N198-F290 PolarHBondContact ND2-O 2.92Å; N198-Q292 HydrophobicContact CB-CG 3.83Å; N198-Q292 WeakPolarHBondContact OD1-CG 3.34Å; N198-Q292 PolarHBondContact OD1-NE2 2.84Å
199	T	94.3	Very high	92.7	Very high	1 Å²	1	19.2 Å²	19.2	1%	0.006	12%	0.124	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	17.8	-170.1	69.4	0	0	0	0	114.8	N195 L196 F201 F202 N203 F277 F290	N195-T199 PolarHBondContact OD1-N 2.99Å; N195-T199 PolarHBondContact OD1-OG1 2.98Å; L196-T199 HydrophobicContact CB-CG2 3.82Å; L196-T199 HydrophobicContact CG-CG2 4.45Å; L196-T199 PolarHBondContact N-OG1 3.31Å; T199-F201 VanDerWaalsContact C-N 3.31Å; T199-F201 PolarHBondContact O-N 2.89Å; T199-F202 WeakPolarHBondContact O-CB 3.39Å; T199-F202 PolarHBondContact O-N 3.45Å; T199-F202 VanDerWaalsContact O-N 3.12Å; T199-N203 PolarHBondContact O-N 2.84Å; T199-N203 PolarHBondContact O-OD1 3.12Å; T199-F277 HydrophobicContact CG2-CD2 4.47Å; T199-F277 HydrophobicContact CG2-CE1 4.14Å; T199-F277 HydrophobicContact CG2-CE2 4.06Å; T199-F277 HydrophobicContact CG2-CZ 3.89Å; T199-F290 HydrophobicContact CG2-CD1 4.45Å
200	C	95.8	Very high	93.8	Very high	5 Å²	5	15.2 Å²	15.2	3%	0.034	10%	0.097	C	C	.	.	H	α-helix	trans	-63.5	-34.7	-180	59.1	0	0	0	0	112.9	N198 F202 N203 A204 H747 D790	N198-C200 PolarHBondContact O-N 2.73Å; N198-C200 VanDerWaalsContact O-N 3.09Å; C200-F202 VanDerWaalsContact C-N 3.27Å; C200-F202 PolarHBondContact O-N 2.89Å; C200-N203 PolarHBondContact O-N 3.04Å; C200-A204 WeakPolarHBondContact O-CB 2.9Å; C200-A204 PolarHBondContact O-N 3.13Å; C200-H747 WeakPolarHBondContact CB-CE1 3.46Å; C200-H747 VanDerWaalsContact CB-ND1 3.3Å; C200-H747 WeakPolarHBondContact CB-ND1 3.5Å; C200-H747 PolarHBondContact SG-ND1 2.81Å; C200-D790 WeakPolarHBondContact CA-OD1 3.35Å
201	F	96.3	Very high	94	Very high	4 Å²	4	14.7 Å²	14.7	2%	0.018	9%	0.093	C	C	.	.	H	α-helix	trans	-59	-38.4	172.8	69.9	-80.5	0	0	0	112.1	N198 T199 V205 F277 F287 Q293 L298 Y748	N198-F201 WeakPolarHBondContact O-CD1 3.29Å; N198-F201 WeakPolarHBondContact O-CE1 3.24Å; T199-F201 VanDerWaalsContact C-N 3.31Å; T199-F201 PolarHBondContact O-N 2.89Å; F201-V205 WeakPolarHBondContact O-CG2 3.49Å; F201-F277 HydrophobicContact CZ-CE2 4.33Å; F201-F287 AromaticContact CE2-CD1 3.63Å; F201-F287 HydrophobicContact CE2-CD1 3.63Å; F201-F287 AromaticContact CE2-CE1 3.89Å; F201-F287 HydrophobicContact CE2-CE1 3.89Å; F201-F287 AromaticContact CZ-CD1 3.92Å; F201-F287 HydrophobicContact CZ-CD1 3.92Å; F201-Q293 WeakPolarHBondContact CB-O 3.36Å; F201-Q293 HydrophobicContact CD1-CB 4.4Å; F201-Q293 HydrophobicContact CD2-CB 3.96Å; F201-Q293 HydrophobicContact CE1-CB 4.1Å; F201-Q293 HydrophobicContact CE2-CB 3.6Å; F201-Q293 HydrophobicContact CE2-CG 4.36Å; F201-Q293 HydrophobicContact CG-CB 4.37Å; F201-Q293 WeakPolarHBondContact CG-O 3.48Å; F201-Q293 HydrophobicContact CZ-CB 3.71Å; F201-Q293 HydrophobicContact CZ-CG 4.08Å; F201-L298 HydrophobicContact CD2-CB 3.9Å; F201-L298 HydrophobicContact CD2-CD1 3.92Å; F201-L298 HydrophobicContact CD2-CD2 4.23Å; F201-L298 HydrophobicContact CD2-CG 4.22Å; F201-L298 HydrophobicContact CE2-CB 4.05Å; F201-L298 HydrophobicContact CE2-CD1 3.4Å; F201-L298 VanDerWaalsContact CE2-CD1 3.4Å; F201-L298 HydrophobicContact CE2-CG 4.17Å; F201-L298 HydrophobicContact CZ-CD1 4.36Å; F201-Y748 HydrophobicContact CB-CD2 3.5Å; F201-Y748 HydrophobicContact CB-CE2 3.7Å; F201-Y748 HydrophobicContact CB-CG 4.23Å
202	F	97	Very high	94.2	Very high	0 Å²	0	14.2 Å²	14.2	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-71.9	-47.7	172.9	175.7	-83.1	0	0	0	112.1	T199 C200 A204 V205 M206 P273 L276 F277 L280 L298	T199-F202 WeakPolarHBondContact O-CB 3.39Å; T199-F202 PolarHBondContact O-N 3.45Å; T199-F202 VanDerWaalsContact O-N 3.12Å; C200-F202 VanDerWaalsContact C-N 3.27Å; C200-F202 PolarHBondContact O-N 2.89Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.01Å; F202-V205 PolarHBondContact O-N 3.19Å; F202-M206 HydrophobicContact CD1-CG 3.84Å; F202-M206 HydrophobicContact CD2-CG 4.33Å; F202-M206 HydrophobicContact CE1-CB 4.29Å; F202-M206 HydrophobicContact CE1-CG 3.35Å; F202-M206 HydrophobicContact CE2-CG 3.95Å; F202-M206 HydrophobicContact CE2-SD 4.31Å; F202-M206 HydrophobicContact CG-CG 4.29Å; F202-M206 HydrophobicContact CZ-CG 3.44Å; F202-M206 VanDerWaalsContact CZ-CG 3.44Å; F202-M206 HydrophobicContact CZ-SD 4.09Å; F202-M206 WeakPolarHBondContact O-CB 3.24Å; F202-M206 WeakPolarHBondContact O-CG 3.44Å; F202-M206 PolarHBondContact O-N 2.91Å; F202-P273 HydrophobicContact CD1-CB 4.06Å; F202-P273 HydrophobicContact CE1-CB 3.42Å; F202-P273 VanDerWaalsContact CE1-CB 3.42Å; F202-P273 HydrophobicContact CE1-CG 4.39Å; F202-P273 HydrophobicContact CZ-CB 4.28Å; F202-L276 HydrophobicContact CE2-CG 4.31Å; F202-L276 HydrophobicContact CZ-CB 4.33Å; F202-L276 HydrophobicContact CZ-CD2 3.83Å; F202-L276 HydrophobicContact CZ-CG 3.83Å; F202-F277 HydrophobicContact CB-CD2 4.33Å; F202-F277 HydrophobicContact CB-CE2 4.37Å; F202-F277 HydrophobicContact CD1-CD2 4.44Å; F202-F277 AromaticContact CD2-CD2 3.73Å; F202-F277 HydrophobicContact CD2-CD2 3.73Å; F202-F277 HydrophobicContact CD2-CE2 4.36Å; F202-F277 HydrophobicContact CE2-CD2 4.11Å; F202-F277 AromaticContact CG-CD2 3.91Å; F202-F277 HydrophobicContact CG-CD2 3.91Å; F202-F277 HydrophobicContact CG-CE2 4.42Å; F202-F277 HydrophobicContact CZ-CB 4.45Å; F202-L280 HydrophobicContact CD2-CD2 4.42Å; F202-L280 HydrophobicContact CE2-CD2 4.36Å; F202-L298 HydrophobicContact CB-CD1 4.23Å; F202-L298 HydrophobicContact CB-CD2 4Å; F202-L298 HydrophobicContact CD2-CD1 3.84Å; F202-L298 HydrophobicContact CD2-CD2 3.95Å; F202-L298 HydrophobicContact CD2-CG 4.43Å; F202-L298 HydrophobicContact CG-CD2 4.36Å
203	N	97.2	Very high	93.9	Very high	4 Å²	4	14.6 Å²	14.6	2%	0.021	9%	0.092	C	C	.	.	H	α-helix	trans	-60.2	-43.3	-177	-66.4	-9.6	0	0	0	111.3	I193 T199 C200 M206 Q207 D790	I193-N203 HydrophobicContact CB-CB 4.16Å; I193-N203 HydrophobicContact CD1-CB 4.31Å; I193-N203 WeakPolarHBondContact CD1-O 3.13Å; I193-N203 HydrophobicContact CG2-CB 4.25Å; I193-N203 WeakPolarHBondContact CG2-OD1 3.18Å; I193-N203 PolarHBondContact O-ND2 3.39Å; T199-N203 PolarHBondContact O-N 2.84Å; T199-N203 PolarHBondContact O-OD1 3.12Å; C200-N203 PolarHBondContact O-N 3.04Å; N203-M206 PolarHBondContact O-N 3.11Å; N203-Q207 WeakPolarHBondContact O-CG 3.25Å; N203-Q207 PolarHBondContact O-N 3.47Å; N203-D790 WeakPolarHBondContact CB-OD1 3.34Å; N203-D790 PolarHBondContact ND2-OD1 3.47Å
204	A	97.9	Very high	93.6	Very high	4 Å²	4	16 Å²	16	3%	0.033	10%	0.1	C	C	.	.	H	α-helix	trans	-65.2	-39.8	179	0	0	0	0	0	113.1	C200 F202 N208 V737 A750	C200-A204 WeakPolarHBondContact O-CB 2.9Å; C200-A204 PolarHBondContact O-N 3.13Å; F202-A204 VanDerWaalsContact C-N 3.33Å; F202-A204 PolarHBondContact O-N 3.01Å; A204-N208 PolarHBondContact O-ND2 2.87Å; A204-V737 HydrophobicContact CB-CG1 4Å; A204-V737 HydrophobicContact CB-CG2 4.22Å; A204-A750 HydrophobicContact CB-CB 4.35Å
205	V	98.1	Very high	93.4	Very high	0 Å²	0	14 Å²	14	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-65.6	-45	173.6	171.1	0	0	0	0	110.8	F201 F202 Q207 N208 L209 S295 L298 L299 L808	F201-V205 WeakPolarHBondContact O-CG2 3.49Å; F202-V205 PolarHBondContact O-N 3.19Å; V205-Q207 VanDerWaalsContact C-N 3.34Å; V205-Q207 PolarHBondContact O-N 2.94Å; V205-N208 PolarHBondContact O-N 3.15Å; V205-N208 VanDerWaalsContact O-N 3.12Å; V205-L209 HydrophobicContact CG1-CD1 3.83Å; V205-L209 HydrophobicContact CG1-CG 4.22Å; V205-L209 PolarHBondContact O-N 3.03Å; V205-S295 WeakPolarHBondContact CG2-O 3.28Å; V205-L298 HydrophobicContact CB-CD2 4.08Å; V205-L298 HydrophobicContact CG1-CD2 4.34Å; V205-L298 HydrophobicContact CG2-CD2 4.15Å; V205-L299 HydrophobicContact CG1-CB 4.2Å; V205-L299 HydrophobicContact CG1-CD1 3.87Å; V205-L808 HydrophobicContact CG2-CD1 4.37Å
206	M	97.3	Very high	93	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.3	-30.3	-177.4	-73.4	-45.9	-53.5	0	0	114.2	I193 F202 N203 L209 A210 L256 F259 L260 L276 L302	I193-M206 HydrophobicContact CD1-CB 4.03Å; F202-M206 HydrophobicContact CD1-CG 3.84Å; F202-M206 HydrophobicContact CD2-CG 4.33Å; F202-M206 HydrophobicContact CE1-CB 4.29Å; F202-M206 HydrophobicContact CE1-CG 3.35Å; F202-M206 HydrophobicContact CE2-CG 3.95Å; F202-M206 HydrophobicContact CE2-SD 4.31Å; F202-M206 HydrophobicContact CG-CG 4.29Å; F202-M206 HydrophobicContact CZ-CG 3.44Å; F202-M206 VanDerWaalsContact CZ-CG 3.44Å; F202-M206 HydrophobicContact CZ-SD 4.09Å; F202-M206 WeakPolarHBondContact O-CB 3.24Å; F202-M206 WeakPolarHBondContact O-CG 3.44Å; F202-M206 PolarHBondContact O-N 2.91Å; N203-M206 PolarHBondContact O-N 3.11Å; M206-L209 HydrophobicContact CE-CB 4.37Å; M206-L209 HydrophobicContact CE-CD1 4.48Å; M206-L209 HydrophobicContact SD-CD1 3.97Å; M206-A210 VanDerWaalsContact O-CB 3.28Å; M206-A210 WeakPolarHBondContact O-CB 3.46Å; M206-A210 PolarHBondContact O-N 3.03Å; M206-L256 HydrophobicContact CE-CD1 3.61Å; M206-F259 HydrophobicContact CB-CE1 3.79Å; M206-F259 HydrophobicContact CB-CZ 4Å; M206-F259 HydrophobicContact CE-CD1 3.5Å; M206-F259 VanDerWaalsContact CE-CD1 3.5Å; M206-F259 HydrophobicContact CE-CE1 3.6Å; M206-F259 HydrophobicContact CE-CG 4.42Å; M206-F259 HydrophobicContact CG-CE1 4.24Å; M206-F259 HydrophobicContact CG-CZ 4.43Å; M206-L260 HydrophobicContact CE-CD2 4.22Å; M206-L276 HydrophobicContact CE-CD2 3.7Å; M206-L276 HydrophobicContact SD-CD2 4.02Å; M206-L302 HydrophobicContact SD-CD2 3.64Å
207	Q	96.3	Very high	92.8	Very high	5 Å²	5	12.9 Å²	12.9	2%	0.023	8%	0.082	C	C	.	.	H	α-helix	trans	-59.9	-46.1	170.2	-72.4	-64.7	-16.7	0	0	111.8	R191 I193 N203 V205 A210 Q211 A750 V752 V788	R191-Q207 PolarHBondContact O-NE2 3.22Å; I193-Q207 HydrophobicContact CD1-CG 3.93Å; I193-Q207 VanDerWaalsContact CD1-NE2 3.3Å; N203-Q207 WeakPolarHBondContact O-CG 3.25Å; N203-Q207 PolarHBondContact O-N 3.47Å; V205-Q207 VanDerWaalsContact C-N 3.34Å; V205-Q207 PolarHBondContact O-N 2.94Å; Q207-A210 PolarHBondContact O-N 2.75Å; Q207-Q211 PolarHBondContact O-N 3.43Å; Q207-A750 HydrophobicContact CB-CB 3.71Å; Q207-A750 HydrophobicContact CG-CB 4.15Å; Q207-V752 HydrophobicContact CB-CG1 4.12Å; Q207-V788 HydrophobicContact CG-CB 4.1Å; Q207-V788 HydrophobicContact CG-CG1 4.07Å; Q207-V788 HydrophobicContact CG-CG2 4.4Å
208	N	96.6	Very high	92.7	Very high	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-69.6	-40.1	-179.2	-70.9	-70.4	0	0	0	111.7	A204 V205 Q211 T212 G735 I736 V737 F810	A204-N208 PolarHBondContact O-ND2 2.87Å; V205-N208 PolarHBondContact O-N 3.15Å; V205-N208 VanDerWaalsContact O-N 3.12Å; N208-Q211 PolarHBondContact O-N 3.4Å; N208-T212 PolarHBondContact O-N 2.66Å; N208-T212 PolarHBondContact O-OG1 3.29Å; N208-G735 VanDerWaalsContact OD1-C 3.22Å; N208-G735 WeakPolarHBondContact OD1-CA 3.35Å; N208-I736 PolarHBondContact ND2-O 2.88Å; N208-I736 VanDerWaalsContact ND2-O 3.08Å; N208-I736 PolarHBondContact OD1-N 3.45Å; N208-V737 VanDerWaalsContact ND2-CG2 3.34Å; N208-V737 WeakPolarHBondContact ND2-CG2 3.48Å; N208-F810 HydrophobicContact CB-CD1 4.18Å; N208-F810 HydrophobicContact CB-CD2 3.7Å; N208-F810 HydrophobicContact CB-CE1 4.13Å; N208-F810 HydrophobicContact CB-CE2 3.67Å; N208-F810 HydrophobicContact CB-CG 3.98Å; N208-F810 HydrophobicContact CB-CZ 3.89Å
209	L	95.7	Very high	92.2	Very high	1 Å²	1	9.1 Å²	9.1	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-64.9	-36.8	173	-66.9	178	0	0	0	112.6	V205 M206 Q211 T212 L215 L299 L302 F355 F810	V205-L209 HydrophobicContact CG1-CD1 3.83Å; V205-L209 HydrophobicContact CG1-CG 4.22Å; V205-L209 PolarHBondContact O-N 3.03Å; M206-L209 HydrophobicContact CE-CB 4.37Å; M206-L209 HydrophobicContact CE-CD1 4.48Å; M206-L209 HydrophobicContact SD-CD1 3.97Å; L209-Q211 VanDerWaalsContact C-N 3.25Å; L209-Q211 PolarHBondContact O-N 3.45Å; L209-T212 VanDerWaalsContact O-CB 3.24Å; L209-T212 WeakPolarHBondContact O-CB 3.44Å; L209-T212 PolarHBondContact O-N 3.49Å; L209-T212 VanDerWaalsContact O-N 3.11Å; L209-T212 PolarHBondContact O-OG1 3.44Å; L209-L215 HydrophobicContact CD2-CD2 4.47Å; L209-L299 HydrophobicContact CD1-CD1 4.28Å; L209-L299 HydrophobicContact CD2-CD1 4.34Å; L209-L302 HydrophobicContact CD1-CD2 3.9Å; L209-F355 HydrophobicContact CD2-CE1 4.12Å; L209-F355 HydrophobicContact CD2-CZ 3.79Å; L209-F810 HydrophobicContact CD2-CE1 4.21Å
210	A	93.2	Very high	91.3	Very high	9 Å²	9	11.9 Å²	11.9	7%	0.074	7%	0.065	C	C	.	.	H	α-helix	trans	-63.8	-28.9	174.9	0	0	0	0	0	113.6	M206 Q207 T212 L260 M263	M206-A210 VanDerWaalsContact O-CB 3.28Å; M206-A210 WeakPolarHBondContact O-CB 3.46Å; M206-A210 PolarHBondContact O-N 3.03Å; Q207-A210 PolarHBondContact O-N 2.75Å; A210-T212 VanDerWaalsContact C-N 3.32Å; A210-L260 HydrophobicContact CB-CD2 4.12Å; A210-M263 HydrophobicContact CB-CB 4.04Å; A210-M263 HydrophobicContact CB-CE 4.06Å; A210-M263 HydrophobicContact CB-CG 4.11Å
211	Q	92	Very high	90.1	Very high	10 Å²	10	17.4 Å²	17.4	5%	0.047	9%	0.091	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.2	3.9	176.7	-165.8	51.1	16.2	0	0	113.7	Q207 N208 L209 Y213 Y734 V752 K753 R755	Q207-Q211 PolarHBondContact O-N 3.43Å; N208-Q211 PolarHBondContact O-N 3.4Å; L209-Q211 VanDerWaalsContact C-N 3.25Å; L209-Q211 PolarHBondContact O-N 3.45Å; Q211-Y213 VanDerWaalsContact NE2-CZ 3.26Å; Q211-Y213 PolarHBondContact NE2-OH 2.89Å; Q211-Y213 PolarHBondContact O-N 2.8Å; Q211-Y213 VanDerWaalsContact OE1-CE1 3.3Å; Q211-Y213 PolarHBondContact OE1-OH 3.45Å; Q211-Y734 HydrophobicContact CB-CD2 4.23Å; Q211-Y734 HydrophobicContact CB-CE2 4.47Å; Q211-Y734 HydrophobicContact CG-CD2 4.05Å; Q211-V752 HydrophobicContact CB-CB 4.33Å; Q211-V752 HydrophobicContact CB-CG1 4.34Å; Q211-V752 HydrophobicContact CG-CB 4.26Å; Q211-K753 PolarHBondContact NE2-O 3.5Å; Q211-R755 PolarHBondContact O-NH2 2.9Å
212	T	92.7	Very high	88.7	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	10%	0.096	C	C	.	.			trans	-87.5	98.4	173.3	-52.3	0	0	0	0	109.3	N208 L209 A210 L215 T216 I354 F355 V682 Y734	N208-T212 PolarHBondContact O-N 2.66Å; N208-T212 PolarHBondContact O-OG1 3.29Å; L209-T212 VanDerWaalsContact O-CB 3.24Å; L209-T212 WeakPolarHBondContact O-CB 3.44Å; L209-T212 PolarHBondContact O-N 3.49Å; L209-T212 VanDerWaalsContact O-N 3.11Å; L209-T212 PolarHBondContact O-OG1 3.44Å; A210-T212 VanDerWaalsContact C-N 3.32Å; T212-L215 HydrophobicContact CG2-CB 3.84Å; T212-L215 PolarHBondContact O-N 2.84Å; T212-T216 PolarHBondContact O-N 3.32Å; T212-T216 PolarHBondContact O-OG1 2.95Å; T212-I354 HydrophobicContact CG2-CG2 4.47Å; T212-F355 HydrophobicContact CG2-CE1 4.45Å; T212-F355 HydrophobicContact CG2-CZ 4.24Å; T212-V682 HydrophobicContact CG2-CG2 3.72Å; T212-Y734 WeakPolarHBondContact OG1-CE2 3.48Å; T212-Y734 PolarHBondContact OG1-OH 2.9Å
213	Y	87.2	Confident	86.9	Confident	13 Å²	13	22.5 Å²	22.5	5%	0.051	11%	0.113	C	C	.	.	H	α-helix	trans	-74	-42	-168.2	-66.2	-25	0	0	0	113	Q211 L215 T216 D217 R755 P757	Q211-Y213 VanDerWaalsContact NE2-CZ 3.26Å; Q211-Y213 PolarHBondContact NE2-OH 2.89Å; Q211-Y213 PolarHBondContact O-N 2.8Å; Q211-Y213 VanDerWaalsContact OE1-CE1 3.3Å; Q211-Y213 PolarHBondContact OE1-OH 3.45Å; Y213-L215 PolarHBondContact O-N 3.21Å; Y213-L215 VanDerWaalsContact O-N 3.12Å; Y213-T216 PolarHBondContact O-N 2.97Å; Y213-D217 VanDerWaalsContact O-CG 3.27Å; Y213-D217 PolarHBondContact O-N 3.35Å; Y213-R755 HydrophobicContact CE2-CB 4.16Å; Y213-R755 WeakPolarHBondContact CE2-O 3.45Å; Y213-R755 PolarHBondContact OH-O 2.82Å; Y213-P757 HydrophobicContact CD2-CB 3.97Å; Y213-P757 HydrophobicContact CD2-CG 3.83Å; Y213-P757 HydrophobicContact CE2-CB 4.26Å; Y213-P757 HydrophobicContact CE2-CG 3.68Å; Y213-P757 HydrophobicContact CG-CG 4.38Å
214	T	87.8	Confident	84.7	Confident	30 Å²	30	29.7 Å²	29.7	18%	0.184	15%	0.147	C	C	.	.	H	α-helix	trans	-55.6	-31.8	174.3	-50.8	0	0	0	0	113	L218 I354 L761	T214-L218 HydrophobicContact CG2-CD1 4.09Å; T214-L218 HydrophobicContact CG2-CG 4.39Å; T214-L218 WeakPolarHBondContact O-CB 3.31Å; T214-L218 WeakPolarHBondContact O-CG 3.34Å; T214-L218 PolarHBondContact O-N 3.33Å; T214-L218 VanDerWaalsContact O-N 3.08Å; T214-I354 HydrophobicContact CG2-CG1 4.28Å; T214-L761 HydrophobicContact CG2-CD2 4.09Å
215	L	90.2	Very high	82.3	Confident	1 Å²	1	35.1 Å²	35.1	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65.9	-45.6	173.5	176.1	61.9	0	0	0	112	L209 T212 Y213 D217 M219 L260 F350 I351 I354 F355	L209-L215 HydrophobicContact CD2-CD2 4.47Å; T212-L215 HydrophobicContact CG2-CB 3.84Å; T212-L215 PolarHBondContact O-N 2.84Å; Y213-L215 PolarHBondContact O-N 3.21Å; Y213-L215 VanDerWaalsContact O-N 3.12Å; L215-D217 VanDerWaalsContact C-N 3.35Å; L215-M219 HydrophobicContact CD1-CG 4.19Å; L215-M219 HydrophobicContact CD1-SD 3.79Å; L215-M219 HydrophobicContact CG-SD 4.13Å; L215-M219 WeakPolarHBondContact O-CB 3.48Å; L215-M219 WeakPolarHBondContact O-CG 3.17Å; L215-M219 PolarHBondContact O-N 3.25Å; L215-M219 VanDerWaalsContact O-N 3.13Å; L215-L260 HydrophobicContact CD2-CD1 3.95Å; L215-L260 HydrophobicContact CG-CD1 4.1Å; L215-F350 HydrophobicContact CD1-CD2 4.13Å; L215-F350 HydrophobicContact CD1-CE2 3.96Å; L215-I351 HydrophobicContact CD1-CD1 4.5Å; L215-I354 HydrophobicContact CB-CD1 3.96Å; L215-I354 HydrophobicContact CD1-CD1 3.65Å; L215-I354 HydrophobicContact CG-CD1 4.43Å; L215-F355 HydrophobicContact CD1-CE2 4.38Å; L215-F355 HydrophobicContact CD2-CE2 4.4Å; L215-F355 HydrophobicContact CD2-CZ 4.22Å
216	T	84.1	Confident	80.4	Confident	4 Å²	4	37.6 Å²	37.6	3%	0.025	20%	0.202	C	C	.	.	H	α-helix	trans	-68.9	-38.8	179.3	-35.4	0	0	0	0	111.4	T212 Y213 M219 N220 K264	T212-T216 PolarHBondContact O-N 3.32Å; T212-T216 PolarHBondContact O-OG1 2.95Å; Y213-T216 PolarHBondContact O-N 2.97Å; T216-M219 PolarHBondContact O-N 2.83Å; T216-N220 PolarHBondContact O-N 3.37Å; T216-N220 PolarHBondContact O-ND2 3.4Å; T216-K264 HydrophobicContact CG2-CD 4.38Å; T216-K264 WeakPolarHBondContact OG1-CE 3.12Å; T216-K264 PolarHBondContact OG1-NZ 3.14Å
217	D	83.7	Confident	79	Confident	74 Å²	74	39.3 Å²	39.3	40%	0.396	21%	0.213	S	C	.	.	H	α-helix	trans	-69.1	-44.7	-174.5	-61.7	-18	0	0	0	110.5	Y213 L215 M219 N220 E221	Y213-D217 VanDerWaalsContact O-CG 3.27Å; Y213-D217 PolarHBondContact O-N 3.35Å; L215-D217 VanDerWaalsContact C-N 3.35Å; D217-M219 VanDerWaalsContact C-N 3.33Å; D217-M219 PolarHBondContact O-N 3.26Å; D217-N220 WeakPolarHBondContact O-CB 3.28Å; D217-N220 PolarHBondContact O-N 2.91Å; D217-N220 VanDerWaalsContact O-N 3.12Å; D217-E221 PolarHBondContact O-N 3.11Å; D217-E221 VanDerWaalsContact O-N 3.1Å
218	L	82.7	Confident	78.1	Confident	19 Å²	19	46.5 Å²	46.5	10%	0.099	24%	0.244	C	C	.	.	H	α-helix	trans	-64.2	-33.8	171.5	-69.5	178	0	0	0	113	T214 N220 E221 I222 F350 I354	T214-L218 HydrophobicContact CG2-CD1 4.09Å; T214-L218 HydrophobicContact CG2-CG 4.39Å; T214-L218 WeakPolarHBondContact O-CB 3.31Å; T214-L218 WeakPolarHBondContact O-CG 3.34Å; T214-L218 PolarHBondContact O-N 3.33Å; T214-L218 VanDerWaalsContact O-N 3.08Å; L218-N220 VanDerWaalsContact C-N 3.33Å; L218-E221 PolarHBondContact O-N 2.94Å; L218-I222 WeakPolarHBondContact O-CD1 3.43Å; L218-I222 VanDerWaalsContact O-CG1 3.29Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 3.26Å; L218-F350 HydrophobicContact CB-CB 4.38Å; L218-F350 HydrophobicContact CD1-CB 4.26Å; L218-I354 HydrophobicContact CD1-CD1 4.04Å; L218-I354 HydrophobicContact CD1-CG1 3.87Å
219	M	81.1	Confident	77.3	Confident	7 Å²	7	47.7 Å²	47.7	3%	0.034	25%	0.25	C	C	.	.	H	α-helix	trans	-72.9	-23.6	174.2	-67.1	-178.8	96.1	0	0	113.1	L215 T216 D217 K223 T253 L256 F257 L260 F350	L215-M219 HydrophobicContact CD1-CG 4.19Å; L215-M219 HydrophobicContact CD1-SD 3.79Å; L215-M219 HydrophobicContact CG-SD 4.13Å; L215-M219 WeakPolarHBondContact O-CB 3.48Å; L215-M219 WeakPolarHBondContact O-CG 3.17Å; L215-M219 PolarHBondContact O-N 3.25Å; L215-M219 VanDerWaalsContact O-N 3.13Å; T216-M219 PolarHBondContact O-N 2.83Å; D217-M219 VanDerWaalsContact C-N 3.33Å; D217-M219 PolarHBondContact O-N 3.26Å; M219-K223 PolarHBondContact O-N 3.4Å; M219-T253 HydrophobicContact CE-CG2 3.83Å; M219-T253 WeakPolarHBondContact CE-O 3.25Å; M219-L256 HydrophobicContact CE-CB 4.24Å; M219-L256 HydrophobicContact CE-CD2 4.01Å; M219-L256 HydrophobicContact CE-CG 4.02Å; M219-L256 HydrophobicContact SD-CD2 4.35Å; M219-L256 HydrophobicContact SD-CG 4.37Å; M219-F257 HydrophobicContact CB-CD2 3.76Å; M219-F257 HydrophobicContact CB-CE2 4.34Å; M219-F257 HydrophobicContact CE-CB 4.02Å; M219-L260 HydrophobicContact SD-CD1 3.72Å; M219-F350 HydrophobicContact CE-CE2 4.34Å; M219-F350 HydrophobicContact CE-CZ 4.26Å; M219-F350 HydrophobicContact CG-CD2 4.36Å; M219-F350 HydrophobicContact CG-CE2 3.92Å; M219-F350 HydrophobicContact CG-CZ 4.39Å; M219-F350 HydrophobicContact SD-CE2 4.27Å
220	N	73.8	Confident	76.6	Confident	60 Å²	60	52.4 Å²	52.4	32%	0.321	27%	0.27	S	S	.	.	H	α-helix	trans	-71.5	-42.4	169.8	-75.3	-42.6	0	0	0	111.5	T216 D217 L218 I222 K223 F257	T216-N220 PolarHBondContact O-N 3.37Å; T216-N220 PolarHBondContact O-ND2 3.4Å; D217-N220 WeakPolarHBondContact O-CB 3.28Å; D217-N220 PolarHBondContact O-N 2.91Å; D217-N220 VanDerWaalsContact O-N 3.12Å; L218-N220 VanDerWaalsContact C-N 3.33Å; N220-I222 PolarHBondContact O-N 3.3Å; N220-K223 VanDerWaalsContact O-CB 3.26Å; N220-K223 WeakPolarHBondContact O-CB 3.3Å; N220-K223 PolarHBondContact O-N 2.84Å; N220-F257 WeakPolarHBondContact OD1-CE2 3.42Å
221	E	71.2	Confident	76.1	Confident	121 Å²	121	52 Å²	52	57%	0.565	27%	0.267	S	S	*	.	H	α-helix	trans	-57.6	-30.8	173.3	-67.7	174.2	-160	0	0	112.5	D217 L218 K223 T227	D217-E221 PolarHBondContact O-N 3.11Å; D217-E221 VanDerWaalsContact O-N 3.1Å; L218-E221 PolarHBondContact O-N 2.94Å; E221-K223 VanDerWaalsContact C-N 3.31Å; E221-T227 PolarHBondContact O-OG1 3.38Å
222	I	66.6	Low	75.4	Confident	25 Å²	25	56.8 Å²	56.8	13%	0.128	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-12.2	177.6	-70.2	167.7	0	0	0	112.9	L218 N220 T227 P249 R313 F350	L218-I222 WeakPolarHBondContact O-CD1 3.43Å; L218-I222 VanDerWaalsContact O-CG1 3.29Å; L218-I222 WeakPolarHBondContact O-CG1 3.46Å; L218-I222 PolarHBondContact O-N 3.26Å; N220-I222 PolarHBondContact O-N 3.3Å; I222-T227 PolarHBondContact O-OG1 2.95Å; I222-P249 HydrophobicContact CG2-CG 3.85Å; I222-R313 VanDerWaalsContact CG2-NH1 3.26Å; I222-F350 HydrophobicContact CD1-CB 4.31Å; I222-F350 HydrophobicContact CD1-CD1 3.43Å; I222-F350 VanDerWaalsContact CD1-CD1 3.43Å; I222-F350 HydrophobicContact CD1-CE1 3.88Å; I222-F350 HydrophobicContact CD1-CG 3.93Å
223	K	58.8	Low	74.4	Confident	85 Å²	85	57.7 Å²	57.7	37%	0.37	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-34.4	179	-175	-174	174.8	-174	0	112.9	M219 N220 E221 F257	M219-K223 PolarHBondContact O-N 3.4Å; N220-K223 VanDerWaalsContact O-CB 3.26Å; N220-K223 WeakPolarHBondContact O-CB 3.3Å; N220-K223 PolarHBondContact O-N 2.84Å; E221-K223 VanDerWaalsContact C-N 3.31Å; K223-F257 HydrophobicContact CD-CE1 3.95Å; K223-F257 HydrophobicContact CD-CZ 3.8Å
224	E	51.2	Low	73.6	Confident	156 Å²	156	59.3 Å²	59.3	73%	0.729	31%	0.307	S	S	*	.	S	Bend	trans	-68.3	153.7	-177.1	-66.5	-170.2	168.8	0	0	112.3	S226	E224-S226 PolarHBondContact O-N 3.16Å; E224-S226 VanDerWaalsContact O-N 3.1Å
225	S	48.5	Very low	72.3	Confident	117 Å²	117	64 Å²	64	82%	0.818	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49	112.3	-163.3	55.2	0	0	0	0	114.4	T227	S225-T227 PolarHBondContact O-N 3.39Å
226	S	57.8	Low	70.9	Confident	52 Å²	52	71.3 Å²	71.3	36%	0.364	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.4	60.6	173.8	67.5	0	0	0	0	114.8	E224 K228 E245	E224-S226 PolarHBondContact O-N 3.16Å; E224-S226 VanDerWaalsContact O-N 3.1Å; S226-K228 PolarHBondContact O-N 3.09Å; S226-K228 VanDerWaalsContact O-N 3.14Å; S226-E245 VanDerWaalsContact CB-OE1 3.25Å; S226-E245 WeakPolarHBondContact CB-OE1 3.27Å; S226-E245 PolarHBondContact OG-OE1 3.03Å
227	T	67.8	Low	69.8	Low	37 Å²	37	73.1 Å²	73.1	23%	0.227	39%	0.393	C	S	.	.			trans	-33.9	114.2	178.4	-39.2	0	0	0	0	112.8	E221 I222 S225 L229 L246	E221-T227 PolarHBondContact O-OG1 3.38Å; I222-T227 PolarHBondContact O-OG1 2.95Å; S225-T227 PolarHBondContact O-N 3.39Å; T227-L229 PolarHBondContact O-N 2.68Å; T227-L246 WeakPolarHBondContact O-CB 3.15Å; T227-L246 WeakPolarHBondContact O-CG 3.41Å; T227-L246 PolarHBondContact O-N 3.39Å; T227-L246 VanDerWaalsContact O-N 3.07Å
228	K	77.1	Confident	69	Low	156 Å²	156	79.3 Å²	79.3	68%	0.678	42%	0.419	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-86.3	98.3	-178.7	-69.1	179.7	-178.1	174.1	0	110.1	S226 K230 V243 V244	S226-K228 PolarHBondContact O-N 3.09Å; S226-K228 VanDerWaalsContact O-N 3.14Å; K228-K230 PolarHBondContact O-N 2.95Å; K228-V243 HydrophobicContact CB-CG1 4.04Å; K228-V244 CarbonylContact C-O 3.59Å; K228-V244 WeakPolarHBondContact CA-O 3.43Å
229	L	80	Confident	68.7	Low	24 Å²	24	80.6 Å²	80.6	13%	0.126	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	117.5	177.1	177.2	62.6	0	0	0	110.1	T227 I231 V244 L246 I314 M348	T227-L229 PolarHBondContact O-N 2.68Å; L229-I231 HydrophobicContact CD2-CD1 4.3Å; L229-I231 HydrophobicContact CD2-CG1 4.08Å; L229-I231 HydrophobicContact CG-CG1 3.98Å; L229-V244 HydrophobicContact CB-CG2 3.92Å; L229-V244 HydrophobicContact CD2-CG2 4.36Å; L229-V244 HydrophobicContact CG-CG2 4.4Å; L229-V244 PolarHBondContact N-O 2.99Å; L229-V244 PolarHBondContact O-N 3.48Å; L229-L246 HydrophobicContact CB-CD1 4.16Å; L229-L246 HydrophobicContact CB-CD2 4.31Å; L229-L246 HydrophobicContact CB-CG 4.11Å; L229-L246 HydrophobicContact CD2-CD2 4.31Å; L229-I314 HydrophobicContact CD2-CD1 4.16Å; L229-I314 HydrophobicContact CD2-CG1 3.97Å; L229-I314 HydrophobicContact CD2-CG2 3.93Å; L229-M348 HydrophobicContact CD1-CB 3.86Å; L229-M348 HydrophobicContact CD1-CG 4.2Å; L229-M348 HydrophobicContact CD2-CB 4.21Å
230	K	81.5	Confident	68.6	Low	101 Å²	101	86.7 Å²	86.7	44%	0.439	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	110.1	171.8	-171.2	169	-177.2	178.5	0	110.2	K228 F232 P241 L242 V243	K228-K230 PolarHBondContact O-N 2.95Å; K230-F232 HydrophobicContact CB-CE2 4.28Å; K230-F232 HydrophobicContact CD-CE1 4.27Å; K230-F232 HydrophobicContact CD-CE2 3.93Å; K230-F232 HydrophobicContact CD-CZ 3.59Å; K230-F232 HydrophobicContact CG-CD2 4.33Å; K230-F232 HydrophobicContact CG-CE2 3.77Å; K230-F232 HydrophobicContact CG-CZ 3.92Å; K230-P241 HydrophobicContact CD-CB 4.49Å; K230-P241 HydrophobicContact CG-CB 4.3Å; K230-L242 CarbonylContact C-O 3.58Å; K230-L242 WeakPolarHBondContact CA-O 3.42Å; K230-V243 HydrophobicContact CB-CG2 4.21Å; K230-V243 HydrophobicContact CD-CG2 4.17Å; K230-V243 HydrophobicContact CG-CG2 3.93Å
231	I	82.8	Confident	69.1	Low	0 Å²	0	86.4 Å²	86.4	0%	0	46%	0.46	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	114.4	178.1	-54.2	175.2	0	0	0	107.9	L229 P241 L242 V244 I314 I318 Y341 E344	L229-I231 HydrophobicContact CD2-CD1 4.3Å; L229-I231 HydrophobicContact CD2-CG1 4.08Å; L229-I231 HydrophobicContact CG-CG1 3.98Å; I231-P241 CarbonylContact O-C 3.52Å; I231-P241 WeakPolarHBondContact O-CA 3.47Å; I231-L242 PolarHBondContact N-O 2.86Å; I231-L242 PolarHBondContact O-N 3.26Å; I231-V244 HydrophobicContact CD1-CG1 4.42Å; I231-V244 HydrophobicContact CD1-CG2 4.17Å; I231-I314 HydrophobicContact CD1-CG2 4.5Å; I231-I318 HydrophobicContact CD1-CD1 3.61Å; I231-I318 HydrophobicContact CD1-CG1 3.62Å; I231-Y341 HydrophobicContact CG2-CD1 4.13Å; I231-E344 HydrophobicContact CG2-CB 4.05Å
232	F	77	Confident	69.7	Low	110 Å²	110	82 Å²	82	48%	0.482	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-88.9	123	170.4	-63.2	-94.7	0	0	0	108.2	K230 P241	K230-F232 HydrophobicContact CB-CE2 4.28Å; K230-F232 HydrophobicContact CD-CE1 4.27Å; K230-F232 HydrophobicContact CD-CE2 3.93Å; K230-F232 HydrophobicContact CD-CZ 3.59Å; K230-F232 HydrophobicContact CG-CD2 4.33Å; K230-F232 HydrophobicContact CG-CE2 3.77Å; K230-F232 HydrophobicContact CG-CZ 3.92Å; F232-P241 HydrophobicContact CD1-CB 3.79Å; F232-P241 HydrophobicContact CD1-CG 3.72Å; F232-P241 HydrophobicContact CE1-CB 3.97Å; F232-P241 HydrophobicContact CE1-CG 3.94Å; F232-P241 HydrophobicContact CG-CB 4.42Å
233	P	72.5	Confident	70.6	Confident	19 Å²	19	84.6 Å²	84.6	12%	0.123	46%	0.457	C	S	.	.	P	Polyproline II helix	trans	-75.4	163.5	173.6	33.7	-34.2	0	0	0	110.4	L239 Y341	P233-L239 HydrophobicContact CB-CB 3.98Å; P233-L239 HydrophobicContact CB-CD1 4.42Å; P233-L239 HydrophobicContact CG-CB 3.57Å; P233-L239 WeakPolarHBondContact CG-O 3.4Å; P233-Y341 HydrophobicContact CB-CD1 4.36Å; P233-Y341 HydrophobicContact CB-CE1 4.01Å; P233-Y341 HydrophobicContact CG-CE1 3.99Å
234	S	70.5	Confident	71.8	Confident	47 Å²	47	80.7 Å²	80.7	33%	0.329	44%	0.441	S	S	.	.	P	Polyproline II helix	trans	-59.3	145.9	-177.7	-54.2	0	0	0	0	112.7	D236 S237 E344	S234-D236 PolarHBondContact O-N 3.37Å; S234-S237 PolarHBondContact O-N 2.88Å; S234-S237 PolarHBondContact O-OG 2.82Å; S234-E344 PolarHBondContact OG-OE1 3.12Å
235	S	60.1	Low	73.4	Confident	128 Å²	128	77.6 Å²	77.6	90%	0.895	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-23.4	-176.6	-53.2	0	0	0	0	115.2	S237	S235-S237 VanDerWaalsContact C-N 3.25Å; S235-S237 PolarHBondContact O-N 2.97Å
236	D	59.3	Low	74.9	Confident	156 Å²	156	72.5 Å²	72.5	83%	0.834	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-7.9	174.8	-53.7	-60.8	0	0	0	113.8	S234	S234-D236 PolarHBondContact O-N 3.37Å
237	S	61.3	Low	76	Confident	41 Å²	41	73.3 Å²	73.3	29%	0.287	40%	0.395	S	S	.	.	S	Bend	trans	-106.8	130.5	-177.4	67.7	0	0	0	0	112	S234 S235 L239	S234-S237 PolarHBondContact O-N 2.88Å; S234-S237 PolarHBondContact O-OG 2.82Å; S235-S237 VanDerWaalsContact C-N 3.25Å; S235-S237 PolarHBondContact O-N 2.97Å; S237-L239 PolarHBondContact O-N 3.04Å
238	Q	67.4	Low	76.5	Confident	205 Å²	205	78.8 Å²	78.8	96%	0.958	41%	0.411	S	S	*	.			trans	-78	55.2	177	-59.9	-179.4	10.9	0	0	111.1
239	L	75.7	Confident	76.8	Confident	45 Å²	45	72.9 Å²	72.9	24%	0.236	39%	0.389	C	S	.	.			trans	-122.2	133.7	-174.2	-68.2	-178.1	0	0	0	110.5	P233 S237 K337 A340 Y341	P233-L239 HydrophobicContact CB-CB 3.98Å; P233-L239 HydrophobicContact CB-CD1 4.42Å; P233-L239 HydrophobicContact CG-CB 3.57Å; P233-L239 WeakPolarHBondContact CG-O 3.4Å; S237-L239 PolarHBondContact O-N 3.04Å; L239-K337 HydrophobicContact CD1-CG 4.4Å; L239-K337 HydrophobicContact CD2-CD 4.33Å; L239-K337 HydrophobicContact CD2-CG 3.84Å; L239-A340 HydrophobicContact CD1-CB 4.06Å; L239-Y341 HydrophobicContact CD1-CE2 4.45Å
240	D	79.9	Confident	76.8	Confident	135 Å²	135	72.7 Å²	72.7	72%	0.722	39%	0.393	S	S	*	.			trans	-70.4	153.3	177.5	-72.1	-61.5	0	0	0	112.6	L242 Y341	D240-L242 PolarHBondContact O-N 2.95Å; D240-L242 VanDerWaalsContact O-N 3.12Å; D240-Y341 PolarHBondContact O-OH 3.07Å
241	P	83.9	Confident	76.9	Confident	54 Å²	54	69.7 Å²	69.7	35%	0.351	38%	0.384	S	S	.	.			trans	-64.9	112	175.2	-23.4	35.5	0	0	0	112.7	K230 I231 F232	K230-P241 HydrophobicContact CD-CB 4.49Å; K230-P241 HydrophobicContact CG-CB 4.3Å; I231-P241 CarbonylContact O-C 3.52Å; I231-P241 WeakPolarHBondContact O-CA 3.47Å; F232-P241 HydrophobicContact CD1-CB 3.79Å; F232-P241 HydrophobicContact CD1-CG 3.72Å; F232-P241 HydrophobicContact CE1-CB 3.97Å; F232-P241 HydrophobicContact CE1-CG 3.94Å; F232-P241 HydrophobicContact CG-CB 4.42Å
242	L	84.8	Confident	77.2	Confident	30 Å²	30	69.7 Å²	69.7	16%	0.157	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	128.2	179.8	-176.5	69.6	0	0	0	110.9	K230 I231 D240 V244 I318 A321 F322 Y341	K230-L242 CarbonylContact C-O 3.58Å; K230-L242 WeakPolarHBondContact CA-O 3.42Å; I231-L242 PolarHBondContact N-O 2.86Å; I231-L242 PolarHBondContact O-N 3.26Å; D240-L242 PolarHBondContact O-N 2.95Å; D240-L242 VanDerWaalsContact O-N 3.12Å; L242-V244 HydrophobicContact CD2-CG1 3.62Å; L242-V244 HydrophobicContact CG-CG1 3.75Å; L242-I318 HydrophobicContact CD2-CG2 4.42Å; L242-A321 HydrophobicContact CD1-CB 4.33Å; L242-F322 HydrophobicContact CD2-CE2 3.82Å; L242-F322 HydrophobicContact CD2-CZ 4.39Å; L242-Y341 HydrophobicContact CB-CD1 3.76Å; L242-Y341 HydrophobicContact CB-CE1 3.56Å; L242-Y341 HydrophobicContact CB-CG 4.34Å; L242-Y341 HydrophobicContact CD2-CD1 4.09Å; L242-Y341 HydrophobicContact CD2-CD2 3.98Å; L242-Y341 HydrophobicContact CD2-CE1 4.49Å; L242-Y341 HydrophobicContact CD2-CE2 4.41Å; L242-Y341 HydrophobicContact CD2-CG 3.83Å
243	V	84.7	Confident	77.8	Confident	79 Å²	79	64.6 Å²	64.6	48%	0.479	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	116.6	170.4	-178.8	0	0	0	0	108.8	K228 K230	K228-V243 HydrophobicContact CB-CG1 4.04Å; K230-V243 HydrophobicContact CB-CG2 4.21Å; K230-V243 HydrophobicContact CD-CG2 4.17Å; K230-V243 HydrophobicContact CG-CG2 3.93Å
244	V	84.3	Confident	78.4	Confident	3 Å²	3	64.6 Å²	64.6	2%	0.018	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	143	177.2	-54.1	0	0	0	0	111.1	K228 L229 I231 L242 L246 I318 A321	K228-V244 CarbonylContact C-O 3.59Å; K228-V244 WeakPolarHBondContact CA-O 3.43Å; L229-V244 HydrophobicContact CB-CG2 3.92Å; L229-V244 HydrophobicContact CD2-CG2 4.36Å; L229-V244 HydrophobicContact CG-CG2 4.4Å; L229-V244 PolarHBondContact N-O 2.99Å; L229-V244 PolarHBondContact O-N 3.48Å; I231-V244 HydrophobicContact CD1-CG1 4.42Å; I231-V244 HydrophobicContact CD1-CG2 4.17Å; L242-V244 HydrophobicContact CD2-CG1 3.62Å; L242-V244 HydrophobicContact CG-CG1 3.75Å; V244-L246 HydrophobicContact CG2-CD2 4.26Å; V244-I318 HydrophobicContact CG1-CG1 4.2Å; V244-A321 HydrophobicContact CG1-CB 4.13Å
245	E	83.5	Confident	79.2	Confident	90 Å²	90	62.5 Å²	62.5	42%	0.421	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	117.5	174.2	-175.7	-178.8	-134.8	0	0	109.3	S226 S317 K320	S226-E245 VanDerWaalsContact CB-OE1 3.25Å; S226-E245 WeakPolarHBondContact CB-OE1 3.27Å; S226-E245 PolarHBondContact OG-OE1 3.03Å; E245-S317 WeakPolarHBondContact O-CB 3.21Å; E245-S317 PolarHBondContact O-OG 3.24Å; E245-K320 IonicContact OE2-NZ 3.59Å
246	L	81.4	Confident	80.8	Confident	11 Å²	11	56.4 Å²	56.4	6%	0.058	31%	0.305	C	S	.	.			trans	-76.4	136.5	178.1	-61.8	-177.9	0	0	0	111.2	T227 L229 V244 I314 S317	T227-L246 WeakPolarHBondContact O-CB 3.15Å; T227-L246 WeakPolarHBondContact O-CG 3.41Å; T227-L246 PolarHBondContact O-N 3.39Å; T227-L246 VanDerWaalsContact O-N 3.07Å; L229-L246 HydrophobicContact CB-CD1 4.16Å; L229-L246 HydrophobicContact CB-CD2 4.31Å; L229-L246 HydrophobicContact CB-CG 4.11Å; L229-L246 HydrophobicContact CD2-CD2 4.31Å; V244-L246 HydrophobicContact CG2-CD2 4.26Å; L246-I314 HydrophobicContact CD2-CG1 4.09Å; L246-S317 WeakPolarHBondContact CA-OG 3.41Å
247	S	80.3	Confident	82.1	Confident	68 Å²	68	49.7 Å²	49.7	48%	0.476	27%	0.269	S	S	.	.			trans	-68.7	-174.6	169.8	60.7	0	0	0	0	111.2	R313	S247-R313 VanDerWaalsContact O-CZ 3.22Å; S247-R313 PolarHBondContact O-NE 2.86Å; S247-R313 PolarHBondContact O-NH2 3.49Å
248	R	77.9	Confident	83.2	Confident	152 Å²	152	49.1 Å²	49.1	57%	0.574	26%	0.262	S	S	*	.			trans	-67.6	150.3	174	-67.5	-173.9	72.4	99.3	-3.5	110.9
249	P	83.1	Confident	84.3	Confident	32 Å²	32	40 Å²	40	21%	0.208	22%	0.219	C	C	.	.			trans	-58.2	153.5	170.9	-18.7	30.7	0	0	0	111.5	I222 T253 S254	I222-P249 HydrophobicContact CG2-CG 3.85Å; P249-T253 HydrophobicContact CB-CG2 4Å; P249-S254 PolarHBondContact O-OG 3.11Å
250	G	80.9	Confident	85	Confident	21 Å²	21	37.9 Å²	37.9	22%	0.216	21%	0.208	C	C	.	.			trans	-71.1	177.6	175.4	0	0	0	0	0	113.3	L252 S254 E309	G250-L252 PolarHBondContact O-N 3.14Å; G250-S254 WeakPolarHBondContact O-CB 3.42Å; G250-S254 PolarHBondContact O-N 3.19Å; G250-S254 PolarHBondContact O-OG 3.4Å; G250-E309 WeakPolarHBondContact CA-OE1 3.19Å
251	P	84.5	Confident	85.2	Confident	38 Å²	38	34.1 Å²	34.1	25%	0.247	19%	0.186	C	C	.	.	H	α-helix	trans	-70.1	-29.3	-171.5	29.4	-36.6	0	0	0	113.9	A255	P251-A255 VanDerWaalsContact O-CB 3.22Å; P251-A255 WeakPolarHBondContact O-CB 3.11Å; P251-A255 PolarHBondContact O-N 3.19Å
252	L	88.4	Confident	85.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-77.3	-47.8	176.5	177.5	64.5	0	0	0	110.4	G250 S254 A255 L256 L276 Q279 L280 K283 L302 A305 V306 E309	G250-L252 PolarHBondContact O-N 3.14Å; L252-S254 VanDerWaalsContact C-N 3.26Å; L252-S254 PolarHBondContact O-N 2.98Å; L252-A255 PolarHBondContact O-N 2.77Å; L252-L256 WeakPolarHBondContact O-CB 3.48Å; L252-L256 PolarHBondContact O-N 2.77Å; L252-L276 HydrophobicContact CD1-CD1 3.73Å; L252-Q279 HydrophobicContact CB-CB 4.39Å; L252-Q279 HydrophobicContact CD1-CB 3.76Å; L252-L280 HydrophobicContact CD1-CB 4.38Å; L252-K283 HydrophobicContact CD2-CG 4.02Å; L252-L302 HydrophobicContact CD1-CD1 4.28Å; L252-A305 HydrophobicContact CD2-CB 3.44Å; L252-A305 VanDerWaalsContact CD2-CB 3.44Å; L252-V306 HydrophobicContact CD2-CG2 3.88Å; L252-V306 HydrophobicContact CG-CG2 3.9Å; L252-E309 WeakPolarHBondContact CA-OE1 3.43Å; L252-E309 PolarHBondContact N-OE1 2.87Å
253	T	90	Very high	85.5	Confident	3 Å²	3	31.9 Å²	31.9	2%	0.018	17%	0.173	C	C	.	.	H	α-helix	trans	-60.1	-39.3	177.2	-54.9	0	0	0	0	111.1	M219 P249 F257 V306 E309 F350	M219-T253 HydrophobicContact CE-CG2 3.83Å; M219-T253 WeakPolarHBondContact CE-O 3.25Å; P249-T253 HydrophobicContact CB-CG2 4Å; T253-F257 PolarHBondContact O-N 2.88Å; T253-V306 HydrophobicContact CG2-CG1 4.27Å; T253-E309 PolarHBondContact N-OE1 2.96Å; T253-E309 PolarHBondContact OG1-OE1 3.4Å; T253-F350 HydrophobicContact CG2-CE1 4.34Å; T253-F350 HydrophobicContact CG2-CZ 3.96Å
254	S	85.2	Confident	85.2	Confident	19 Å²	19	31.6 Å²	31.6	13%	0.133	17%	0.166	C	C	.	.	H	α-helix	trans	-68.4	-42	175.5	-56.4	0	0	0	0	112.5	F162 P249 G250 L252 L256 F257 L258	F162-S254 VanDerWaalsContact CE1-CB 3.45Å; F162-S254 WeakPolarHBondContact CZ-O 3.5Å; P249-S254 PolarHBondContact O-OG 3.11Å; G250-S254 WeakPolarHBondContact O-CB 3.42Å; G250-S254 PolarHBondContact O-N 3.19Å; G250-S254 PolarHBondContact O-OG 3.4Å; L252-S254 VanDerWaalsContact C-N 3.26Å; L252-S254 PolarHBondContact O-N 2.98Å; S254-L256 VanDerWaalsContact C-N 3.32Å; S254-L256 PolarHBondContact O-N 2.85Å; S254-F257 WeakPolarHBondContact O-CB 3.39Å; S254-F257 PolarHBondContact O-N 2.77Å; S254-L258 PolarHBondContact O-N 3.27Å
255	A	87.3	Confident	84.8	Confident	2 Å²	2	33.9 Å²	33.9	2%	0.017	18%	0.176	C	C	.	.	H	α-helix	trans	-65.2	-35.7	176.4	0	0	0	0	0	112.3	F162 P251 L252 F259 V275 L276 Q279	F162-A255 HydrophobicContact CE2-CB 4.2Å; P251-A255 VanDerWaalsContact O-CB 3.22Å; P251-A255 WeakPolarHBondContact O-CB 3.11Å; P251-A255 PolarHBondContact O-N 3.19Å; L252-A255 PolarHBondContact O-N 2.77Å; A255-F259 WeakPolarHBondContact O-CB 3.48Å; A255-F259 PolarHBondContact O-N 3.11Å; A255-V275 HydrophobicContact CB-CG1 4.25Å; A255-L276 HydrophobicContact CB-CB 4.49Å; A255-L276 HydrophobicContact CB-CD1 4.22Å; A255-Q279 HydrophobicContact CB-CB 4.36Å; A255-Q279 HydrophobicContact CB-CG 3.92Å
256	L	92	Very high	83.9	Confident	1 Å²	1	35.6 Å²	35.6	1%	0.005	19%	0.193	C	C	.	.	H	α-helix	trans	-63.6	-47	172.1	177.1	60.8	0	0	0	110.5	M206 M219 L252 S254 L258 F259 L260 L276 V306	M206-L256 HydrophobicContact CE-CD1 3.61Å; M219-L256 HydrophobicContact CE-CB 4.24Å; M219-L256 HydrophobicContact CE-CD2 4.01Å; M219-L256 HydrophobicContact CE-CG 4.02Å; M219-L256 HydrophobicContact SD-CD2 4.35Å; M219-L256 HydrophobicContact SD-CG 4.37Å; L252-L256 WeakPolarHBondContact O-CB 3.48Å; L252-L256 PolarHBondContact O-N 2.77Å; S254-L256 VanDerWaalsContact C-N 3.32Å; S254-L256 PolarHBondContact O-N 2.85Å; L256-L258 PolarHBondContact O-N 2.93Å; L256-F259 PolarHBondContact O-N 3.45Å; L256-L260 HydrophobicContact CD1-CD1 3.88Å; L256-L260 HydrophobicContact CD1-CD2 4.39Å; L256-L260 HydrophobicContact CD1-CG 3.96Å; L256-L260 HydrophobicContact CG-CD1 3.87Å; L256-L260 HydrophobicContact CG-CG 4.37Å; L256-L260 VanDerWaalsContact O-CG 3.28Å; L256-L260 WeakPolarHBondContact O-CG 3.4Å; L256-L260 PolarHBondContact O-N 3.33Å; L256-L276 HydrophobicContact CB-CD1 4.02Å; L256-L276 HydrophobicContact CD1-CD2 3.92Å; L256-V306 HydrophobicContact CD2-CG1 4.46Å; L256-V306 HydrophobicContact CD2-CG2 3.95Å
257	F	87.4	Confident	83.1	Confident	15 Å²	15	38.6 Å²	38.6	7%	0.066	21%	0.207	C	C	.	.	H	α-helix	trans	-56.9	-50.2	176.6	177.5	-104.7	0	0	0	112.7	M166 M219 N220 K223 T253 S254 F259 L260 H261	M166-F257 HydrophobicContact CE-CD1 4.45Å; M166-F257 HydrophobicContact CE-CE1 4.28Å; M219-F257 HydrophobicContact CB-CD2 3.76Å; M219-F257 HydrophobicContact CB-CE2 4.34Å; M219-F257 HydrophobicContact CE-CB 4.02Å; N220-F257 WeakPolarHBondContact OD1-CE2 3.42Å; K223-F257 HydrophobicContact CD-CE1 3.95Å; K223-F257 HydrophobicContact CD-CZ 3.8Å; T253-F257 PolarHBondContact O-N 2.88Å; S254-F257 WeakPolarHBondContact O-CB 3.39Å; S254-F257 PolarHBondContact O-N 2.77Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 2.75Å; F257-L260 PolarHBondContact O-N 3.32Å; F257-H261 WeakPolarHBondContact O-CB 3.18Å; F257-H261 PolarHBondContact O-N 2.83Å
258	L	85.3	Confident	82.3	Confident	29 Å²	29	43.8 Å²	43.8	15%	0.152	22%	0.221	C	C	.	.	H	α-helix	trans	-59.1	-43.5	177.4	-81.1	-169.8	0	0	0	112.1	F162 I165 M166 S254 L256 H261 S262	F162-L258 HydrophobicContact CE1-CD1 3.65Å; F162-L258 HydrophobicContact CE1-CG 3.97Å; F162-L258 HydrophobicContact CE2-CD1 3.86Å; F162-L258 HydrophobicContact CZ-CB 4.31Å; F162-L258 HydrophobicContact CZ-CD1 3.24Å; F162-L258 HydrophobicContact CZ-CG 3.63Å; I165-L258 HydrophobicContact CG2-CD1 4.19Å; M166-L258 HydrophobicContact SD-CD1 4.46Å; M166-L258 HydrophobicContact SD-CD2 3.6Å; M166-L258 HydrophobicContact SD-CG 4.01Å; S254-L258 PolarHBondContact O-N 3.27Å; L256-L258 PolarHBondContact O-N 2.93Å; L258-H261 PolarHBondContact O-N 2.92Å; L258-S262 PolarHBondContact O-N 3.17Å; L258-S262 PolarHBondContact O-OG 3.49Å
259	F	90.4	Very high	82.3	Confident	12 Å²	12	38.4 Å²	38.4	5%	0.053	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-47.6	178.1	-177.6	-83.3	0	0	0	111.7	I193 M206 A255 L256 F257 H261 S262 M263 L271 P273 L276	I193-F259 HydrophobicContact CD1-CE1 4.48Å; I193-F259 HydrophobicContact CD1-CZ 3.75Å; I193-F259 HydrophobicContact CG1-CZ 3.98Å; I193-F259 HydrophobicContact CG2-CZ 4.48Å; M206-F259 HydrophobicContact CB-CE1 3.79Å; M206-F259 HydrophobicContact CB-CZ 4Å; M206-F259 HydrophobicContact CE-CD1 3.5Å; M206-F259 VanDerWaalsContact CE-CD1 3.5Å; M206-F259 HydrophobicContact CE-CE1 3.6Å; M206-F259 HydrophobicContact CE-CG 4.42Å; M206-F259 HydrophobicContact CG-CE1 4.24Å; M206-F259 HydrophobicContact CG-CZ 4.43Å; A255-F259 WeakPolarHBondContact O-CB 3.48Å; A255-F259 PolarHBondContact O-N 3.11Å; L256-F259 PolarHBondContact O-N 3.45Å; F257-F259 VanDerWaalsContact C-N 3.33Å; F257-F259 PolarHBondContact O-N 2.75Å; F259-H261 VanDerWaalsContact C-N 3.27Å; F259-H261 PolarHBondContact O-N 2.8Å; F259-S262 PolarHBondContact O-N 2.75Å; F259-M263 HydrophobicContact CD1-CG 4.03Å; F259-M263 HydrophobicContact CE1-CG 3.6Å; F259-M263 HydrophobicContact CE1-SD 4.22Å; F259-M263 HydrophobicContact CZ-CG 4.05Å; F259-M263 HydrophobicContact CZ-SD 4.14Å; F259-M263 VanDerWaalsContact O-CG 3.3Å; F259-M263 WeakPolarHBondContact O-CG 3.5Å; F259-M263 PolarHBondContact O-N 2.91Å; F259-L271 HydrophobicContact CD2-CD2 3.71Å; F259-L271 HydrophobicContact CD2-CG 4.37Å; F259-L271 HydrophobicContact CE2-CD2 3.61Å; F259-L271 HydrophobicContact CE2-CG 4.11Å; F259-L271 HydrophobicContact CG-CD2 4.23Å; F259-L271 HydrophobicContact CZ-CD2 4.03Å; F259-P273 HydrophobicContact CE2-CB 4Å; F259-L276 HydrophobicContact CB-CB 4.45Å; F259-L276 HydrophobicContact CB-CD2 3.82Å; F259-L276 HydrophobicContact CD1-CD2 4.16Å; F259-L276 HydrophobicContact CD2-CD2 4.29Å; F259-L276 HydrophobicContact CG-CD2 3.81Å
260	L	90.2	Very high	82.4	Confident	1 Å²	1	38.7 Å²	38.7	1%	0.005	21%	0.214	C	C	.	.	H	α-helix	trans	-64.7	-30.9	178.2	-64.1	172.2	0	0	0	112.4	M206 A210 L215 M219 L256 F257	M206-L260 HydrophobicContact CE-CD2 4.22Å; A210-L260 HydrophobicContact CB-CD2 4.12Å; L215-L260 HydrophobicContact CD2-CD1 3.95Å; L215-L260 HydrophobicContact CG-CD1 4.1Å; M219-L260 HydrophobicContact SD-CD1 3.72Å; L256-L260 HydrophobicContact CD1-CD1 3.88Å; L256-L260 HydrophobicContact CD1-CD2 4.39Å; L256-L260 HydrophobicContact CD1-CG 3.96Å; L256-L260 HydrophobicContact CG-CD1 3.87Å; L256-L260 HydrophobicContact CG-CG 4.37Å; L256-L260 VanDerWaalsContact O-CG 3.28Å; L256-L260 WeakPolarHBondContact O-CG 3.4Å; L256-L260 PolarHBondContact O-N 3.33Å; F257-L260 PolarHBondContact O-N 3.32Å
261	H	84.6	Confident	82.8	Confident	56 Å²	56	38.9 Å²	38.9	26%	0.259	21%	0.21	S	C	.	.	H	α-helix	trans	-69.4	-52	173.9	-167.5	-82.9	0	0	0	111.6	F257 L258 F259 M263 K264 E265	F257-H261 WeakPolarHBondContact O-CB 3.18Å; F257-H261 PolarHBondContact O-N 2.83Å; L258-H261 PolarHBondContact O-N 2.92Å; F259-H261 VanDerWaalsContact C-N 3.27Å; F259-H261 PolarHBondContact O-N 2.8Å; H261-M263 PolarHBondContact O-N 2.98Å; H261-K264 PolarHBondContact O-N 3.42Å; H261-E265 IonicContact CE1-OE1 3.8Å; H261-E265 PolarHBondContact CE1-OE1 3.1Å; H261-E265 IonicContact CG-OE1 3.78Å; H261-E265 IonicContact ND1-OE1 2.92Å; H261-E265 PolarHBondContact ND1-OE1 2.95Å; H261-E265 PolarHBondContact O-N 2.92Å
262	S	86.6	Confident	83	Confident	25 Å²	25	39.7 Å²	39.7	18%	0.175	22%	0.216	C	C	.	.	H	α-helix	trans	-67.1	-22.1	-179.3	-59.9	0	0	0	0	113.8	R191 L258 F259 K264 E265	R191-S262 VanDerWaalsContact CZ-O 3.28Å; R191-S262 PolarHBondContact NE-O 2.92Å; R191-S262 PolarHBondContact NH2-O 2.85Å; L258-S262 PolarHBondContact O-N 3.17Å; L258-S262 PolarHBondContact O-OG 3.49Å; F259-S262 PolarHBondContact O-N 2.75Å; S262-K264 PolarHBondContact O-N 3.18Å; S262-E265 WeakPolarHBondContact CA-OE1 3.47Å; S262-E265 PolarHBondContact OG-OE1 3.42Å
263	M	86.6	Confident	83.1	Confident	12 Å²	12	39.7 Å²	39.7	6%	0.059	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-19.8	167.5	-75.6	-65	-70.8	0	0	113.9	R191 I193 A210 F259 H261 L271	R191-M263 HydrophobicContact CB-SD 4.24Å; I193-M263 HydrophobicContact CD1-CE 4.42Å; I193-M263 HydrophobicContact CG1-CE 4.41Å; I193-M263 HydrophobicContact CG1-SD 4.15Å; A210-M263 HydrophobicContact CB-CB 4.04Å; A210-M263 HydrophobicContact CB-CE 4.06Å; A210-M263 HydrophobicContact CB-CG 4.11Å; F259-M263 HydrophobicContact CD1-CG 4.03Å; F259-M263 HydrophobicContact CE1-CG 3.6Å; F259-M263 HydrophobicContact CE1-SD 4.22Å; F259-M263 HydrophobicContact CZ-CG 4.05Å; F259-M263 HydrophobicContact CZ-SD 4.14Å; F259-M263 VanDerWaalsContact O-CG 3.3Å; F259-M263 WeakPolarHBondContact O-CG 3.5Å; F259-M263 PolarHBondContact O-N 2.91Å; H261-M263 PolarHBondContact O-N 2.98Å; M263-L271 HydrophobicContact CG-CD2 3.69Å; M263-L271 HydrophobicContact SD-CB 4.22Å; M263-L271 HydrophobicContact SD-CD2 3.72Å
264	K	78.8	Confident	82.8	Confident	73 Å²	73	40.9 Å²	40.9	32%	0.317	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	-18.2	178.9	-62	-172.2	-173.2	-169.5	0	114	T216 H261 S262	T216-K264 HydrophobicContact CG2-CD 4.38Å; T216-K264 WeakPolarHBondContact OG1-CE 3.12Å; T216-K264 PolarHBondContact OG1-NZ 3.14Å; H261-K264 PolarHBondContact O-N 3.42Å; S262-K264 PolarHBondContact O-N 3.18Å
265	E	77.3	Confident	82.7	Confident	51 Å²	51	43.9 Å²	43.9	24%	0.238	24%	0.242	C	C	.	.	S	Bend	trans	-65.1	146.9	176.6	-73.8	165	-145.5	0	0	112.3	R191 H261 S262 E267	R191-E265 PolarHBondContact NE-O 3.5Å; R191-E265 VanDerWaalsContact NH2-C 3.34Å; R191-E265 PolarHBondContact NH2-O 2.8Å; H261-E265 IonicContact CE1-OE1 3.8Å; H261-E265 PolarHBondContact CE1-OE1 3.1Å; H261-E265 IonicContact CG-OE1 3.78Å; H261-E265 IonicContact ND1-OE1 2.92Å; H261-E265 PolarHBondContact ND1-OE1 2.95Å; H261-E265 PolarHBondContact O-N 2.92Å; S262-E265 WeakPolarHBondContact CA-OE1 3.47Å; S262-E265 PolarHBondContact OG-OE1 3.42Å; E265-E267 VanDerWaalsContact C-N 3.34Å; E265-E267 PolarHBondContact O-N 3.03Å
266	T	64.7	Low	82.8	Confident	126 Å²	126	43.9 Å²	43.9	77%	0.773	24%	0.242	S	C	*	.			trans	-87.9	21.7	-173.4	63.2	0	0	0	0	115.4
267	E	63.2	Low	82.7	Confident	75 Å²	75	43.9 Å²	43.9	35%	0.35	24%	0.242	S	C	.	.			trans	-72.1	167.7	172.7	-40.2	171.4	129.1	0	0	111	R191 E265	R191-E267 IonicContact CZ-OE2 3.69Å; R191-E267 IonicContact NH1-OE2 3.91Å; R191-E267 PolarHBondContact NH1-OE2 2.81Å; R191-E267 VanDerWaalsContact NH2-CB 3.33Å; R191-E267 IonicContact NH2-OE2 3.65Å; R191-E267 PolarHBondContact NH2-OE2 3.45Å; E265-E267 VanDerWaalsContact C-N 3.34Å; E265-E267 PolarHBondContact O-N 3.03Å
268	K	63.5	Low	82.6	Confident	177 Å²	177	47.2 Å²	47.2	77%	0.77	26%	0.26	S	S	*	.			trans	-97.4	156.3	-179.9	-62.7	-178.6	179.7	-179.3	0	111.6	Q75	Q75-K268 PolarHBondContact NE2-O 3.04Å
269	G	78.6	Confident	82.8	Confident	38 Å²	38	46.6 Å²	46.6	39%	0.392	26%	0.257	S	S	.	.	S	Bend	trans	90.2	165.5	175	0	0	0	0	0	114.9
270	P	84.8	Confident	82.7	Confident	39 Å²	39	46 Å²	46	25%	0.253	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-74.9	143.9	-177.7	31.5	-35.2	0	0	0	112.2	Q75 G192 T791	Q75-P270 PolarHBondContact NE2-O 3.03Å; Q75-P270 PolarHBondContact OE1-O 2.95Å; G192-P270 CarbonylContact O-C 3.59Å; G192-P270 WeakPolarHBondContact O-CA 3.42Å; P270-T791 HydrophobicContact CB-CG2 3.77Å; P270-T791 HydrophobicContact CG-CG2 3.84Å
271	L	90.4	Very high	82.7	Confident	24 Å²	24	46.5 Å²	46.5	13%	0.126	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-80.2	135.4	179.8	-174.1	61.7	0	0	0	111	G192 I193 T194 F259 M263	G192-L271 PolarHBondContact O-N 2.86Å; I193-L271 CarbonylContact C-O 3.57Å; I193-L271 VanDerWaalsContact CA-O 3.31Å; I193-L271 WeakPolarHBondContact CA-O 3.35Å; T194-L271 PolarHBondContact N-O 3.1Å; F259-L271 HydrophobicContact CD2-CD2 3.71Å; F259-L271 HydrophobicContact CD2-CG 4.37Å; F259-L271 HydrophobicContact CE2-CD2 3.61Å; F259-L271 HydrophobicContact CE2-CG 4.11Å; F259-L271 HydrophobicContact CG-CD2 4.23Å; F259-L271 HydrophobicContact CZ-CD2 4.03Å; M263-L271 HydrophobicContact CG-CD2 3.69Å; M263-L271 HydrophobicContact SD-CB 4.22Å; M263-L271 HydrophobicContact SD-CD2 3.72Å
272	S	87.3	Confident	82.7	Confident	55 Å²	55	49 Å²	49	39%	0.385	27%	0.269	S	S	.	.	P	Polyproline II helix	trans	-82.1	122.5	172.5	-174	0	0	0	0	110.8	S274	S272-S274 PolarHBondContact O-N 2.94Å; S272-S274 PolarHBondContact OG-OG 3.03Å
273	P	90.4	Very high	82.8	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	28%	0.281	C	S	.	.			trans	-80.7	-0	-178.7	32.3	-33.6	0	0	0	113.6	I193 T194 L196 F202 F259 V275 L276 F277	I193-P273 HydrophobicContact CG2-CB 3.81Å; I193-P273 HydrophobicContact CG2-CG 3.62Å; T194-P273 WeakPolarHBondContact O-CD 3.43Å; T194-P273 WeakPolarHBondContact O-CG 3.43Å; L196-P273 HydrophobicContact CD1-CG 3.89Å; L196-P273 HydrophobicContact CD2-CG 4.49Å; L196-P273 HydrophobicContact CG-CG 3.96Å; F202-P273 HydrophobicContact CD1-CB 4.06Å; F202-P273 HydrophobicContact CE1-CB 3.42Å; F202-P273 VanDerWaalsContact CE1-CB 3.42Å; F202-P273 HydrophobicContact CE1-CG 4.39Å; F202-P273 HydrophobicContact CZ-CB 4.28Å; F259-P273 HydrophobicContact CE2-CB 4Å; P273-V275 VanDerWaalsContact C-N 3.31Å; P273-V275 PolarHBondContact O-N 3.2Å; P273-V275 VanDerWaalsContact O-N 3.14Å; P273-L276 PolarHBondContact O-N 3.04Å; P273-L276 VanDerWaalsContact O-N 3.11Å; P273-F277 WeakPolarHBondContact O-CB 3.26Å; P273-F277 PolarHBondContact O-N 2.77Å
274	S	83.7	Confident	82.9	Confident	28 Å²	28	52 Å²	52	20%	0.196	28%	0.28	C	S	.	.	H	α-helix	trans	-57.1	-36.2	-163.2	64	0	0	0	0	114.6	S272 N278	S272-S274 PolarHBondContact O-N 2.94Å; S272-S274 PolarHBondContact OG-OG 3.03Å; S274-N278 WeakPolarHBondContact O-CB 3.35Å; S274-N278 PolarHBondContact O-N 2.94Å; S274-N278 PolarHBondContact O-ND2 3.44Å
275	V	83.5	Confident	83.2	Confident	82 Å²	82	52.7 Å²	52.7	50%	0.497	29%	0.292	S	S	.	.	H	α-helix	trans	-65.3	-49.2	178.5	-178.4	0	0	0	0	111.1	F162 A255 P273 Q279	F162-V275 HydrophobicContact CE2-CG1 4.43Å; A255-V275 HydrophobicContact CB-CG1 4.25Å; P273-V275 VanDerWaalsContact C-N 3.31Å; P273-V275 PolarHBondContact O-N 3.2Å; P273-V275 VanDerWaalsContact O-N 3.14Å; V275-Q279 WeakPolarHBondContact O-CG 3.21Å; V275-Q279 PolarHBondContact O-N 2.91Å
276	L	90.2	Very high	83.7	Confident	2 Å²	2	56.7 Å²	56.7	1%	0.01	31%	0.305	C	S	.	.	H	α-helix	trans	-69.4	-45.3	179.8	175.9	55.2	0	0	0	111.5	F202 M206 L252 A255 L256 F259 P273 N278 Q279 L280 L302	F202-L276 HydrophobicContact CE2-CG 4.31Å; F202-L276 HydrophobicContact CZ-CB 4.33Å; F202-L276 HydrophobicContact CZ-CD2 3.83Å; F202-L276 HydrophobicContact CZ-CG 3.83Å; M206-L276 HydrophobicContact CE-CD2 3.7Å; M206-L276 HydrophobicContact SD-CD2 4.02Å; L252-L276 HydrophobicContact CD1-CD1 3.73Å; A255-L276 HydrophobicContact CB-CB 4.49Å; A255-L276 HydrophobicContact CB-CD1 4.22Å; L256-L276 HydrophobicContact CB-CD1 4.02Å; L256-L276 HydrophobicContact CD1-CD2 3.92Å; F259-L276 HydrophobicContact CB-CB 4.45Å; F259-L276 HydrophobicContact CB-CD2 3.82Å; F259-L276 HydrophobicContact CD1-CD2 4.16Å; F259-L276 HydrophobicContact CD2-CD2 4.29Å; F259-L276 HydrophobicContact CG-CD2 3.81Å; P273-L276 PolarHBondContact O-N 3.04Å; P273-L276 VanDerWaalsContact O-N 3.11Å; L276-N278 VanDerWaalsContact C-N 3.34Å; L276-N278 PolarHBondContact O-N 3Å; L276-Q279 PolarHBondContact O-N 3.47Å; L276-Q279 VanDerWaalsContact O-N 3.15Å; L276-L280 PolarHBondContact O-N 3.36Å; L276-L302 HydrophobicContact CD1-CD1 4.43Å
277	F	89.7	Confident	84.8	Confident	1 Å²	1	50.8 Å²	50.8	0%	0.004	27%	0.269	C	S	.	.	H	α-helix	trans	-59.4	-44.3	178	-170.3	-104.2	0	0	0	111.6	L196 T199 F201 F202 P273 Q279 L280 C281 F287 F290	L196-F277 HydrophobicContact CD1-CD1 4.48Å; T199-F277 HydrophobicContact CG2-CD2 4.47Å; T199-F277 HydrophobicContact CG2-CE1 4.14Å; T199-F277 HydrophobicContact CG2-CE2 4.06Å; T199-F277 HydrophobicContact CG2-CZ 3.89Å; F201-F277 HydrophobicContact CZ-CE2 4.33Å; F202-F277 HydrophobicContact CB-CD2 4.33Å; F202-F277 HydrophobicContact CB-CE2 4.37Å; F202-F277 HydrophobicContact CD1-CD2 4.44Å; F202-F277 AromaticContact CD2-CD2 3.73Å; F202-F277 HydrophobicContact CD2-CD2 3.73Å; F202-F277 HydrophobicContact CD2-CE2 4.36Å; F202-F277 HydrophobicContact CE2-CD2 4.11Å; F202-F277 AromaticContact CG-CD2 3.91Å; F202-F277 HydrophobicContact CG-CD2 3.91Å; F202-F277 HydrophobicContact CG-CE2 4.42Å; F202-F277 HydrophobicContact CZ-CB 4.45Å; P273-F277 WeakPolarHBondContact O-CB 3.26Å; P273-F277 PolarHBondContact O-N 2.77Å; F277-Q279 PolarHBondContact O-N 3.02Å; F277-L280 PolarHBondContact O-N 3.43Å; F277-C281 PolarHBondContact O-N 3.18Å; F277-C281 PolarHBondContact O-SG 3.44Å; F277-F287 HydrophobicContact CE2-CB 4.41Å; F277-F287 HydrophobicContact CZ-CB 4.27Å; F277-F287 WeakPolarHBondContact CZ-O 3.28Å; F277-F290 HydrophobicContact CD1-CE1 4.4Å; F277-F290 HydrophobicContact CE1-CD1 4.27Å; F277-F290 AromaticContact CE1-CE1 3.81Å; F277-F290 HydrophobicContact CE1-CE1 3.81Å; F277-F290 HydrophobicContact CE1-CZ 4.31Å
278	N	85.6	Confident	85.7	Confident	85 Å²	85	53.4 Å²	53.4	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-65.3	-33.7	176.1	-76	-38.1	0	0	0	113.3	S274 L276 Q282	S274-N278 WeakPolarHBondContact O-CB 3.35Å; S274-N278 PolarHBondContact O-N 2.94Å; S274-N278 PolarHBondContact O-ND2 3.44Å; L276-N278 VanDerWaalsContact C-N 3.34Å; L276-N278 PolarHBondContact O-N 3Å; N278-Q282 WeakPolarHBondContact O-CG 3.2Å; N278-Q282 PolarHBondContact O-N 3.44Å
279	Q	87.9	Confident	86.4	Confident	16 Å²	16	50.2 Å²	50.2	8%	0.075	27%	0.27	C	S	.	.	H	α-helix	trans	-69	-37	172.9	-70.2	-59.2	-32.6	0	0	111.9	L252 A255 V275 L276 F277 Q282	L252-Q279 HydrophobicContact CB-CB 4.39Å; L252-Q279 HydrophobicContact CD1-CB 3.76Å; A255-Q279 HydrophobicContact CB-CB 4.36Å; A255-Q279 HydrophobicContact CB-CG 3.92Å; V275-Q279 WeakPolarHBondContact O-CG 3.21Å; V275-Q279 PolarHBondContact O-N 2.91Å; L276-Q279 PolarHBondContact O-N 3.47Å; L276-Q279 VanDerWaalsContact O-N 3.15Å; F277-Q279 PolarHBondContact O-N 3.02Å; Q279-Q282 PolarHBondContact O-N 3.2Å
280	L	90.3	Very high	86.5	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.1	-44.6	174.5	-176.9	59.9	0	0	0	111.4	F202 L252 L276 F277 Q282 K283 A284 F287 L298 L302	F202-L280 HydrophobicContact CD2-CD2 4.42Å; F202-L280 HydrophobicContact CE2-CD2 4.36Å; L252-L280 HydrophobicContact CD1-CB 4.38Å; L276-L280 PolarHBondContact O-N 3.36Å; F277-L280 PolarHBondContact O-N 3.43Å; L280-Q282 PolarHBondContact O-N 3.06Å; L280-K283 WeakPolarHBondContact O-CA 3.43Å; L280-K283 PolarHBondContact O-N 2.85Å; L280-A284 PolarHBondContact O-N 3.28Å; L280-F287 HydrophobicContact CD2-CD2 4.48Å; L280-F287 HydrophobicContact CG-CD2 4.41Å; L280-L298 HydrophobicContact CD2-CD1 3.61Å; L280-L298 HydrophobicContact CD2-CG 4.27Å; L280-L302 HydrophobicContact CD1-CB 4.29Å; L280-L302 HydrophobicContact CD1-CD1 4.26Å; L280-L302 HydrophobicContact CD2-CB 4.31Å; L280-L302 HydrophobicContact CD2-CD1 4.44Å
281	C	88.6	Confident	86.5	Confident	12 Å²	12	56.2 Å²	56.2	8%	0.081	28%	0.283	C	S	.	.	H	α-helix	trans	-62.4	-20.3	176.1	-66.9	0	0	0	0	113.9	F277 F287 K288	F277-C281 PolarHBondContact O-N 3.18Å; F277-C281 PolarHBondContact O-SG 3.44Å; C281-F287 VanDerWaalsContact SG-C 3.59Å; C281-K288 HydrophobicContact CB-CB 4.19Å
282	Q	86.3	Confident	86.4	Confident	107 Å²	107	58.6 Å²	58.6	50%	0.5	29%	0.294	S	S	.	.	H	α-helix	trans	-75.2	-24.1	169.4	-73.6	179.8	53.9	0	0	113.3	N278 Q279 L280	N278-Q282 WeakPolarHBondContact O-CG 3.2Å; N278-Q282 PolarHBondContact O-N 3.44Å; Q279-Q282 PolarHBondContact O-N 3.2Å; L280-Q282 PolarHBondContact O-N 3.06Å
283	K	87.1	Confident	86.7	Confident	96 Å²	96	57.6 Å²	57.6	42%	0.417	28%	0.283	S	S	.	.	H	α-helix	trans	-93.6	-38.8	176.6	-49.6	-62.5	-172.5	171.7	0	112.1	L252 L280 A305 E309	L252-K283 HydrophobicContact CD2-CG 4.02Å; L280-K283 WeakPolarHBondContact O-CA 3.43Å; L280-K283 PolarHBondContact O-N 2.85Å; K283-A305 HydrophobicContact CB-CB 4.16Å; K283-A305 HydrophobicContact CG-CB 4.15Å; K283-E309 WeakPolarHBondContact CE-OE2 3.47Å; K283-E309 IonicContact NZ-OE2 2.73Å; K283-E309 PolarHBondContact NZ-OE2 3.01Å
284	A	89.2	Confident	86.9	Confident	6 Å²	6	59.3 Å²	59.3	5%	0.05	29%	0.292	C	S	.	.			trans	-127.5	87	-177.6	0	0	0	0	0	110	L280 R286 F287 Y301	L280-A284 PolarHBondContact O-N 3.28Å; A284-R286 PolarHBondContact O-N 3.24Å; A284-F287 HydrophobicContact CB-CD2 3.71Å; A284-F287 HydrophobicContact CB-CE2 3.72Å; A284-F287 PolarHBondContact O-N 2.73Å; A284-Y301 HydrophobicContact CB-CD1 3.84Å; A284-Y301 HydrophobicContact CB-CE1 4.35Å; A284-Y301 HydrophobicContact CB-CG 4.08Å
285	P	85.8	Confident	87.5	Confident	86 Å²	86	58 Å²	58	56%	0.558	28%	0.283	S	S	*	.	G	3₁₀ helix	trans	-59.8	-19.7	-174.3	-28.1	37	0	0	0	115.7	F287 K288	P285-F287 PolarHBondContact O-N 3.23Å; P285-F287 VanDerWaalsContact O-N 3.16Å; P285-K288 WeakPolarHBondContact O-CB 3.1Å; P285-K288 PolarHBondContact O-N 3.43Å
286	R	86.7	Confident	88.1	Confident	135 Å²	135	55.3 Å²	55.3	51%	0.509	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-52.4	-34.2	176.7	-179.9	177.3	-73	-171.2	-2.8	113.3	A284 K288 E297	A284-R286 PolarHBondContact O-N 3.24Å; R286-K288 VanDerWaalsContact C-N 3.31Å; R286-K288 PolarHBondContact O-N 3.18Å; R286-E297 WeakPolarHBondContact CD-OE1 3.38Å; R286-E297 IonicContact CZ-OE1 2.6Å; R286-E297 IonicContact NE-OE1 3.78Å; R286-E297 IonicContact NH1-OE1 3.6Å; R286-E297 PolarHBondContact NH1-OE1 2.94Å; R286-E297 IonicContact NH1-OE2 2.8Å; R286-E297 PolarHBondContact NH1-OE2 2.81Å
287	F	88.1	Confident	88.3	Confident	3 Å²	3	57.6 Å²	57.6	1%	0.013	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-79.8	-10.4	179.9	-56.5	-64.5	0	0	0	113.9	F201 F277 L280 C281 A284 P285 D289 Q293 L298 Y301	F201-F287 AromaticContact CE2-CD1 3.63Å; F201-F287 HydrophobicContact CE2-CD1 3.63Å; F201-F287 AromaticContact CE2-CE1 3.89Å; F201-F287 HydrophobicContact CE2-CE1 3.89Å; F201-F287 AromaticContact CZ-CD1 3.92Å; F201-F287 HydrophobicContact CZ-CD1 3.92Å; F277-F287 HydrophobicContact CE2-CB 4.41Å; F277-F287 HydrophobicContact CZ-CB 4.27Å; F277-F287 WeakPolarHBondContact CZ-O 3.28Å; L280-F287 HydrophobicContact CD2-CD2 4.48Å; L280-F287 HydrophobicContact CG-CD2 4.41Å; C281-F287 VanDerWaalsContact SG-C 3.59Å; A284-F287 HydrophobicContact CB-CD2 3.71Å; A284-F287 HydrophobicContact CB-CE2 3.72Å; A284-F287 PolarHBondContact O-N 2.73Å; P285-F287 PolarHBondContact O-N 3.23Å; P285-F287 VanDerWaalsContact O-N 3.16Å; F287-D289 PolarHBondContact O-N 2.91Å; F287-Q293 HydrophobicContact CD1-CB 4.12Å; F287-Q293 HydrophobicContact CD1-CG 3.96Å; F287-Q293 HydrophobicContact CE1-CB 4.04Å; F287-Q293 HydrophobicContact CE1-CG 4.25Å; F287-L298 HydrophobicContact CD1-CD1 4.05Å; F287-L298 HydrophobicContact CE1-CB 4.07Å; F287-L298 HydrophobicContact CE1-CD1 4.04Å; F287-L298 HydrophobicContact CG-CD1 4.31Å; F287-L298 HydrophobicContact CZ-CB 4.12Å; F287-L298 HydrophobicContact CZ-CD1 4.28Å; F287-Y301 AromaticContact CE2-CD2 3.71Å; F287-Y301 HydrophobicContact CE2-CD2 3.71Å; F287-Y301 AromaticContact CE2-CG 3.9Å; F287-Y301 HydrophobicContact CE2-CG 3.9Å; F287-Y301 AromaticContact CZ-CD2 3.69Å; F287-Y301 HydrophobicContact CZ-CD2 3.69Å; F287-Y301 HydrophobicContact CZ-CE2 4.42Å; F287-Y301 HydrophobicContact CZ-CG 4.3Å
288	K	81.4	Confident	88.6	Confident	130 Å²	130	57.5 Å²	57.5	57%	0.565	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-70.5	-29.3	-172.8	-169.2	-168.5	170.7	-163.5	0	113.5	C281 P285 R286 F290	C281-K288 HydrophobicContact CB-CB 4.19Å; P285-K288 WeakPolarHBondContact O-CB 3.1Å; P285-K288 PolarHBondContact O-N 3.43Å; R286-K288 VanDerWaalsContact C-N 3.31Å; R286-K288 PolarHBondContact O-N 3.18Å; K288-F290 WeakPolarHBondContact O-CD2 3.21Å; K288-F290 VanDerWaalsContact O-CE2 3.28Å; K288-F290 WeakPolarHBondContact O-CE2 3.47Å; K288-F290 PolarHBondContact O-N 2.84Å
289	D	79.9	Confident	89.2	Confident	110 Å²	110	53.5 Å²	53.5	59%	0.588	25%	0.254	S	S	*	.	G	3₁₀ helix	trans	-83.2	11	-170.5	-59.7	-31.6	0	0	0	113.4	F287 Q291	F287-D289 PolarHBondContact O-N 2.91Å; D289-Q291 HydrophobicContact CB-CG 4.36Å; D289-Q291 PolarHBondContact O-N 2.9Å
290	F	79.1	Confident	89.6	Confident	88 Å²	88	55.5 Å²	55.5	39%	0.386	26%	0.263	S	S	.	.			trans	51.3	26.7	178.8	-61.3	-88.7	0	0	0	114.6	L196 N198 T199 F277 K288	L196-F290 HydrophobicContact CB-CE1 4.18Å; N198-F290 WeakPolarHBondContact CB-O 3.3Å; N198-F290 PolarHBondContact ND2-O 2.92Å; T199-F290 HydrophobicContact CG2-CD1 4.45Å; F277-F290 HydrophobicContact CD1-CE1 4.4Å; F277-F290 HydrophobicContact CE1-CD1 4.27Å; F277-F290 AromaticContact CE1-CE1 3.81Å; F277-F290 HydrophobicContact CE1-CE1 3.81Å; F277-F290 HydrophobicContact CE1-CZ 4.31Å; K288-F290 WeakPolarHBondContact O-CD2 3.21Å; K288-F290 VanDerWaalsContact O-CE2 3.28Å; K288-F290 WeakPolarHBondContact O-CE2 3.47Å; K288-F290 PolarHBondContact O-N 2.84Å
291	Q	85.8	Confident	89.8	Confident	115 Å²	115	60.4 Å²	60.4	54%	0.537	28%	0.282	S	S	.	.			trans	-72.2	161.5	169.3	-64.3	-178	-4.3	0	0	110.7	D289	D289-Q291 HydrophobicContact CB-CG 4.36Å; D289-Q291 PolarHBondContact O-N 2.9Å
292	Q	88.1	Confident	90.2	Very high	74 Å²	74	59.8 Å²	59.8	35%	0.346	28%	0.278	S	S	.	.			trans	-70.1	137.9	165.2	-65.9	-179.8	9.4	0	0	108.9	N198	N198-Q292 HydrophobicContact CB-CG 3.83Å; N198-Q292 WeakPolarHBondContact OD1-CG 3.34Å; N198-Q292 PolarHBondContact OD1-NE2 2.84Å
293	Q	93.1	Very high	90.7	Very high	34 Å²	34	54.8 Å²	54.8	16%	0.159	26%	0.255	C	S	.	.			trans	-143.3	164.9	-172.6	-65.3	-69.6	-21	0	0	109.3	F201 F287	F201-Q293 WeakPolarHBondContact CB-O 3.36Å; F201-Q293 HydrophobicContact CD1-CB 4.4Å; F201-Q293 HydrophobicContact CD2-CB 3.96Å; F201-Q293 HydrophobicContact CE1-CB 4.1Å; F201-Q293 HydrophobicContact CE2-CB 3.6Å; F201-Q293 HydrophobicContact CE2-CG 4.36Å; F201-Q293 HydrophobicContact CG-CB 4.37Å; F201-Q293 WeakPolarHBondContact CG-O 3.48Å; F201-Q293 HydrophobicContact CZ-CB 3.71Å; F201-Q293 HydrophobicContact CZ-CG 4.08Å; F287-Q293 HydrophobicContact CD1-CB 4.12Å; F287-Q293 HydrophobicContact CD1-CG 3.96Å; F287-Q293 HydrophobicContact CE1-CB 4.04Å; F287-Q293 HydrophobicContact CE1-CG 4.25Å
294	D	94.4	Very high	91	Very high	35 Å²	35	53.2 Å²	53.2	19%	0.187	25%	0.251	C	S	.	.			trans	-78.1	140	-179	-160.4	-73.6	0	0	0	112.6	Q296 E297 L298 F690 Y748 Y807	D294-Q296 WeakPolarHBondContact OD1-CB 3.48Å; D294-Q296 PolarHBondContact OD1-N 3.1Å; D294-E297 HydrophobicContact CB-CB 3.98Å; D294-L298 WeakPolarHBondContact O-CB 3.43Å; D294-L298 PolarHBondContact O-N 3.41Å; D294-L298 VanDerWaalsContact O-N 3.13Å; D294-F690 WeakPolarHBondContact OD2-CE2 3.29Å; D294-Y748 PolarHBondContact OD2-OH 3.33Å; D294-Y807 PolarHBondContact OD1-OH 2.97Å; D294-Y807 PolarHBondContact OD2-OH 2.98Å
295	S	96.1	Very high	91.3	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-76.5	-28	179.8	67.8	0	0	0	0	113.6	V205 L299 Y748 Y807	V205-S295 WeakPolarHBondContact CG2-O 3.28Å; S295-L299 WeakPolarHBondContact O-CB 3.45Å; S295-L299 PolarHBondContact O-N 3.49Å; S295-L299 VanDerWaalsContact O-N 3.13Å; S295-Y748 WeakPolarHBondContact OG-CE1 3.11Å; S295-Y807 VanDerWaalsContact OG-CD1 3.3Å; S295-Y807 WeakPolarHBondContact OG-CD1 3.48Å; S295-Y807 VanDerWaalsContact OG-CE1 3.27Å; S295-Y807 WeakPolarHBondContact OG-CE1 3.37Å
296	Q	96.2	Very high	91.7	Very high	27 Å²	27	49.7 Å²	49.7	13%	0.126	23%	0.229	C	C	.	.	H	α-helix	trans	-70	-47	170.5	-168.4	-160.2	6.5	0	0	110.5	D294 L298 L299 H300 D380 S382 H686 Y807 L808	D294-Q296 WeakPolarHBondContact OD1-CB 3.48Å; D294-Q296 PolarHBondContact OD1-N 3.1Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; Q296-L298 PolarHBondContact O-N 2.88Å; Q296-L299 WeakPolarHBondContact O-CB 3.47Å; Q296-L299 PolarHBondContact O-N 2.95Å; Q296-L299 VanDerWaalsContact O-N 3.1Å; Q296-H300 PolarHBondContact NE2-CE1 3.41Å; Q296-H300 PolarHBondContact O-N 3.18Å; Q296-D380 VanDerWaalsContact NE2-CG 3.31Å; Q296-D380 PolarHBondContact NE2-OD1 3.17Å; Q296-D380 PolarHBondContact NE2-OD2 2.83Å; Q296-D380 VanDerWaalsContact NE2-OD2 3.17Å; Q296-S382 PolarHBondContact NE2-OG 3.4Å; Q296-H686 VanDerWaalsContact CD-ND1 3.3Å; Q296-H686 HydrophobicContact CG-CB 4.47Å; Q296-H686 PolarHBondContact NE2-ND1 3.49Å; Q296-H686 PolarHBondContact OE1-CE1 3.49Å; Q296-H686 PolarHBondContact OE1-ND1 3.12Å; Q296-Y807 HydrophobicContact CB-CE1 4.32Å; Q296-L808 HydrophobicContact CB-CD2 4.15Å; Q296-L808 HydrophobicContact CG-CD2 4.3Å
297	E	95.6	Very high	91.9	Very high	49 Å²	49	46 Å²	46	23%	0.229	22%	0.215	C	C	.	.	H	α-helix	trans	-59	-45.6	179.8	-174.6	-176.2	147.1	0	0	111	R286 D294 L299 H300 Y301	R286-E297 WeakPolarHBondContact CD-OE1 3.38Å; R286-E297 IonicContact CZ-OE1 2.6Å; R286-E297 IonicContact NE-OE1 3.78Å; R286-E297 IonicContact NH1-OE1 3.6Å; R286-E297 PolarHBondContact NH1-OE1 2.94Å; R286-E297 IonicContact NH1-OE2 2.8Å; R286-E297 PolarHBondContact NH1-OE2 2.81Å; D294-E297 HydrophobicContact CB-CB 3.98Å; E297-L299 PolarHBondContact O-N 2.94Å; E297-H300 PolarHBondContact O-N 3.12Å; E297-Y301 HydrophobicContact CG-CD2 3.83Å; E297-Y301 HydrophobicContact CG-CE2 3.74Å; E297-Y301 VanDerWaalsContact O-CD2 3.32Å; E297-Y301 WeakPolarHBondContact O-CD2 3.34Å; E297-Y301 PolarHBondContact O-N 2.88Å; E297-Y301 WeakPolarHBondContact OE1-CE2 3.32Å
298	L	96.4	Very high	92.1	Very high	0 Å²	0	49 Å²	49	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-58.3	-47	172.9	176.5	106	0	0	0	112.3	F201 F202 V205 L280 F287 D294 Q296 H300 Y301 L302	F201-L298 HydrophobicContact CD2-CB 3.9Å; F201-L298 HydrophobicContact CD2-CD1 3.92Å; F201-L298 HydrophobicContact CD2-CD2 4.23Å; F201-L298 HydrophobicContact CD2-CG 4.22Å; F201-L298 HydrophobicContact CE2-CB 4.05Å; F201-L298 HydrophobicContact CE2-CD1 3.4Å; F201-L298 VanDerWaalsContact CE2-CD1 3.4Å; F201-L298 HydrophobicContact CE2-CG 4.17Å; F201-L298 HydrophobicContact CZ-CD1 4.36Å; F202-L298 HydrophobicContact CB-CD1 4.23Å; F202-L298 HydrophobicContact CB-CD2 4Å; F202-L298 HydrophobicContact CD2-CD1 3.84Å; F202-L298 HydrophobicContact CD2-CD2 3.95Å; F202-L298 HydrophobicContact CD2-CG 4.43Å; F202-L298 HydrophobicContact CG-CD2 4.36Å; V205-L298 HydrophobicContact CB-CD2 4.08Å; V205-L298 HydrophobicContact CG1-CD2 4.34Å; V205-L298 HydrophobicContact CG2-CD2 4.15Å; L280-L298 HydrophobicContact CD2-CD1 3.61Å; L280-L298 HydrophobicContact CD2-CG 4.27Å; F287-L298 HydrophobicContact CD1-CD1 4.05Å; F287-L298 HydrophobicContact CE1-CB 4.07Å; F287-L298 HydrophobicContact CE1-CD1 4.04Å; F287-L298 HydrophobicContact CG-CD1 4.31Å; F287-L298 HydrophobicContact CZ-CB 4.12Å; F287-L298 HydrophobicContact CZ-CD1 4.28Å; D294-L298 WeakPolarHBondContact O-CB 3.43Å; D294-L298 PolarHBondContact O-N 3.41Å; D294-L298 VanDerWaalsContact O-N 3.13Å; Q296-L298 VanDerWaalsContact C-N 3.33Å; Q296-L298 PolarHBondContact O-N 2.88Å; L298-H300 VanDerWaalsContact C-N 3.29Å; L298-H300 PolarHBondContact O-N 2.9Å; L298-Y301 PolarHBondContact O-N 3.12Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 PolarHBondContact O-N 3.26Å
299	L	97.1	Very high	92.6	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-56.9	-43.8	-180	171.7	67.2	0	0	0	111.2	V205 L209 S295 Q296 E297 L303 I684 L808 F810	V205-L299 HydrophobicContact CG1-CB 4.2Å; V205-L299 HydrophobicContact CG1-CD1 3.87Å; L209-L299 HydrophobicContact CD1-CD1 4.28Å; L209-L299 HydrophobicContact CD2-CD1 4.34Å; S295-L299 WeakPolarHBondContact O-CB 3.45Å; S295-L299 PolarHBondContact O-N 3.49Å; S295-L299 VanDerWaalsContact O-N 3.13Å; Q296-L299 WeakPolarHBondContact O-CB 3.47Å; Q296-L299 PolarHBondContact O-N 2.95Å; Q296-L299 VanDerWaalsContact O-N 3.1Å; E297-L299 PolarHBondContact O-N 2.94Å; L299-L303 HydrophobicContact CD1-CD1 3.61Å; L299-L303 HydrophobicContact CD1-CG 4.04Å; L299-L303 HydrophobicContact CG-CD1 4.09Å; L299-L303 WeakPolarHBondContact O-CB 3.33Å; L299-L303 WeakPolarHBondContact O-CG 3.41Å; L299-L303 PolarHBondContact O-N 2.69Å; L299-I684 HydrophobicContact CD1-CD1 4.42Å; L299-I684 HydrophobicContact CD2-CD1 3.85Å; L299-I684 HydrophobicContact CD2-CG2 4.06Å; L299-L808 HydrophobicContact CD2-CD1 4.16Å; L299-F810 HydrophobicContact CD2-CZ 4.25Å
300	H	95.7	Very high	93.1	Very high	58 Å²	58	39 Å²	39	27%	0.269	19%	0.185	S	C	.	.	H	α-helix	trans	-60.9	-55.6	173.6	-66	169.5	0	0	0	111.6	Q296 E297 L298 L302 L303 D304 D380	Q296-H300 PolarHBondContact NE2-CE1 3.41Å; Q296-H300 PolarHBondContact O-N 3.18Å; E297-H300 PolarHBondContact O-N 3.12Å; L298-H300 VanDerWaalsContact C-N 3.29Å; L298-H300 PolarHBondContact O-N 2.9Å; H300-L302 VanDerWaalsContact C-N 3.25Å; H300-L302 PolarHBondContact O-N 3.39Å; H300-L303 PolarHBondContact O-N 2.8Å; H300-D304 WeakPolarHBondContact O-CB 3.47Å; H300-D304 PolarHBondContact O-N 3.1Å; H300-D380 IonicContact CD2-OD1 3.75Å; H300-D380 IonicContact CE1-OD1 3.69Å; H300-D380 PolarHBondContact CE1-OD1 2.7Å; H300-D380 IonicContact NE2-OD1 3.31Å; H300-D380 PolarHBondContact NE2-OD1 3.36Å
301	Y	96.3	Very high	93.6	Very high	103 Å²	103	35.9 Å²	35.9	40%	0.404	17%	0.174	S	C	.	.	H	α-helix	trans	-58.6	-35.4	-179.1	-85.6	-68	0	0	0	113.3	A284 F287 E297 L298 A305	A284-Y301 HydrophobicContact CB-CD1 3.84Å; A284-Y301 HydrophobicContact CB-CE1 4.35Å; A284-Y301 HydrophobicContact CB-CG 4.08Å; F287-Y301 AromaticContact CE2-CD2 3.71Å; F287-Y301 HydrophobicContact CE2-CD2 3.71Å; F287-Y301 AromaticContact CE2-CG 3.9Å; F287-Y301 HydrophobicContact CE2-CG 3.9Å; F287-Y301 AromaticContact CZ-CD2 3.69Å; F287-Y301 HydrophobicContact CZ-CD2 3.69Å; F287-Y301 HydrophobicContact CZ-CE2 4.42Å; F287-Y301 HydrophobicContact CZ-CG 4.3Å; E297-Y301 HydrophobicContact CG-CD2 3.83Å; E297-Y301 HydrophobicContact CG-CE2 3.74Å; E297-Y301 VanDerWaalsContact O-CD2 3.32Å; E297-Y301 WeakPolarHBondContact O-CD2 3.34Å; E297-Y301 PolarHBondContact O-N 2.88Å; E297-Y301 WeakPolarHBondContact OE1-CE2 3.32Å; L298-Y301 PolarHBondContact O-N 3.12Å; Y301-A305 WeakPolarHBondContact O-CB 3.48Å; Y301-A305 PolarHBondContact O-N 2.97Å; Y301-A305 VanDerWaalsContact O-N 3.1Å
302	L	96.8	Very high	93.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-68.9	-51.5	176.1	177.8	60.5	0	0	0	111.5	M206 L209 L252 L276 L280 L298 H300 A305 V306	M206-L302 HydrophobicContact SD-CD2 3.64Å; L209-L302 HydrophobicContact CD1-CD2 3.9Å; L252-L302 HydrophobicContact CD1-CD1 4.28Å; L276-L302 HydrophobicContact CD1-CD1 4.43Å; L280-L302 HydrophobicContact CD1-CB 4.29Å; L280-L302 HydrophobicContact CD1-CD1 4.26Å; L280-L302 HydrophobicContact CD2-CB 4.31Å; L280-L302 HydrophobicContact CD2-CD1 4.44Å; L298-L302 WeakPolarHBondContact O-CB 3.44Å; L298-L302 PolarHBondContact O-N 3.26Å; H300-L302 VanDerWaalsContact C-N 3.25Å; H300-L302 PolarHBondContact O-N 3.39Å; L302-A305 PolarHBondContact O-N 3.37Å; L302-V306 HydrophobicContact CD1-CG2 4.39Å; L302-V306 WeakPolarHBondContact O-CG2 3.35Å; L302-V306 PolarHBondContact O-N 3.1Å; L302-V306 VanDerWaalsContact O-N 3.08Å
303	L	95.7	Very high	93.8	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.01	16%	0.158	C	C	.	.	H	α-helix	trans	-66.3	-44.7	-178	-69.8	177.3	0	0	0	111.6	L299 H300 A305 V306 R307 I351 F355 I379	L299-L303 HydrophobicContact CD1-CD1 3.61Å; L299-L303 HydrophobicContact CD1-CG 4.04Å; L299-L303 HydrophobicContact CG-CD1 4.09Å; L299-L303 WeakPolarHBondContact O-CB 3.33Å; L299-L303 WeakPolarHBondContact O-CG 3.41Å; L299-L303 PolarHBondContact O-N 2.69Å; H300-L303 PolarHBondContact O-N 2.8Å; L303-A305 PolarHBondContact O-N 2.55Å; L303-V306 PolarHBondContact O-N 3.29Å; L303-R307 WeakPolarHBondContact O-CB 3.37Å; L303-R307 PolarHBondContact O-N 2.83Å; L303-I351 HydrophobicContact CB-CG2 4.36Å; L303-I351 HydrophobicContact CD2-CD1 4.08Å; L303-I351 HydrophobicContact CD2-CG2 4.48Å; L303-F355 HydrophobicContact CD1-CD2 4.27Å; L303-F355 HydrophobicContact CD1-CG 4.23Å; L303-F355 HydrophobicContact CD2-CD2 3.96Å; L303-F355 HydrophobicContact CD2-CE2 3.76Å; L303-F355 HydrophobicContact CD2-CZ 4.36Å; L303-I379 HydrophobicContact CD1-CG2 3.61Å
304	D	94.4	Very high	93.5	Very high	63 Å²	63	31.6 Å²	31.6	34%	0.337	15%	0.151	S	C	.	.	H	α-helix	trans	-69.3	-32	178.1	-84.3	-37.2	0	0	0	113	H300 R307 T308	H300-D304 WeakPolarHBondContact O-CB 3.47Å; H300-D304 PolarHBondContact O-N 3.1Å; D304-R307 IonicContact OD1-NH1 3.8Å; D304-T308 WeakPolarHBondContact O-CB 3.27Å; D304-T308 PolarHBondContact O-N 3.2Å; D304-T308 PolarHBondContact O-OG1 2.7Å
305	A	94.4	Very high	93.3	Very high	18 Å²	18	30.4 Å²	30.4	15%	0.149	15%	0.145	C	C	.	.	H	α-helix	trans	-68.2	-41.6	173.9	0	0	0	0	0	112.1	L252 K283 Y301 L302 L303 E309	L252-A305 HydrophobicContact CD2-CB 3.44Å; L252-A305 VanDerWaalsContact CD2-CB 3.44Å; K283-A305 HydrophobicContact CB-CB 4.16Å; K283-A305 HydrophobicContact CG-CB 4.15Å; Y301-A305 WeakPolarHBondContact O-CB 3.48Å; Y301-A305 PolarHBondContact O-N 2.97Å; Y301-A305 VanDerWaalsContact O-N 3.1Å; L302-A305 PolarHBondContact O-N 3.37Å; L303-A305 PolarHBondContact O-N 2.55Å; A305-E309 WeakPolarHBondContact O-CB 3.26Å; A305-E309 PolarHBondContact O-N 2.89Å
306	V	93.6	Very high	92.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-66.5	-45.4	173.8	171.3	0	0	0	0	110.9	L252 T253 L256 L302 L303 T308 E309 E310 F350 I351	L252-V306 HydrophobicContact CD2-CG2 3.88Å; L252-V306 HydrophobicContact CG-CG2 3.9Å; T253-V306 HydrophobicContact CG2-CG1 4.27Å; L256-V306 HydrophobicContact CD2-CG1 4.46Å; L256-V306 HydrophobicContact CD2-CG2 3.95Å; L302-V306 HydrophobicContact CD1-CG2 4.39Å; L302-V306 WeakPolarHBondContact O-CG2 3.35Å; L302-V306 PolarHBondContact O-N 3.1Å; L302-V306 VanDerWaalsContact O-N 3.08Å; L303-V306 PolarHBondContact O-N 3.29Å; V306-T308 VanDerWaalsContact C-N 3.32Å; V306-T308 PolarHBondContact O-N 3.03Å; V306-E309 PolarHBondContact O-N 3.46Å; V306-E309 VanDerWaalsContact O-N 3.14Å; V306-E310 PolarHBondContact O-N 3.28Å; V306-F350 HydrophobicContact CG1-CE2 4.22Å; V306-F350 HydrophobicContact CG1-CZ 3.67Å; V306-I351 HydrophobicContact CG1-CD1 3.86Å; V306-I351 HydrophobicContact CG1-CG1 3.95Å
307	R	92.6	Very high	92.5	Very high	58 Å²	58	30.3 Å²	30.3	22%	0.219	15%	0.148	C	C	.	.	H	α-helix	trans	-57.1	-44.7	175.2	-172.7	-175.9	-175.9	-156.4	2.2	111.3	L303 D304 T311 N349 I351 D352 I356	L303-R307 WeakPolarHBondContact O-CB 3.37Å; L303-R307 PolarHBondContact O-N 2.83Å; D304-R307 IonicContact OD1-NH1 3.8Å; R307-T311 VanDerWaalsContact O-CB 3.24Å; R307-T311 WeakPolarHBondContact O-CB 3.46Å; R307-T311 PolarHBondContact O-N 3.33Å; R307-T311 PolarHBondContact O-OG1 2.92Å; R307-N349 WeakPolarHBondContact CG-ND2 3.41Å; R307-N349 PolarHBondContact O-ND2 2.73Å; R307-I351 HydrophobicContact CB-CB 4.1Å; R307-I351 HydrophobicContact CB-CG1 4.21Å; R307-I351 HydrophobicContact CB-CG2 4.09Å; R307-I351 HydrophobicContact CG-CB 4.27Å; R307-I351 HydrophobicContact CG-CG2 4.34Å; R307-D352 WeakPolarHBondContact CG-OD1 3.41Å; R307-D352 IonicContact CZ-OD1 2.6Å; R307-D352 IonicContact CZ-OD2 3.18Å; R307-D352 IonicContact NE-OD1 2.69Å; R307-D352 PolarHBondContact NE-OD1 2.58Å; R307-D352 IonicContact NE-OD2 2.73Å; R307-D352 PolarHBondContact NE-OD2 2.85Å; R307-D352 IonicContact NH2-OD1 2.63Å; R307-D352 IonicContact NH2-OD2 2.75Å; R307-D352 PolarHBondContact NH2-OD2 2.99Å; R307-I356 VanDerWaalsContact NH2-CD1 3.29Å
308	T	92.5	Very high	92.1	Very high	65 Å²	65	28 Å²	28	40%	0.399	14%	0.138	S	C	.	.	H	α-helix	trans	-64.7	-38.2	176.5	-65.1	0	0	0	0	112.2	D304 V306 K312	D304-T308 WeakPolarHBondContact O-CB 3.27Å; D304-T308 PolarHBondContact O-N 3.2Å; D304-T308 PolarHBondContact O-OG1 2.7Å; V306-T308 VanDerWaalsContact C-N 3.32Å; V306-T308 PolarHBondContact O-N 3.03Å; T308-K312 HydrophobicContact CG2-CD 4.27Å; T308-K312 WeakPolarHBondContact O-CG 3.34Å; T308-K312 PolarHBondContact O-N 3.43Å; T308-K312 VanDerWaalsContact O-N 3.14Å
309	E	91.4	Very high	91.7	Very high	24 Å²	24	28.2 Å²	28.2	11%	0.112	14%	0.138	C	C	.	.	H	α-helix	trans	-68.2	-45.1	178.3	-168	155.5	101.6	0	0	111.5	G250 L252 T253 K283 A305 V306 K312 R313	G250-E309 WeakPolarHBondContact CA-OE1 3.19Å; L252-E309 WeakPolarHBondContact CA-OE1 3.43Å; L252-E309 PolarHBondContact N-OE1 2.87Å; T253-E309 PolarHBondContact N-OE1 2.96Å; T253-E309 PolarHBondContact OG1-OE1 3.4Å; K283-E309 WeakPolarHBondContact CE-OE2 3.47Å; K283-E309 IonicContact NZ-OE2 2.73Å; K283-E309 PolarHBondContact NZ-OE2 3.01Å; A305-E309 WeakPolarHBondContact O-CB 3.26Å; A305-E309 PolarHBondContact O-N 2.89Å; V306-E309 PolarHBondContact O-N 3.46Å; V306-E309 VanDerWaalsContact O-N 3.14Å; E309-K312 PolarHBondContact O-N 3.02Å; E309-R313 PolarHBondContact O-N 3.25Å; E309-R313 VanDerWaalsContact O-N 3.15Å
310	E	89.6	Confident	91.2	Very high	5 Å²	5	33.9 Å²	33.9	2%	0.023	16%	0.163	C	C	.	.	H	α-helix	trans	-68	-38.1	174.8	-170.4	62.5	-160.9	0	0	112.4	V306 K312 R313 I314 F350	V306-E310 PolarHBondContact O-N 3.28Å; E310-K312 VanDerWaalsContact C-N 3.33Å; E310-K312 PolarHBondContact O-N 3.26Å; E310-R313 VanDerWaalsContact CD-NH1 3.26Å; E310-R313 WeakPolarHBondContact O-CB 3.41Å; E310-R313 PolarHBondContact O-N 2.91Å; E310-R313 VanDerWaalsContact O-N 3.13Å; E310-R313 IonicContact OE1-CZ 2.7Å; E310-R313 IonicContact OE1-NH1 2.62Å; E310-R313 PolarHBondContact OE1-NH1 2.88Å; E310-R313 WeakPolarHBondContact OE2-CD 3.43Å; E310-R313 IonicContact OE2-CZ 3.44Å; E310-R313 IonicContact OE2-NH1 2.71Å; E310-R313 PolarHBondContact OE2-NH1 3.11Å; E310-I314 HydrophobicContact CG-CD1 4.1Å; E310-I314 HydrophobicContact CG-CG1 4.49Å; E310-I314 WeakPolarHBondContact O-CG1 3.22Å; E310-I314 PolarHBondContact O-N 2.79Å; E310-F350 HydrophobicContact CB-CE1 3.99Å; E310-F350 HydrophobicContact CG-CD1 3.87Å; E310-F350 HydrophobicContact CG-CE1 3.72Å
311	T	90.4	Very high	90.8	Very high	23 Å²	23	33.4 Å²	33.4	14%	0.141	17%	0.169	C	C	.	.	H	α-helix	trans	-59	-45.3	176.2	-64.6	0	0	0	0	111.4	R307 R313 I314 Q315 V346 N349	R307-T311 VanDerWaalsContact O-CB 3.24Å; R307-T311 WeakPolarHBondContact O-CB 3.46Å; R307-T311 PolarHBondContact O-N 3.33Å; R307-T311 PolarHBondContact O-OG1 2.92Å; T311-R313 VanDerWaalsContact C-N 3.33Å; T311-R313 PolarHBondContact O-N 2.9Å; T311-I314 PolarHBondContact O-N 3.13Å; T311-Q315 HydrophobicContact CG2-CG 4.49Å; T311-Q315 WeakPolarHBondContact O-CB 3.47Å; T311-Q315 VanDerWaalsContact O-CG 3.28Å; T311-Q315 WeakPolarHBondContact O-CG 3.5Å; T311-Q315 PolarHBondContact O-N 3.48Å; T311-V346 HydrophobicContact CG2-CG2 3.97Å; T311-N349 PolarHBondContact OG1-ND2 3.14Å; T311-N349 VanDerWaalsContact OG1-ND2 3.11Å
312	K	89.6	Confident	90.3	Very high	116 Å²	116	30.7 Å²	30.7	50%	0.504	16%	0.159	S	C	.	.	H	α-helix	trans	-64.2	-37.5	175.9	-73.5	169.5	-177.9	174	0	112.1	T308 E309 E310 Q315 A316	T308-K312 HydrophobicContact CG2-CD 4.27Å; T308-K312 WeakPolarHBondContact O-CG 3.34Å; T308-K312 PolarHBondContact O-N 3.43Å; T308-K312 VanDerWaalsContact O-N 3.14Å; E309-K312 PolarHBondContact O-N 3.02Å; E310-K312 VanDerWaalsContact C-N 3.33Å; E310-K312 PolarHBondContact O-N 3.26Å; K312-Q315 PolarHBondContact O-N 3.13Å; K312-A316 VanDerWaalsContact O-CB 3.27Å; K312-A316 WeakPolarHBondContact O-CB 3.38Å; K312-A316 PolarHBondContact O-N 3.17Å
313	R	87.8	Confident	89.8	Confident	15 Å²	15	37.9 Å²	37.9	6%	0.057	20%	0.198	C	C	.	.	H	α-helix	trans	-63.4	-47.5	175.7	176.6	174.4	173.3	-130.5	2.9	111.9	I222 S247 E309 E310 T311 A316 S317	I222-R313 VanDerWaalsContact CG2-NH1 3.26Å; S247-R313 VanDerWaalsContact O-CZ 3.22Å; S247-R313 PolarHBondContact O-NE 2.86Å; S247-R313 PolarHBondContact O-NH2 3.49Å; E309-R313 PolarHBondContact O-N 3.25Å; E309-R313 VanDerWaalsContact O-N 3.15Å; E310-R313 VanDerWaalsContact CD-NH1 3.26Å; E310-R313 WeakPolarHBondContact O-CB 3.41Å; E310-R313 PolarHBondContact O-N 2.91Å; E310-R313 VanDerWaalsContact O-N 3.13Å; E310-R313 IonicContact OE1-CZ 2.7Å; E310-R313 IonicContact OE1-NH1 2.62Å; E310-R313 PolarHBondContact OE1-NH1 2.88Å; E310-R313 WeakPolarHBondContact OE2-CD 3.43Å; E310-R313 IonicContact OE2-CZ 3.44Å; E310-R313 IonicContact OE2-NH1 2.71Å; E310-R313 PolarHBondContact OE2-NH1 3.11Å; T311-R313 VanDerWaalsContact C-N 3.33Å; T311-R313 PolarHBondContact O-N 2.9Å; R313-A316 PolarHBondContact O-N 2.71Å; R313-S317 PolarHBondContact O-N 3.06Å; R313-S317 VanDerWaalsContact O-N 3.09Å
314	I	88.1	Confident	89.2	Confident	2 Å²	2	41.3 Å²	41.3	1%	0.01	22%	0.216	C	C	.	.	H	α-helix	trans	-61.2	-48.2	174.9	-65.7	169.6	0	0	0	110.6	L229 I231 L246 E310 T311 A316 S317 I318	L229-I314 HydrophobicContact CD2-CD1 4.16Å; L229-I314 HydrophobicContact CD2-CG1 3.97Å; L229-I314 HydrophobicContact CD2-CG2 3.93Å; I231-I314 HydrophobicContact CD1-CG2 4.5Å; L246-I314 HydrophobicContact CD2-CG1 4.09Å; E310-I314 HydrophobicContact CG-CD1 4.1Å; E310-I314 HydrophobicContact CG-CG1 4.49Å; E310-I314 WeakPolarHBondContact O-CG1 3.22Å; E310-I314 PolarHBondContact O-N 2.79Å; T311-I314 PolarHBondContact O-N 3.13Å; I314-A316 PolarHBondContact O-N 3.2Å; I314-S317 PolarHBondContact O-N 3.25Å; I314-I318 HydrophobicContact CG2-CD1 3.93Å; I314-I318 WeakPolarHBondContact O-CG1 3.5Å; I314-I318 PolarHBondContact O-N 3.11Å
315	Q	89	Confident	88.6	Confident	11 Å²	11	38.7 Å²	38.7	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-62.1	-41.8	179.3	-73	-179.6	-10	0	0	112.9	T311 K312 S317 I318 L319 L565	T311-Q315 HydrophobicContact CG2-CG 4.49Å; T311-Q315 WeakPolarHBondContact O-CB 3.47Å; T311-Q315 VanDerWaalsContact O-CG 3.28Å; T311-Q315 WeakPolarHBondContact O-CG 3.5Å; T311-Q315 PolarHBondContact O-N 3.48Å; K312-Q315 PolarHBondContact O-N 3.13Å; Q315-S317 PolarHBondContact O-N 3.21Å; Q315-I318 PolarHBondContact O-N 2.67Å; Q315-L319 WeakPolarHBondContact O-CG 3.39Å; Q315-L319 PolarHBondContact O-N 3.1Å; Q315-L565 PolarHBondContact NE2-O 3.5Å
316	A	87.8	Confident	87.8	Confident	19 Å²	19	40.4 Å²	40.4	16%	0.157	21%	0.211	C	C	.	.	H	α-helix	trans	-62.5	-40.8	175.3	0	0	0	0	0	112.2	K312 R313 I314 L319 K320 I560	K312-A316 VanDerWaalsContact O-CB 3.27Å; K312-A316 WeakPolarHBondContact O-CB 3.38Å; K312-A316 PolarHBondContact O-N 3.17Å; R313-A316 PolarHBondContact O-N 2.71Å; I314-A316 PolarHBondContact O-N 3.2Å; A316-L319 PolarHBondContact O-N 3.05Å; A316-K320 WeakPolarHBondContact O-CB 3.39Å; A316-K320 PolarHBondContact O-N 3.23Å; A316-I560 HydrophobicContact CB-CD1 4.42Å
317	S	87	Confident	86.8	Confident	6 Å²	6	42.8 Å²	42.8	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-68.4	-32.3	175.7	-75.1	0	0	0	0	113.4	E245 L246 R313 I314 Q315 A321	E245-S317 WeakPolarHBondContact O-CB 3.21Å; E245-S317 PolarHBondContact O-OG 3.24Å; L246-S317 WeakPolarHBondContact CA-OG 3.41Å; R313-S317 PolarHBondContact O-N 3.06Å; R313-S317 VanDerWaalsContact O-N 3.09Å; I314-S317 PolarHBondContact O-N 3.25Å; Q315-S317 PolarHBondContact O-N 3.21Å; S317-A321 PolarHBondContact O-N 2.92Å; S317-A321 VanDerWaalsContact O-N 3.15Å
318	I	88.3	Confident	85.7	Confident	1 Å²	1	49.4 Å²	49.4	1%	0.005	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-48.9	170	-64.6	162.3	0	0	0	110.3	I231 L242 V244 I314 Q315 K320 A321 F322 Y341	I231-I318 HydrophobicContact CD1-CD1 3.61Å; I231-I318 HydrophobicContact CD1-CG1 3.62Å; L242-I318 HydrophobicContact CD2-CG2 4.42Å; V244-I318 HydrophobicContact CG1-CG1 4.2Å; I314-I318 HydrophobicContact CG2-CD1 3.93Å; I314-I318 WeakPolarHBondContact O-CG1 3.5Å; I314-I318 PolarHBondContact O-N 3.11Å; Q315-I318 PolarHBondContact O-N 2.67Å; I318-K320 VanDerWaalsContact C-N 3.32Å; I318-K320 PolarHBondContact O-N 3.14Å; I318-A321 WeakPolarHBondContact O-CB 3.42Å; I318-A321 PolarHBondContact O-N 3.25Å; I318-A321 VanDerWaalsContact O-N 3.1Å; I318-F322 HydrophobicContact CG2-CD2 4.26Å; I318-F322 HydrophobicContact CG2-CE2 4.28Å; I318-F322 WeakPolarHBondContact O-CD2 3.4Å; I318-F322 PolarHBondContact O-N 3.04Å; I318-Y341 WeakPolarHBondContact CD1-O 3.35Å
319	L	87.9	Confident	84.9	Confident	3 Å²	3	51.3 Å²	51.3	2%	0.016	27%	0.268	C	S	.	.	H	α-helix	trans	-59.4	-42.7	177.8	-70.8	174	0	0	0	111.9	Q315 A316 A321 F322 N323 N324 P325 V338 A559 I560 L563 L565	Q315-L319 WeakPolarHBondContact O-CG 3.39Å; Q315-L319 PolarHBondContact O-N 3.1Å; A316-L319 PolarHBondContact O-N 3.05Å; L319-A321 VanDerWaalsContact C-N 3.28Å; L319-A321 PolarHBondContact O-N 3.26Å; L319-F322 CarbonylContact O-C 3.56Å; L319-F322 PolarHBondContact O-N 3.19Å; L319-N323 PolarHBondContact O-N 3.27Å; L319-N324 WeakPolarHBondContact O-CA 3.36Å; L319-N324 PolarHBondContact O-N 2.91Å; L319-P325 HydrophobicContact CD2-CG 3.9Å; L319-P325 WeakPolarHBondContact O-CD 3.22Å; L319-V338 HydrophobicContact CD2-CG1 3.81Å; L319-A559 HydrophobicContact CD1-CB 4.34Å; L319-I560 HydrophobicContact CD1-CB 4.42Å; L319-I560 HydrophobicContact CD1-CG1 3.45Å; L319-I560 VanDerWaalsContact CD1-CG1 3.45Å; L319-L563 HydrophobicContact CD2-CD1 3.56Å; L319-L565 HydrophobicContact CD1-CD1 4.11Å; L319-L565 HydrophobicContact CD2-CD1 4.03Å; L319-L565 HydrophobicContact CG-CD1 4.1Å
320	K	87.5	Confident	84.3	Confident	120 Å²	120	50.5 Å²	50.5	52%	0.522	27%	0.266	S	S	.	.	H	α-helix	trans	-57.3	-40	174.6	-173	-170.6	173.7	-162.1	0	111.9	E245 A316 I318 F322 N323 N324	E245-K320 IonicContact OE2-NZ 3.59Å; A316-K320 WeakPolarHBondContact O-CB 3.39Å; A316-K320 PolarHBondContact O-N 3.23Å; I318-K320 VanDerWaalsContact C-N 3.32Å; I318-K320 PolarHBondContact O-N 3.14Å; K320-F322 PolarHBondContact O-N 2.96Å; K320-N323 PolarHBondContact O-N 3.13Å; K320-N323 VanDerWaalsContact O-N 3.11Å; K320-N324 WeakPolarHBondContact CA-OD1 3.36Å; K320-N324 PolarHBondContact N-OD1 2.76Å
321	A	86.8	Confident	84.1	Confident	47 Å²	47	54.2 Å²	54.2	39%	0.388	29%	0.285	S	S	.	.	H	α-helix	trans	-66.8	-21.9	177.7	0	0	0	0	0	113.8	L242 V244 S317 I318 L319	L242-A321 HydrophobicContact CD1-CB 4.33Å; V244-A321 HydrophobicContact CG1-CB 4.13Å; S317-A321 PolarHBondContact O-N 2.92Å; S317-A321 VanDerWaalsContact O-N 3.15Å; I318-A321 WeakPolarHBondContact O-CB 3.42Å; I318-A321 PolarHBondContact O-N 3.25Å; I318-A321 VanDerWaalsContact O-N 3.1Å; L319-A321 VanDerWaalsContact C-N 3.28Å; L319-A321 PolarHBondContact O-N 3.26Å
322	F	86.3	Confident	83.8	Confident	46 Å²	46	57.6 Å²	57.6	20%	0.202	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	21.2	172.4	-69.4	-78.8	0	0	0	113.2	L242 I318 L319 K320 P325 T334 K337 V338 Y341	L242-F322 HydrophobicContact CD2-CE2 3.82Å; L242-F322 HydrophobicContact CD2-CZ 4.39Å; I318-F322 HydrophobicContact CG2-CD2 4.26Å; I318-F322 HydrophobicContact CG2-CE2 4.28Å; I318-F322 WeakPolarHBondContact O-CD2 3.4Å; I318-F322 PolarHBondContact O-N 3.04Å; L319-F322 CarbonylContact O-C 3.56Å; L319-F322 PolarHBondContact O-N 3.19Å; K320-F322 PolarHBondContact O-N 2.96Å; F322-P325 HydrophobicContact CB-CG 3.9Å; F322-P325 WeakPolarHBondContact O-CD 3.21Å; F322-T334 HydrophobicContact CB-CG2 4.21Å; F322-T334 HydrophobicContact CD1-CG2 4.08Å; F322-T334 HydrophobicContact CG-CG2 4.33Å; F322-K337 HydrophobicContact CE1-CB 4.34Å; F322-K337 HydrophobicContact CE1-CD 4.44Å; F322-K337 HydrophobicContact CZ-CB 4.23Å; F322-V338 HydrophobicContact CB-CG2 4.05Å; F322-V338 HydrophobicContact CD2-CG2 3.52Å; F322-V338 HydrophobicContact CE2-CG2 4.13Å; F322-V338 HydrophobicContact CG-CG2 3.76Å; F322-Y341 AromaticContact CE2-CD2 3.75Å; F322-Y341 HydrophobicContact CE2-CD2 3.75Å; F322-Y341 HydrophobicContact CE2-CE2 4.11Å; F322-Y341 AromaticContact CZ-CD2 3.75Å; F322-Y341 HydrophobicContact CZ-CD2 3.75Å; F322-Y341 AromaticContact CZ-CE2 3.61Å; F322-Y341 HydrophobicContact CZ-CE2 3.61Å
323	N	85	Confident	83.5	Confident	151 Å²	151	57.7 Å²	57.7	81%	0.807	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.3	35.5	-179.2	-53.8	-67.8	0	0	0	115	L319 K320	L319-N323 PolarHBondContact O-N 3.27Å; K320-N323 PolarHBondContact O-N 3.13Å; K320-N323 VanDerWaalsContact O-N 3.11Å
324	N	83.9	Confident	83.4	Confident	75 Å²	75	58.3 Å²	58.3	40%	0.401	31%	0.31	S	S	.	.	S	Bend	trans	53.6	63.9	-178.2	-65.7	-29.1	0	0	0	113	L319 K320	L319-N324 WeakPolarHBondContact O-CA 3.36Å; L319-N324 PolarHBondContact O-N 2.91Å; K320-N324 WeakPolarHBondContact CA-OD1 3.36Å; K320-N324 PolarHBondContact N-OD1 2.76Å
325	P	80.3	Confident	83.2	Confident	7 Å²	7	62.6 Å²	62.6	5%	0.045	33%	0.326	C	S	.	.			trans	-62.1	144.2	179.9	23.8	-28.4	0	0	0	111.1	L319 F322 A330 T334 V338 L563	L319-P325 HydrophobicContact CD2-CG 3.9Å; L319-P325 WeakPolarHBondContact O-CD 3.22Å; F322-P325 HydrophobicContact CB-CG 3.9Å; F322-P325 WeakPolarHBondContact O-CD 3.21Å; P325-A330 HydrophobicContact CB-CB 3.78Å; P325-T334 HydrophobicContact CB-CG2 4.19Å; P325-T334 HydrophobicContact CG-CG2 4.29Å; P325-V338 HydrophobicContact CG-CG2 4.08Å; P325-L563 HydrophobicContact CB-CD1 4.19Å; P325-L563 HydrophobicContact CG-CD1 3.95Å; P325-L563 VanDerWaalsContact O-CD1 3.24Å; P325-L563 WeakPolarHBondContact O-CD1 3.48Å
326	T	79.1	Confident	83	Confident	54 Å²	54	69.2 Å²	69.2	33%	0.331	36%	0.355	S	S	.	.			trans	-117.9	164.9	173.8	72.1	0	0	0	0	110.1	K328 T329 A330	T326-K328 PolarHBondContact O-N 3.42Å; T326-K328 PolarHBondContact OG1-N 3.26Å; T326-T329 PolarHBondContact N-OG1 3.31Å; T326-T329 PolarHBondContact O-N 3.15Å; T326-T329 VanDerWaalsContact O-N 3.07Å; T326-T329 PolarHBondContact OG1-N 3.46Å; T326-T329 VanDerWaalsContact OG1-N 3.12Å; T326-T329 PolarHBondContact OG1-OG1 2.87Å; T326-A330 WeakPolarHBondContact O-CB 3.45Å; T326-A330 PolarHBondContact O-N 3.25Å
327	T	71.9	Confident	82.9	Confident	51 Å²	51	71 Å²	71	31%	0.313	36%	0.359	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-21.1	173.5	37.6	0	0	0	0	114.3	E562 L563	T327-E562 WeakPolarHBondContact CB-OE2 3.04Å; T327-E562 HydrophobicContact CG2-CB 3.76Å; T327-E562 WeakPolarHBondContact CG2-O 3.32Å; T327-E562 WeakPolarHBondContact CG2-OE2 3.48Å; T327-E562 PolarHBondContact OG1-OE2 3.32Å; T327-L563 HydrophobicContact CG2-CD2 4.27Å
328	K	70.1	Confident	82.8	Confident	197 Å²	197	70.8 Å²	70.8	86%	0.857	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.7	-17.7	177.8	-62.8	178.4	-177.4	174.3	0	114.7	T326	T326-K328 PolarHBondContact O-N 3.42Å; T326-K328 PolarHBondContact OG1-N 3.26Å
329	T	75.3	Confident	82.7	Confident	104 Å²	104	77.5 Å²	77.5	64%	0.638	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.5	-12.3	-178.5	57.5	0	0	0	0	113.8	T326	T326-T329 PolarHBondContact N-OG1 3.31Å; T326-T329 PolarHBondContact O-N 3.15Å; T326-T329 VanDerWaalsContact O-N 3.07Å; T326-T329 PolarHBondContact OG1-N 3.46Å; T326-T329 VanDerWaalsContact OG1-N 3.12Å; T326-T329 PolarHBondContact OG1-OG1 2.87Å
330	A	79.2	Confident	82.6	Confident	8 Å²	8	78.8 Å²	78.8	7%	0.066	40%	0.398	C	S	.	.			trans	-89.7	117.9	178	0	0	0	0	0	111.5	P325 T326 R335 L563	P325-A330 HydrophobicContact CB-CB 3.78Å; T326-A330 WeakPolarHBondContact O-CB 3.45Å; T326-A330 PolarHBondContact O-N 3.25Å; A330-R335 PolarHBondContact O-NH2 3.27Å; A330-L563 HydrophobicContact CB-CD2 4.36Å
331	D	84.4	Confident	82.5	Confident	82 Å²	82	73.8 Å²	73.8	44%	0.439	38%	0.376	S	S	.	.			trans	-61.3	160.3	161.4	67.3	-79.1	0	0	0	111.3	E333 T334 R335	D331-E333 PolarHBondContact O-N 3.13Å; D331-E333 WeakPolarHBondContact OD2-CA 3.45Å; D331-E333 VanDerWaalsContact OD2-CB 3.26Å; D331-E333 WeakPolarHBondContact OD2-CB 3.32Å; D331-E333 PolarHBondContact OD2-N 3.37Å; D331-T334 PolarHBondContact O-N 3.03Å; D331-T334 WeakPolarHBondContact OD1-CB 3.4Å; D331-T334 PolarHBondContact OD1-OG1 3.16Å; D331-T334 PolarHBondContact OD2-N 3.44Å; D331-T334 PolarHBondContact OD2-OG1 3.24Å; D331-R335 WeakPolarHBondContact O-CB 3.3Å; D331-R335 PolarHBondContact O-N 3.26Å
332	D	83.7	Confident	82.5	Confident	94 Å²	94	71.7 Å²	71.7	50%	0.503	36%	0.359	S	S	.	.	H	α-helix	trans	-68.7	-19.7	-177.1	-84	-32.1	0	0	0	113.9	R335 K336	D332-R335 IonicContact OD1-CZ 3.15Å; D332-R335 VanDerWaalsContact OD1-CZ 3.24Å; D332-R335 IonicContact OD1-NE 2.66Å; D332-R335 IonicContact OD1-NH1 2.73Å; D332-R335 PolarHBondContact OD1-NH1 2.84Å; D332-R335 IonicContact OD1-NH2 2.75Å; D332-K336 WeakPolarHBondContact O-CB 3.36Å; D332-K336 VanDerWaalsContact O-CD 3.32Å; D332-K336 WeakPolarHBondContact O-CD 3.42Å; D332-K336 WeakPolarHBondContact O-CG 3.49Å; D332-K336 PolarHBondContact O-N 3.3Å
333	E	85.1	Confident	82.4	Confident	119 Å²	119	76.3 Å²	76.3	56%	0.556	38%	0.379	S	S	*	.	H	α-helix	trans	-77.9	-47.3	176.6	-158.2	-169.2	137.2	0	0	110.6	D331 R335 K336 K337	D331-E333 PolarHBondContact O-N 3.13Å; D331-E333 WeakPolarHBondContact OD2-CA 3.45Å; D331-E333 VanDerWaalsContact OD2-CB 3.26Å; D331-E333 WeakPolarHBondContact OD2-CB 3.32Å; D331-E333 PolarHBondContact OD2-N 3.37Å; E333-R335 VanDerWaalsContact C-N 3.28Å; E333-R335 PolarHBondContact O-N 3.42Å; E333-K336 PolarHBondContact O-N 3.5Å; E333-K337 WeakPolarHBondContact O-CB 3.43Å; E333-K337 WeakPolarHBondContact O-CG 3.48Å; E333-K337 PolarHBondContact O-N 3.21Å; E333-K337 WeakPolarHBondContact OE1-CE 3Å; E333-K337 IonicContact OE1-NZ 3.89Å; E333-K337 PolarHBondContact OE1-NZ 3.06Å
334	T	84.5	Confident	82.3	Confident	27 Å²	27	70 Å²	70	17%	0.166	35%	0.345	C	S	.	.	H	α-helix	trans	-57.3	-41.7	169.4	-63.2	0	0	0	0	110.8	F322 P325 D331 K336 K337 V338	F322-T334 HydrophobicContact CB-CG2 4.21Å; F322-T334 HydrophobicContact CD1-CG2 4.08Å; F322-T334 HydrophobicContact CG-CG2 4.33Å; P325-T334 HydrophobicContact CB-CG2 4.19Å; P325-T334 HydrophobicContact CG-CG2 4.29Å; D331-T334 PolarHBondContact O-N 3.03Å; D331-T334 WeakPolarHBondContact OD1-CB 3.4Å; D331-T334 PolarHBondContact OD1-OG1 3.16Å; D331-T334 PolarHBondContact OD2-N 3.44Å; D331-T334 PolarHBondContact OD2-OG1 3.24Å; T334-K336 PolarHBondContact O-N 3.33Å; T334-K337 PolarHBondContact O-N 3.38Å; T334-V338 HydrophobicContact CG2-CG2 4.16Å; T334-V338 WeakPolarHBondContact O-CB 3.38Å; T334-V338 VanDerWaalsContact O-CG2 3.3Å; T334-V338 WeakPolarHBondContact O-CG2 3.24Å; T334-V338 PolarHBondContact O-N 3.34Å
335	R	84	Confident	82.1	Confident	92 Å²	92	66.4 Å²	66.4	35%	0.347	33%	0.326	S	S	.	.	H	α-helix	trans	-61.8	-43.4	176	-164.5	179.3	-58.3	161	-1.7	112.3	A330 D331 D332 E333 K339 L563	A330-R335 PolarHBondContact O-NH2 3.27Å; D331-R335 WeakPolarHBondContact O-CB 3.3Å; D331-R335 PolarHBondContact O-N 3.26Å; D332-R335 IonicContact OD1-CZ 3.15Å; D332-R335 VanDerWaalsContact OD1-CZ 3.24Å; D332-R335 IonicContact OD1-NE 2.66Å; D332-R335 IonicContact OD1-NH1 2.73Å; D332-R335 PolarHBondContact OD1-NH1 2.84Å; D332-R335 IonicContact OD1-NH2 2.75Å; E333-R335 VanDerWaalsContact C-N 3.28Å; E333-R335 PolarHBondContact O-N 3.42Å; R335-K339 WeakPolarHBondContact O-CB 3.1Å; R335-K339 PolarHBondContact O-N 3.47Å; R335-L563 HydrophobicContact CG-CD2 4.38Å
336	K	85.5	Confident	82	Confident	151 Å²	151	67.3 Å²	67.3	66%	0.657	33%	0.331	S	S	*	.	H	α-helix	trans	-63.8	-45.5	173.7	-74.5	163.8	-172.6	172.4	0	111.7	D332 E333 T334 K339 A340	D332-K336 WeakPolarHBondContact O-CB 3.36Å; D332-K336 VanDerWaalsContact O-CD 3.32Å; D332-K336 WeakPolarHBondContact O-CD 3.42Å; D332-K336 WeakPolarHBondContact O-CG 3.49Å; D332-K336 PolarHBondContact O-N 3.3Å; E333-K336 PolarHBondContact O-N 3.5Å; T334-K336 PolarHBondContact O-N 3.33Å; K336-K339 PolarHBondContact O-N 3.18Å; K336-A340 WeakPolarHBondContact O-CB 3.1Å; K336-A340 PolarHBondContact O-N 2.96Å
337	K	84.8	Confident	82	Confident	56 Å²	56	69.9 Å²	69.9	24%	0.243	34%	0.337	C	S	.	.	H	α-helix	trans	-59.3	-53.5	176.6	-75.2	171.5	-176.7	170.5	0	111.7	L239 F322 E333 T334 K339 A340 Y341	L239-K337 HydrophobicContact CD1-CG 4.4Å; L239-K337 HydrophobicContact CD2-CD 4.33Å; L239-K337 HydrophobicContact CD2-CG 3.84Å; F322-K337 HydrophobicContact CE1-CB 4.34Å; F322-K337 HydrophobicContact CE1-CD 4.44Å; F322-K337 HydrophobicContact CZ-CB 4.23Å; E333-K337 WeakPolarHBondContact O-CB 3.43Å; E333-K337 WeakPolarHBondContact O-CG 3.48Å; E333-K337 PolarHBondContact O-N 3.21Å; E333-K337 WeakPolarHBondContact OE1-CE 3Å; E333-K337 IonicContact OE1-NZ 3.89Å; E333-K337 PolarHBondContact OE1-NZ 3.06Å; T334-K337 PolarHBondContact O-N 3.38Å; K337-K339 VanDerWaalsContact C-N 3.29Å; K337-K339 PolarHBondContact O-N 2.79Å; K337-A340 WeakPolarHBondContact O-CB 3.35Å; K337-A340 PolarHBondContact O-N 2.85Å; K337-A340 VanDerWaalsContact O-N 3.07Å; K337-Y341 HydrophobicContact CB-CD2 4.3Å; K337-Y341 HydrophobicContact CB-CE2 4.06Å; K337-Y341 WeakPolarHBondContact O-CD2 3.19Å; K337-Y341 PolarHBondContact O-N 3.14Å
338	V	86.1	Confident	82.2	Confident	2 Å²	2	69.6 Å²	69.6	1%	0.012	33%	0.333	C	S	.	.	H	α-helix	trans	-57.3	-41.1	177.8	166.5	0	0	0	0	111.4	L319 F322 P325 T334 G342 L563 L565	L319-V338 HydrophobicContact CD2-CG1 3.81Å; F322-V338 HydrophobicContact CB-CG2 4.05Å; F322-V338 HydrophobicContact CD2-CG2 3.52Å; F322-V338 HydrophobicContact CE2-CG2 4.13Å; F322-V338 HydrophobicContact CG-CG2 3.76Å; P325-V338 HydrophobicContact CG-CG2 4.08Å; T334-V338 HydrophobicContact CG2-CG2 4.16Å; T334-V338 WeakPolarHBondContact O-CB 3.38Å; T334-V338 VanDerWaalsContact O-CG2 3.3Å; T334-V338 WeakPolarHBondContact O-CG2 3.24Å; T334-V338 PolarHBondContact O-N 3.34Å; V338-G342 WeakPolarHBondContact O-CA 3.28Å; V338-G342 PolarHBondContact O-N 2.89Å; V338-L563 HydrophobicContact CG1-CD1 4.38Å; V338-L565 HydrophobicContact CG1-CD1 4.09Å; V338-L565 HydrophobicContact CG1-CD2 4.06Å; V338-L565 HydrophobicContact CG1-CG 4.45Å
339	K	86.3	Confident	83	Confident	141 Å²	141	60.2 Å²	60.2	61%	0.613	29%	0.292	S	S	*	.	H	α-helix	trans	-66.6	-38.3	175.2	-169	172.7	-175.8	175.8	0	112.8	R335 K336 K337 K343	R335-K339 WeakPolarHBondContact O-CB 3.1Å; R335-K339 PolarHBondContact O-N 3.47Å; K336-K339 PolarHBondContact O-N 3.18Å; K337-K339 VanDerWaalsContact C-N 3.29Å; K337-K339 PolarHBondContact O-N 2.79Å; K339-K343 PolarHBondContact O-N 2.97Å
340	A	85.4	Confident	83.6	Confident	31 Å²	31	55.6 Å²	55.6	26%	0.256	26%	0.263	S	S	.	.	H	α-helix	trans	-67.5	-53.7	176.7	0	0	0	0	0	112.2	L239 K336 K337 G342 K343 E344	L239-A340 HydrophobicContact CD1-CB 4.06Å; K336-A340 WeakPolarHBondContact O-CB 3.1Å; K336-A340 PolarHBondContact O-N 2.96Å; K337-A340 WeakPolarHBondContact O-CB 3.35Å; K337-A340 PolarHBondContact O-N 2.85Å; K337-A340 VanDerWaalsContact O-N 3.07Å; A340-G342 VanDerWaalsContact C-N 3.26Å; A340-G342 PolarHBondContact O-N 3.37Å; A340-K343 PolarHBondContact O-N 3.17Å; A340-E344 PolarHBondContact O-N 3.4Å; A340-E344 VanDerWaalsContact O-N 3.13Å
341	Y	85.6	Confident	84.3	Confident	14 Å²	14	55.2 Å²	55.2	6%	0.055	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-32.7	175.8	-63.7	-64.6	0	0	0	112.2	I231 P233 L239 D240 L242 I318 F322 K337 G345	I231-Y341 HydrophobicContact CG2-CD1 4.13Å; P233-Y341 HydrophobicContact CB-CD1 4.36Å; P233-Y341 HydrophobicContact CB-CE1 4.01Å; P233-Y341 HydrophobicContact CG-CE1 3.99Å; L239-Y341 HydrophobicContact CD1-CE2 4.45Å; D240-Y341 PolarHBondContact O-OH 3.07Å; L242-Y341 HydrophobicContact CB-CD1 3.76Å; L242-Y341 HydrophobicContact CB-CE1 3.56Å; L242-Y341 HydrophobicContact CB-CG 4.34Å; L242-Y341 HydrophobicContact CD2-CD1 4.09Å; L242-Y341 HydrophobicContact CD2-CD2 3.98Å; L242-Y341 HydrophobicContact CD2-CE1 4.49Å; L242-Y341 HydrophobicContact CD2-CE2 4.41Å; L242-Y341 HydrophobicContact CD2-CG 3.83Å; I318-Y341 WeakPolarHBondContact CD1-O 3.35Å; F322-Y341 AromaticContact CE2-CD2 3.75Å; F322-Y341 HydrophobicContact CE2-CD2 3.75Å; F322-Y341 HydrophobicContact CE2-CE2 4.11Å; F322-Y341 AromaticContact CZ-CD2 3.75Å; F322-Y341 HydrophobicContact CZ-CD2 3.75Å; F322-Y341 AromaticContact CZ-CE2 3.61Å; F322-Y341 HydrophobicContact CZ-CE2 3.61Å; K337-Y341 HydrophobicContact CB-CD2 4.3Å; K337-Y341 HydrophobicContact CB-CE2 4.06Å; K337-Y341 WeakPolarHBondContact O-CD2 3.19Å; K337-Y341 PolarHBondContact O-N 3.14Å; Y341-G345 WeakPolarHBondContact O-CA 3.44Å; Y341-G345 PolarHBondContact O-N 3.49Å
342	G	85.2	Confident	84.6	Confident	3 Å²	3	52.6 Å²	52.6	3%	0.031	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-45.4	172.9	0	0	0	0	0	112.6	V338 A340 V346	V338-G342 WeakPolarHBondContact O-CA 3.28Å; V338-G342 PolarHBondContact O-N 2.89Å; A340-G342 VanDerWaalsContact C-N 3.26Å; A340-G342 PolarHBondContact O-N 3.37Å; G342-V346 WeakPolarHBondContact O-CG2 3.46Å; G342-V346 PolarHBondContact O-N 2.96Å
343	K	84.6	Confident	84.8	Confident	144 Å²	144	53.9 Å²	53.9	63%	0.626	24%	0.244	S	C	*	.	H	α-helix	trans	-62.9	-44.8	177.8	-174.8	-176.4	178.4	-176.2	0	112.3	K339 A340	K339-K343 PolarHBondContact O-N 2.97Å; A340-K343 PolarHBondContact O-N 3.17Å
344	E	83.4	Confident	85.2	Confident	18 Å²	18	48.2 Å²	48.2	8%	0.084	22%	0.218	C	C	.	.	H	α-helix	trans	-79	-31.3	-179	-60.5	-53.5	122.7	0	0	112.4	I231 S234 A340 V346 K347	I231-E344 HydrophobicContact CG2-CB 4.05Å; S234-E344 PolarHBondContact OG-OE1 3.12Å; A340-E344 PolarHBondContact O-N 3.4Å; A340-E344 VanDerWaalsContact O-N 3.13Å; E344-V346 PolarHBondContact O-N 3.45Å; E344-K347 WeakPolarHBondContact O-CB 3.42Å; E344-K347 PolarHBondContact O-N 3.01Å; E344-K347 VanDerWaalsContact OE1-CE 3.28Å; E344-K347 WeakPolarHBondContact OE1-CE 3.26Å; E344-K347 IonicContact OE1-NZ 3.58Å; E344-K347 PolarHBondContact OE1-NZ 3.34Å; E344-K347 WeakPolarHBondContact OE2-CD 3.37Å; E344-K347 VanDerWaalsContact OE2-CE 3.27Å; E344-K347 WeakPolarHBondContact OE2-CE 3.23Å; E344-K347 IonicContact OE2-NZ 2.67Å; E344-K347 PolarHBondContact OE2-NZ 3.45Å
345	G	80.2	Confident	85.7	Confident	0 Å²	0	47 Å²	47	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-63.3	-35.9	174.3	0	0	0	0	0	113.4	Y341 K347 M348	Y341-G345 WeakPolarHBondContact O-CA 3.44Å; Y341-G345 PolarHBondContact O-N 3.49Å; G345-K347 VanDerWaalsContact C-N 3.29Å; G345-K347 PolarHBondContact O-N 3.37Å; G345-M348 WeakPolarHBondContact O-CB 3.38Å; G345-M348 PolarHBondContact O-N 3.46Å
346	V	77.5	Confident	86.2	Confident	25 Å²	25	44 Å²	44	15%	0.152	20%	0.2	C	C	.	.	H	α-helix	trans	-59.6	-39.2	173.8	170.3	0	0	0	0	111.5	T311 G342 E344 M348 N349	T311-V346 HydrophobicContact CG2-CG2 3.97Å; G342-V346 WeakPolarHBondContact O-CG2 3.46Å; G342-V346 PolarHBondContact O-N 2.96Å; E344-V346 PolarHBondContact O-N 3.45Å; V346-M348 PolarHBondContact O-N 3.44Å; V346-M348 VanDerWaalsContact O-N 3.13Å; V346-N349 WeakPolarHBondContact O-CB 3.33Å; V346-N349 PolarHBondContact O-N 2.94Å; V346-N349 VanDerWaalsContact O-N 3.11Å
347	K	78.8	Confident	86.6	Confident	109 Å²	109	36.9 Å²	36.9	47%	0.474	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.7	-14.1	176.7	-53.3	-179.1	-167.3	165.9	0	113.7	E344 G345 N349	E344-K347 WeakPolarHBondContact O-CB 3.42Å; E344-K347 PolarHBondContact O-N 3.01Å; E344-K347 VanDerWaalsContact OE1-CE 3.28Å; E344-K347 WeakPolarHBondContact OE1-CE 3.26Å; E344-K347 IonicContact OE1-NZ 3.58Å; E344-K347 PolarHBondContact OE1-NZ 3.34Å; E344-K347 WeakPolarHBondContact OE2-CD 3.37Å; E344-K347 VanDerWaalsContact OE2-CE 3.27Å; E344-K347 WeakPolarHBondContact OE2-CE 3.23Å; E344-K347 IonicContact OE2-NZ 2.67Å; E344-K347 PolarHBondContact OE2-NZ 3.45Å; G345-K347 VanDerWaalsContact C-N 3.29Å; G345-K347 PolarHBondContact O-N 3.37Å; K347-N349 VanDerWaalsContact C-N 3.34Å
348	M	76.8	Confident	87.1	Confident	44 Å²	44	36.1 Å²	36.1	22%	0.217	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.2	-4.4	177.5	-57	-60.7	168	0	0	113.2	L229 G345 V346 F350 R353	L229-M348 HydrophobicContact CD1-CB 3.86Å; L229-M348 HydrophobicContact CD1-CG 4.2Å; L229-M348 HydrophobicContact CD2-CB 4.21Å; G345-M348 WeakPolarHBondContact O-CB 3.38Å; G345-M348 PolarHBondContact O-N 3.46Å; V346-M348 PolarHBondContact O-N 3.44Å; V346-M348 VanDerWaalsContact O-N 3.13Å; M348-F350 PolarHBondContact O-N 2.89Å; M348-R353 PolarHBondContact O-NE 3.45Å; M348-R353 PolarHBondContact SD-NH2 3.13Å
349	N	87.7	Confident	87.6	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	17%	0.171	C	C	.	.			trans	-58.1	132.8	176.5	-169.1	-33.3	0	0	0	110.9	R307 T311 V346 K347 I351 D352 R353	R307-N349 WeakPolarHBondContact CG-ND2 3.41Å; R307-N349 PolarHBondContact O-ND2 2.73Å; T311-N349 PolarHBondContact OG1-ND2 3.14Å; T311-N349 VanDerWaalsContact OG1-ND2 3.11Å; V346-N349 WeakPolarHBondContact O-CB 3.33Å; V346-N349 PolarHBondContact O-N 2.94Å; V346-N349 VanDerWaalsContact O-N 3.11Å; K347-N349 VanDerWaalsContact C-N 3.34Å; N349-I351 VanDerWaalsContact C-N 3.29Å; N349-I351 PolarHBondContact O-N 2.89Å; N349-I351 PolarHBondContact OD1-N 2.95Å; N349-I351 VanDerWaalsContact OD1-N 3.1Å; N349-D352 HydrophobicContact CB-CB 4.24Å; N349-D352 WeakPolarHBondContact CB-OD1 3.41Å; N349-D352 PolarHBondContact O-N 3.38Å; N349-R353 WeakPolarHBondContact O-CG 3.4Å; N349-R353 PolarHBondContact O-N 3.08Å; N349-R353 VanDerWaalsContact O-N 3.12Å
350	F	87.9	Confident	88	Confident	7 Å²	7	30.6 Å²	30.6	3%	0.031	15%	0.145	C	C	.	.	H	α-helix	trans	-67.8	-28.9	-176.2	67.6	-88.4	0	0	0	112.6	L215 L218 M219 I222 T253 V306 E310 M348 R353 I354	L215-F350 HydrophobicContact CD1-CD2 4.13Å; L215-F350 HydrophobicContact CD1-CE2 3.96Å; L218-F350 HydrophobicContact CB-CB 4.38Å; L218-F350 HydrophobicContact CD1-CB 4.26Å; M219-F350 HydrophobicContact CE-CE2 4.34Å; M219-F350 HydrophobicContact CE-CZ 4.26Å; M219-F350 HydrophobicContact CG-CD2 4.36Å; M219-F350 HydrophobicContact CG-CE2 3.92Å; M219-F350 HydrophobicContact CG-CZ 4.39Å; M219-F350 HydrophobicContact SD-CE2 4.27Å; I222-F350 HydrophobicContact CD1-CB 4.31Å; I222-F350 HydrophobicContact CD1-CD1 3.43Å; I222-F350 VanDerWaalsContact CD1-CD1 3.43Å; I222-F350 HydrophobicContact CD1-CE1 3.88Å; I222-F350 HydrophobicContact CD1-CG 3.93Å; T253-F350 HydrophobicContact CG2-CE1 4.34Å; T253-F350 HydrophobicContact CG2-CZ 3.96Å; V306-F350 HydrophobicContact CG1-CE2 4.22Å; V306-F350 HydrophobicContact CG1-CZ 3.67Å; E310-F350 HydrophobicContact CB-CE1 3.99Å; E310-F350 HydrophobicContact CG-CD1 3.87Å; E310-F350 HydrophobicContact CG-CE1 3.72Å; M348-F350 PolarHBondContact O-N 2.89Å; F350-R353 PolarHBondContact O-N 3.28Å; F350-I354 HydrophobicContact CD2-CD1 4.2Å; F350-I354 VanDerWaalsContact O-CD1 3.25Å; F350-I354 WeakPolarHBondContact O-CD1 3.42Å; F350-I354 WeakPolarHBondContact O-CG1 3.38Å; F350-I354 PolarHBondContact O-N 2.95Å; F350-I354 VanDerWaalsContact O-N 3.12Å
351	I	92.4	Very high	88.5	Confident	0 Å²	0	30 Å²	30	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-64.4	-46.6	174.2	-59.3	-59.9	0	0	0	110.5	L215 L303 V306 R307 N349 R353 I354 F355	L215-I351 HydrophobicContact CD1-CD1 4.5Å; L303-I351 HydrophobicContact CB-CG2 4.36Å; L303-I351 HydrophobicContact CD2-CD1 4.08Å; L303-I351 HydrophobicContact CD2-CG2 4.48Å; V306-I351 HydrophobicContact CG1-CD1 3.86Å; V306-I351 HydrophobicContact CG1-CG1 3.95Å; R307-I351 HydrophobicContact CB-CB 4.1Å; R307-I351 HydrophobicContact CB-CG1 4.21Å; R307-I351 HydrophobicContact CB-CG2 4.09Å; R307-I351 HydrophobicContact CG-CB 4.27Å; R307-I351 HydrophobicContact CG-CG2 4.34Å; N349-I351 VanDerWaalsContact C-N 3.29Å; N349-I351 PolarHBondContact O-N 2.89Å; N349-I351 PolarHBondContact OD1-N 2.95Å; N349-I351 VanDerWaalsContact OD1-N 3.1Å; I351-R353 VanDerWaalsContact C-N 3.32Å; I351-R353 PolarHBondContact O-N 3.2Å; I351-I354 PolarHBondContact O-N 3.48Å; I351-F355 HydrophobicContact CD1-CE2 4.49Å; I351-F355 HydrophobicContact CG2-CD2 4.28Å; I351-F355 PolarHBondContact O-N 3.1Å
352	D	90.8	Very high	89	Confident	27 Å²	27	29.9 Å²	29.9	14%	0.144	14%	0.14	C	C	.	.	H	α-helix	trans	-59	-41.9	176.5	-64.7	53.4	0	0	0	111.8	R307 N349 I354 I356	R307-D352 WeakPolarHBondContact CG-OD1 3.41Å; R307-D352 IonicContact CZ-OD1 2.6Å; R307-D352 IonicContact CZ-OD2 3.18Å; R307-D352 IonicContact NE-OD1 2.69Å; R307-D352 PolarHBondContact NE-OD1 2.58Å; R307-D352 IonicContact NE-OD2 2.73Å; R307-D352 PolarHBondContact NE-OD2 2.85Å; R307-D352 IonicContact NH2-OD1 2.63Å; R307-D352 IonicContact NH2-OD2 2.75Å; R307-D352 PolarHBondContact NH2-OD2 2.99Å; N349-D352 HydrophobicContact CB-CB 4.24Å; N349-D352 WeakPolarHBondContact CB-OD1 3.41Å; N349-D352 PolarHBondContact O-N 3.38Å; D352-I354 PolarHBondContact O-N 3.47Å; D352-I356 HydrophobicContact CB-CD1 4.24Å; D352-I356 PolarHBondContact O-N 2.85Å
353	R	89.1	Confident	89.5	Confident	121 Å²	121	30.6 Å²	30.6	46%	0.457	14%	0.144	S	C	.	.	H	α-helix	trans	-66.5	-31.9	177.7	-68.7	175.2	178.8	-176.9	1.9	114.2	M348 N349 F350 I351	M348-R353 PolarHBondContact O-NE 3.45Å; M348-R353 PolarHBondContact SD-NH2 3.13Å; N349-R353 WeakPolarHBondContact O-CG 3.4Å; N349-R353 PolarHBondContact O-N 3.08Å; N349-R353 VanDerWaalsContact O-N 3.12Å; F350-R353 PolarHBondContact O-N 3.28Å; I351-R353 VanDerWaalsContact C-N 3.32Å; I351-R353 PolarHBondContact O-N 3.2Å
354	I	92.8	Very high	90	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-87.2	-57.3	-176.7	-61.2	157.9	0	0	0	110.6	T212 T214 L215 L218 F350 I351 D352 A681 V682	T212-I354 HydrophobicContact CG2-CG2 4.47Å; T214-I354 HydrophobicContact CG2-CG1 4.28Å; L215-I354 HydrophobicContact CB-CD1 3.96Å; L215-I354 HydrophobicContact CD1-CD1 3.65Å; L215-I354 HydrophobicContact CG-CD1 4.43Å; L218-I354 HydrophobicContact CD1-CD1 4.04Å; L218-I354 HydrophobicContact CD1-CG1 3.87Å; F350-I354 HydrophobicContact CD2-CD1 4.2Å; F350-I354 VanDerWaalsContact O-CD1 3.25Å; F350-I354 WeakPolarHBondContact O-CD1 3.42Å; F350-I354 WeakPolarHBondContact O-CG1 3.38Å; F350-I354 PolarHBondContact O-N 2.95Å; F350-I354 VanDerWaalsContact O-N 3.12Å; I351-I354 PolarHBondContact O-N 3.48Å; D352-I354 PolarHBondContact O-N 3.47Å; I354-A681 PolarHBondContact O-N 3.35Å; I354-V682 HydrophobicContact CG2-CB 3.98Å; I354-V682 HydrophobicContact CG2-CG2 3.62Å; I354-V682 PolarHBondContact O-N 2.9Å
355	F	95.3	Very high	90.5	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-105.1	-16.2	-161.1	-62.5	-74.8	0	0	0	114.4	L209 T212 L215 L303 I351 V682 I684	L209-F355 HydrophobicContact CD2-CE1 4.12Å; L209-F355 HydrophobicContact CD2-CZ 3.79Å; T212-F355 HydrophobicContact CG2-CE1 4.45Å; T212-F355 HydrophobicContact CG2-CZ 4.24Å; L215-F355 HydrophobicContact CD1-CE2 4.38Å; L215-F355 HydrophobicContact CD2-CE2 4.4Å; L215-F355 HydrophobicContact CD2-CZ 4.22Å; L303-F355 HydrophobicContact CD1-CD2 4.27Å; L303-F355 HydrophobicContact CD1-CG 4.23Å; L303-F355 HydrophobicContact CD2-CD2 3.96Å; L303-F355 HydrophobicContact CD2-CE2 3.76Å; L303-F355 HydrophobicContact CD2-CZ 4.36Å; I351-F355 HydrophobicContact CD1-CE2 4.49Å; I351-F355 HydrophobicContact CG2-CD2 4.28Å; I351-F355 PolarHBondContact O-N 3.1Å; F355-V682 HydrophobicContact CD1-CB 3.92Å; F355-V682 HydrophobicContact CD1-CG1 3.9Å; F355-V682 HydrophobicContact CE1-CB 4.01Å; F355-V682 HydrophobicContact CE1-CG1 3.77Å; F355-V682 HydrophobicContact CE1-CG2 4.47Å; F355-I684 HydrophobicContact CD1-CD1 3.79Å; F355-I684 HydrophobicContact CD1-CG1 4.37Å; F355-I684 HydrophobicContact CE1-CD1 4.09Å
356	I	94.1	Very high	91.2	Very high	29 Å²	29	27.1 Å²	27.1	15%	0.149	13%	0.13	C	C	.	.			trans	-94.8	119.5	-168.2	-59.8	-172	0	0	0	112.3	R307 D352 P377 F378 I379	R307-I356 VanDerWaalsContact NH2-CD1 3.29Å; D352-I356 HydrophobicContact CB-CD1 4.24Å; D352-I356 PolarHBondContact O-N 2.85Å; I356-P377 HydrophobicContact CG2-CB 4Å; I356-F378 VanDerWaalsContact CA-O 3.29Å; I356-F378 WeakPolarHBondContact CA-O 3.39Å; I356-I379 HydrophobicContact CD1-CG1 4.41Å; I356-I379 HydrophobicContact CG1-CG1 4.14Å
357	G	94.4	Very high	92	Very high	3 Å²	3	32.4 Å²	32.4	3%	0.031	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	177.8	166.9	0	0	0	0	0	112.3	P377 F378 A678	G357-P377 VanDerWaalsContact O-CA 3.3Å; G357-P377 WeakPolarHBondContact O-CA 3.3Å; G357-F378 VanDerWaalsContact C-CD1 3.47Å; G357-F378 VanDerWaalsContact C-CE1 3.42Å; G357-F378 PolarHBondContact N-O 3.48Å; G357-F378 PolarHBondContact O-N 2.95Å; G357-A678 VanDerWaalsContact CA-O 3.29Å; G357-A678 WeakPolarHBondContact CA-O 3.29Å
358	E	95.2	Very high	92.6	Very high	40 Å²	40	29 Å²	29	19%	0.187	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	120.2	177.8	-170.5	-177.4	83.1	0	0	108.8	K375 S677 A678 K721	E358-K375 HydrophobicContact CG-CB 4.24Å; E358-K375 HydrophobicContact CG-CG 4.4Å; E358-K375 IonicContact OE1-NZ 3.25Å; E358-K375 PolarHBondContact OE1-NZ 3.11Å; E358-S677 CarbonylContact O-C 3.54Å; E358-S677 WeakPolarHBondContact O-CA 3.42Å; E358-S677 PolarHBondContact O-N 2.96Å; E358-S677 PolarHBondContact O-OG 3.42Å; E358-S677 VanDerWaalsContact O-OG 3.13Å; E358-S677 PolarHBondContact OE1-OG 2.94Å; E358-A678 HydrophobicContact CB-CB 3.54Å; E358-A678 PolarHBondContact N-O 3.25Å; E358-A678 PolarHBondContact O-N 3.49Å; E358-K721 IonicContact OE1-NZ 3.38Å; E358-K721 PolarHBondContact OE1-NZ 2.85Å; E358-K721 IonicContact OE2-NZ 3.73Å; E358-K721 PolarHBondContact OE2-NZ 3.34Å
359	L	96	Very high	93.4	Very high	17 Å²	17	29.1 Å²	29.1	9%	0.089	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	148.4	165.8	-70.7	167.3	0	0	0	109.4	K375 D376 F378 F628 L674 L675 I676	L359-K375 CarbonylContact O-C 3.57Å; L359-K375 VanDerWaalsContact O-CA 3.29Å; L359-K375 WeakPolarHBondContact O-CA 3.39Å; L359-D376 PolarHBondContact N-O 3.03Å; L359-D376 PolarHBondContact O-N 2.96Å; L359-F378 HydrophobicContact CD1-CD1 4.26Å; L359-F378 HydrophobicContact CD2-CE1 4.35Å; L359-F378 HydrophobicContact CG-CD1 3.75Å; L359-F378 HydrophobicContact CG-CE1 3.99Å; L359-F628 HydrophobicContact CD1-CE1 4.16Å; L359-F628 HydrophobicContact CD1-CZ 3.98Å; L359-F628 HydrophobicContact CD2-CE1 4.04Å; L359-L674 HydrophobicContact CD1-CD2 4.31Å; L359-L675 CarbonylContact C-O 3.44Å; L359-L675 WeakPolarHBondContact CA-O 3.18Å; L359-I676 HydrophobicContact CD2-CG1 3.82Å
360	T	95.4	Very high	93.7	Very high	10 Å²	10	32.6 Å²	32.6	6%	0.061	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.4	160.2	-63.8	0	0	0	0	108.2	T373 V374 K375 L674 L675 S677	T360-T373 HydrophobicContact CG2-CG2 4.16Å; T360-V374 CarbonylContact C-O 3.57Å; T360-V374 VanDerWaalsContact CA-O 3.29Å; T360-V374 WeakPolarHBondContact CA-O 3.36Å; T360-K375 PolarHBondContact OG1-NZ 3.33Å; T360-K375 VanDerWaalsContact OG1-NZ 3.11Å; T360-L674 WeakPolarHBondContact O-CA 3.25Å; T360-L675 PolarHBondContact N-O 2.88Å; T360-L675 PolarHBondContact O-N 3.15Å; T360-S677 WeakPolarHBondContact OG1-CB 3.48Å; T360-S677 PolarHBondContact OG1-OG 2.86Å
361	S	95.6	Very high	93.9	Very high	19 Å²	19	34.1 Å²	34.1	13%	0.133	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	106.2	165.6	-177.2	0	0	0	0	108.5	T373 V374	S361-T373 WeakPolarHBondContact O-CA 3.19Å; S361-V374 PolarHBondContact N-O 2.82Å; S361-V374 PolarHBondContact O-N 2.99Å
362	T	95.4	Very high	93.9	Very high	10 Å²	10	36.8 Å²	36.8	6%	0.061	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130.8	176.2	-58.5	0	0	0	0	109.5	I371 T373 A604 F605 K672 Q673	T362-I371 HydrophobicContact CG2-CG2 3.79Å; T362-T373 HydrophobicContact CG2-CG2 4.16Å; T362-A604 HydrophobicContact CG2-CB 4.4Å; T362-F605 HydrophobicContact CG2-CD1 4.17Å; T362-F605 HydrophobicContact CG2-CE1 3.65Å; T362-F605 HydrophobicContact CG2-CZ 4.02Å; T362-K672 CarbonylContact O-C 3.48Å; T362-K672 VanDerWaalsContact O-CA 3.32Å; T362-K672 WeakPolarHBondContact O-CA 3.48Å; T362-Q673 PolarHBondContact N-O 3.29Å; T362-Q673 PolarHBondContact O-N 2.78Å
363	V	95.4	Very high	94	Very high	19 Å²	19	39.2 Å²	39.2	12%	0.115	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	132	172.9	-175	0	0	0	0	109.9	I371 S372 L634 L640 A670 R671 K672	V363-I371 CarbonylContact O-C 3.57Å; V363-I371 WeakPolarHBondContact O-CA 3.43Å; V363-S372 PolarHBondContact N-O 2.66Å; V363-S372 PolarHBondContact O-N 3.36Å; V363-L634 HydrophobicContact CG1-CD1 4.34Å; V363-L640 HydrophobicContact CG1-CD1 4.36Å; V363-L640 HydrophobicContact CG1-CD2 3.87Å; V363-A670 HydrophobicContact CG1-CB 4.04Å; V363-R671 CarbonylContact C-O 3.45Å; V363-R671 VanDerWaalsContact CA-O 3.3Å; V363-R671 WeakPolarHBondContact CA-O 3.34Å; V363-K672 HydrophobicContact CG2-CB 4.2Å; V363-K672 HydrophobicContact CG2-CD 4.44Å; V363-K672 HydrophobicContact CG2-CG 4.14Å
364	M	95.5	Very high	94.3	Very high	20 Å²	20	37.5 Å²	37.5	10%	0.099	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	122	178.5	-175.2	-178.1	77.3	0	0	110.8	N370 I371 P601 F605 A670 R671	M364-N370 WeakPolarHBondContact CA-O 3.41Å; M364-I371 HydrophobicContact CB-CG1 4.1Å; M364-I371 HydrophobicContact CG-CG1 3.79Å; M364-I371 HydrophobicContact SD-CG1 4.2Å; M364-P601 HydrophobicContact SD-CB 3.83Å; M364-F605 HydrophobicContact CB-CE2 3.84Å; M364-F605 HydrophobicContact CB-CZ 3.72Å; M364-F605 HydrophobicContact CE-CE2 4.03Å; M364-F605 HydrophobicContact SD-CE2 4.02Å; M364-A670 CarbonylContact O-C 3.46Å; M364-A670 WeakPolarHBondContact O-CA 3.49Å; M364-A670 VanDerWaalsContact O-CB 3.31Å; M364-A670 WeakPolarHBondContact O-CB 3.41Å; M364-R671 PolarHBondContact N-O 3.21Å; M364-R671 PolarHBondContact O-N 3.39Å
365	C	95.3	Very high	94.3	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.007	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	130.7	172.4	171.5	0	0	0	0	110.7	E367 A369 N370 L640 C642 T668	C365-E367 PolarHBondContact SG-N 3.33Å; C365-A369 WeakPolarHBondContact O-CA 3.36Å; C365-A369 PolarHBondContact O-N 3.12Å; C365-N370 PolarHBondContact N-O 2.92Å; C365-L640 HydrophobicContact CB-CD2 4.26Å; C365-C642 VanDerWaalsContact SG-SG 3.69Å; C365-T668 PolarHBondContact SG-OG1 2.92Å
366	E	94.3	Very high	94.3	Very high	67 Å²	67	45.1 Å²	45.1	31%	0.313	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-25.2	-179.5	-64.4	-159.6	116.4	0	0	113.5	N669 R671	E366-N669 HydrophobicContact CB-CB 4.36Å; E366-N669 HydrophobicContact CG-CB 4.34Å; E366-N669 PolarHBondContact N-O 3.38Å; E366-N669 VanDerWaalsContact OE2-CB 3.31Å; E366-N669 WeakPolarHBondContact OE2-CB 3.2Å; E366-R671 HydrophobicContact CG-CG 4.37Å; E366-R671 IonicContact OE1-CZ 3.8Å; E366-R671 IonicContact OE1-NE 2.74Å; E366-R671 PolarHBondContact OE1-NE 3.46Å; E366-R671 IonicContact OE1-NH2 3.49Å; E366-R671 PolarHBondContact OE1-NH2 3.2Å
367	E	93	Very high	94.3	Very high	136 Å²	136	47.8 Å²	47.8	64%	0.636	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.8	-41.6	-177.7	-54.8	-62.8	158.9	0	0	113.2	C365 T668	C365-E367 PolarHBondContact SG-N 3.33Å; E367-T668 HydrophobicContact CB-CG2 4.2Å; E367-T668 HydrophobicContact CG-CG2 3.56Å
368	C	92.9	Very high	94.3	Very high	39 Å²	39	48.6 Å²	48.6	26%	0.264	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-119.7	4.5	-174.5	70.6	0	0	0	0	114.5	N370 C642 N644	C368-N370 PolarHBondContact O-N 2.97Å; C368-N370 VanDerWaalsContact SG-CB 3.52Å; C368-C642 VanDerWaalsContact SG-SG 3.66Å; C368-N644 PolarHBondContact SG-ND2 2.7Å
369	A	93.4	Very high	94.4	Very high	45 Å²	45	47.5 Å²	47.5	37%	0.372	27%	0.268	S	S	.	.			trans	53.8	15.8	-176.7	0	0	0	0	0	115.4	C365 I371 P601	C365-A369 WeakPolarHBondContact O-CA 3.36Å; C365-A369 PolarHBondContact O-N 3.12Å; A369-I371 PolarHBondContact O-N 3.43Å; A369-P601 HydrophobicContact CB-CG 3.9Å
370	N	92.8	Very high	94.4	Very high	74 Å²	74	47.4 Å²	47.4	40%	0.396	27%	0.267	S	S	.	.			trans	-68.3	127.1	176.8	-176.8	92.9	0	0	0	110.2	M364 C365 C368 N644	M364-N370 WeakPolarHBondContact CA-O 3.41Å; C365-N370 PolarHBondContact N-O 2.92Å; C368-N370 PolarHBondContact O-N 2.97Å; C368-N370 VanDerWaalsContact SG-CB 3.52Å; N370-N644 HydrophobicContact CB-CB 4.25Å
371	I	92.9	Very high	94.5	Very high	38 Å²	38	47.1 Å²	47.1	20%	0.195	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	133.6	-179.7	-60.3	152.9	0	0	0	109.4	T362 V363 M364 A369 T373 H599 A604	T362-I371 HydrophobicContact CG2-CG2 3.79Å; V363-I371 CarbonylContact O-C 3.57Å; V363-I371 WeakPolarHBondContact O-CA 3.43Å; M364-I371 HydrophobicContact CB-CG1 4.1Å; M364-I371 HydrophobicContact CG-CG1 3.79Å; M364-I371 HydrophobicContact SD-CG1 4.2Å; A369-I371 PolarHBondContact O-N 3.43Å; I371-T373 HydrophobicContact CG2-CG2 4.23Å; I371-H599 HydrophobicContact CD1-CB 3.97Å; I371-H599 VanDerWaalsContact CD1-O 3.26Å; I371-H599 WeakPolarHBondContact CD1-O 3.08Å; I371-A604 HydrophobicContact CD1-CB 3.66Å; I371-A604 HydrophobicContact CG1-CB 4.17Å; I371-A604 HydrophobicContact CG2-CB 4.5Å
372	S	92.8	Very high	94.6	Very high	57 Å²	57	47.4 Å²	47.4	40%	0.399	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	150.4	163.7	56.7	0	0	0	0	110.2	V363	V363-S372 PolarHBondContact N-O 2.66Å; V363-S372 PolarHBondContact O-N 3.36Å
373	T	92.8	Very high	94.7	Very high	78 Å²	78	47 Å²	47	48%	0.479	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	123.9	-179.8	55.7	0	0	0	0	110.2	T360 S361 T362 I371	T360-T373 HydrophobicContact CG2-CG2 4.16Å; S361-T373 WeakPolarHBondContact O-CA 3.19Å; T362-T373 HydrophobicContact CG2-CG2 4.16Å; I371-T373 HydrophobicContact CG2-CG2 4.23Å
374	V	94.7	Very high	94.6	Very high	84 Å²	84	47.9 Å²	47.9	51%	0.509	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	148.3	171.9	-176.7	0	0	0	0	108.8	T360 S361	T360-V374 CarbonylContact C-O 3.57Å; T360-V374 VanDerWaalsContact CA-O 3.29Å; T360-V374 WeakPolarHBondContact CA-O 3.36Å; S361-V374 PolarHBondContact N-O 2.82Å; S361-V374 PolarHBondContact O-N 2.99Å
375	K	94	Very high	94.4	Very high	92 Å²	92	48 Å²	48	40%	0.4	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	118.7	-178	-81.6	177.7	168	-66.8	0	111.1	E358 L359 T360 S677	E358-K375 HydrophobicContact CG-CB 4.24Å; E358-K375 HydrophobicContact CG-CG 4.4Å; E358-K375 IonicContact OE1-NZ 3.25Å; E358-K375 PolarHBondContact OE1-NZ 3.11Å; L359-K375 CarbonylContact O-C 3.57Å; L359-K375 VanDerWaalsContact O-CA 3.29Å; L359-K375 WeakPolarHBondContact O-CA 3.39Å; T360-K375 PolarHBondContact OG1-NZ 3.33Å; T360-K375 VanDerWaalsContact OG1-NZ 3.11Å; K375-S677 PolarHBondContact NZ-OG 2.85Å
376	D	93.9	Very high	93.5	Very high	70 Å²	70	51.2 Å²	51.2	37%	0.374	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	119.9	-169.3	-57.1	-53.6	0	0	0	110.2	L359	L359-D376 PolarHBondContact N-O 3.03Å; L359-D376 PolarHBondContact O-N 2.96Å
377	P	94.6	Very high	92.4	Very high	84 Å²	84	51.3 Å²	51.3	55%	0.545	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	146.3	178.1	31.5	-34.1	0	0	0	111.6	I356 G357	I356-P377 HydrophobicContact CG2-CB 4Å; G357-P377 VanDerWaalsContact O-CA 3.3Å; G357-P377 WeakPolarHBondContact O-CA 3.3Å
378	F	95.3	Very high	91	Very high	20 Å²	20	49.3 Å²	49.3	9%	0.088	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	150.7	179.3	69.9	-92.6	0	0	0	112.9	I356 G357 L359 I381 I676 P680 L683	I356-F378 VanDerWaalsContact CA-O 3.29Å; I356-F378 WeakPolarHBondContact CA-O 3.39Å; G357-F378 VanDerWaalsContact C-CD1 3.47Å; G357-F378 VanDerWaalsContact C-CE1 3.42Å; G357-F378 PolarHBondContact N-O 3.48Å; G357-F378 PolarHBondContact O-N 2.95Å; L359-F378 HydrophobicContact CD1-CD1 4.26Å; L359-F378 HydrophobicContact CD2-CE1 4.35Å; L359-F378 HydrophobicContact CG-CD1 3.75Å; L359-F378 HydrophobicContact CG-CE1 3.99Å; F378-I381 HydrophobicContact CD2-CG1 3.75Å; F378-I381 HydrophobicContact CE2-CD1 3.89Å; F378-I381 HydrophobicContact CE2-CG1 3.55Å; F378-I381 HydrophobicContact CG-CG1 4.4Å; F378-I381 HydrophobicContact CZ-CD1 3.89Å; F378-I381 HydrophobicContact CZ-CG1 4.03Å; F378-I676 HydrophobicContact CE1-CG2 4.29Å; F378-I676 HydrophobicContact CZ-CG2 4.28Å; F378-P680 HydrophobicContact CE2-CG 4.44Å; F378-L683 HydrophobicContact CE2-CD1 4.12Å
379	I	95.6	Very high	89.1	Confident	18 Å²	18	58.7 Å²	58.7	9%	0.092	31%	0.309	C	S	.	.	S	Bend	trans	-99.8	-37.2	171.9	-65.6	173	0	0	0	110.7	L303 I356	L303-I379 HydrophobicContact CD1-CG2 3.61Å; I356-I379 HydrophobicContact CD1-CG1 4.41Å; I356-I379 HydrophobicContact CG1-CG1 4.14Å
380	D	97.3	Very high	86.6	Confident	15 Å²	15	62.3 Å²	62.3	8%	0.08	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	165.4	169	79	-91.9	0	0	0	110.8	Q296 H300 S382 I684 H686	Q296-D380 VanDerWaalsContact NE2-CG 3.31Å; Q296-D380 PolarHBondContact NE2-OD1 3.17Å; Q296-D380 PolarHBondContact NE2-OD2 2.83Å; Q296-D380 VanDerWaalsContact NE2-OD2 3.17Å; H300-D380 IonicContact CD2-OD1 3.75Å; H300-D380 IonicContact CE1-OD1 3.69Å; H300-D380 PolarHBondContact CE1-OD1 2.7Å; H300-D380 IonicContact NE2-OD1 3.31Å; H300-D380 PolarHBondContact NE2-OD1 3.36Å; D380-S382 PolarHBondContact OD2-N 3.38Å; D380-S382 VanDerWaalsContact OD2-N 3.11Å; D380-S382 PolarHBondContact OD2-OG 3.22Å; D380-I684 CarbonylContact C-O 3.53Å; D380-I684 WeakPolarHBondContact CA-O 3.28Å; D380-I684 HydrophobicContact CB-CB 3.9Å; D380-I684 HydrophobicContact CB-CG2 3.89Å; D380-I684 WeakPolarHBondContact CB-O 3.4Å; D380-H686 WeakPolarHBondContact OD2-CB 3.27Å
381	I	97.8	Very high	84	Confident	3 Å²	3	63.8 Å²	63.8	2%	0.015	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	114.5	163.9	-51.1	-179.1	0	0	0	108.8	F378 L383 F628 I676 L683 I684 L685 H686	F378-I381 HydrophobicContact CD2-CG1 3.75Å; F378-I381 HydrophobicContact CE2-CD1 3.89Å; F378-I381 HydrophobicContact CE2-CG1 3.55Å; F378-I381 HydrophobicContact CG-CG1 4.4Å; F378-I381 HydrophobicContact CZ-CD1 3.89Å; F378-I381 HydrophobicContact CZ-CG1 4.03Å; I381-L383 HydrophobicContact CG2-CD2 3.64Å; I381-L383 HydrophobicContact CG2-CG 4.29Å; I381-L383 PolarHBondContact O-N 3.02Å; I381-F628 HydrophobicContact CG2-CD1 3.87Å; I381-F628 HydrophobicContact CG2-CD2 4.23Å; I381-F628 HydrophobicContact CG2-CE1 3.63Å; I381-F628 HydrophobicContact CG2-CE2 4Å; I381-F628 HydrophobicContact CG2-CG 4.17Å; I381-F628 HydrophobicContact CG2-CZ 3.7Å; I381-I676 HydrophobicContact CD1-CD1 3.63Å; I381-I676 HydrophobicContact CD1-CG1 4.14Å; I381-L683 HydrophobicContact CD1-CD1 4.25Å; I381-L683 HydrophobicContact CG1-CD1 4.44Å; I381-I684 PolarHBondContact N-O 3.4Å; I381-L685 HydrophobicContact CB-CD2 3.83Å; I381-L685 HydrophobicContact CD1-CD2 4.45Å; I381-L685 HydrophobicContact CG1-CD2 4.34Å; I381-H686 PolarHBondContact O-N 2.96Å
382	S	97.6	Very high	81.3	Confident	26 Å²	26	70.8 Å²	70.8	18%	0.182	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	91.6	-179.9	-66.2	0	0	0	0	111.7	Q296 D380 H686 K688	Q296-S382 PolarHBondContact NE2-OG 3.4Å; D380-S382 PolarHBondContact OD2-N 3.38Å; D380-S382 VanDerWaalsContact OD2-N 3.11Å; D380-S382 PolarHBondContact OD2-OG 3.22Å; S382-H686 CarbonylContact C-O 3.57Å; S382-H686 WeakPolarHBondContact CA-O 3.48Å; S382-H686 WeakPolarHBondContact CB-ND1 3.48Å; S382-H686 PolarHBondContact OG-ND1 3.49Å; S382-K688 WeakPolarHBondContact O-CE 3.15Å; S382-K688 PolarHBondContact O-NZ 3.38Å; S382-K688 VanDerWaalsContact O-NZ 3.12Å
383	L	96.6	Very high	78.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	137.2	-171.2	-60.6	175.3	0	0	0	113.2	I381 V621 C624 L625 F628 L685 H686 L687 K688	I381-L383 HydrophobicContact CG2-CD2 3.64Å; I381-L383 HydrophobicContact CG2-CG 4.29Å; I381-L383 PolarHBondContact O-N 3.02Å; L383-V621 HydrophobicContact CD1-CG1 4.45Å; L383-C624 HydrophobicContact CB-CB 4.08Å; L383-C624 HydrophobicContact CD1-CB 4.11Å; L383-L625 HydrophobicContact CD1-CD2 4.33Å; L383-L625 HydrophobicContact CD1-CG 4.02Å; L383-L625 HydrophobicContact CD2-CD2 3.85Å; L383-L625 HydrophobicContact CD2-CG 4.13Å; L383-F628 HydrophobicContact CD2-CB 3.81Å; L383-F628 HydrophobicContact CD2-CD2 4.42Å; L383-F628 HydrophobicContact CD2-CG 4.03Å; L383-L685 HydrophobicContact CD1-CB 4.41Å; L383-L685 HydrophobicContact CD1-CD1 4.31Å; L383-L685 HydrophobicContact CD1-CD2 4.3Å; L383-H686 PolarHBondContact N-O 3.29Å; L383-L687 HydrophobicContact CB-CD2 4.18Å; L383-L687 HydrophobicContact CD1-CD2 4.14Å; L383-K688 VanDerWaalsContact O-CB 3.27Å; L383-K688 WeakPolarHBondContact O-CB 3.47Å; L383-K688 WeakPolarHBondContact O-CG 3.49Å; L383-K688 PolarHBondContact O-N 2.91Å
384	P	92.9	Very high	75.7	Confident	39 Å²	39	77.9 Å²	77.9	25%	0.253	41%	0.408	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.6	145.6	170.3	32	-34.3	0	0	0	111.3	C624	P384-C624 PolarHBondContact O-SG 2.72Å
385	I	91.3	Very high	72.9	Confident	21 Å²	21	81.9 Å²	81.9	11%	0.108	43%	0.425	C	S	.	.	P	Polyproline II helix	trans	-103.5	124.9	173.1	-50.6	174.5	0	0	0	108.8	E387 L687 R689 V700 V704	I385-E387 PolarHBondContact O-N 3.02Å; I385-L687 HydrophobicContact CD1-CB 4.04Å; I385-L687 HydrophobicContact CG1-CB 4.34Å; I385-R689 HydrophobicContact CD1-CB 4.4Å; I385-R689 HydrophobicContact CD1-CG 3.56Å; I385-V700 HydrophobicContact CB-CG1 4.19Å; I385-V700 HydrophobicContact CD1-CB 4.29Å; I385-V700 HydrophobicContact CD1-CG1 4.14Å; I385-V700 HydrophobicContact CG2-CG1 3.82Å; I385-V704 HydrophobicContact CD1-CG2 4.17Å; I385-V704 HydrophobicContact CG1-CG2 4.31Å; I385-V704 HydrophobicContact CG2-CG2 3.78Å
386	I	77.5	Confident	70.5	Confident	69 Å²	69	86.3 Å²	86.3	35%	0.354	45%	0.453	S	S	.	.			trans	-77.4	108.8	177.6	-55.4	176.8	0	0	0	109.4	R702	I386-R702 PolarHBondContact O-NH1 2.62Å
387	E	70.6	Confident	67.5	Low	70 Å²	70	86 Å²	86	33%	0.327	47%	0.466	S	S	.	.			trans	-83.6	110.9	159	-68.8	-168	143.7	0	0	109	I385 R389 H691 R698 V700	I385-E387 PolarHBondContact O-N 3.02Å; E387-R389 PolarHBondContact O-N 2.84Å; E387-R389 VanDerWaalsContact O-N 3.11Å; E387-H691 IonicContact OE2-NE2 2.73Å; E387-R698 IonicContact OE2-CZ 2.65Å; E387-R698 VanDerWaalsContact OE2-CZ 3.3Å; E387-R698 IonicContact OE2-NE 3.44Å; E387-R698 PolarHBondContact OE2-NE 3.22Å; E387-R698 VanDerWaalsContact OE2-NE 3.14Å; E387-R698 IonicContact OE2-NH2 3.57Å; E387-R698 PolarHBondContact OE2-NH2 2.86Å; E387-V700 HydrophobicContact CG-CG1 3.89Å; E387-V700 HydrophobicContact CG-CG2 4.21Å
388	E	63.3	Low	64.4	Low	94 Å²	94	92 Å²	92	44%	0.439	48%	0.483	S	S	.	.			trans	-60.2	115.5	170	-172	178.1	-159.8	0	0	107.9	V390 K617	E388-V390 VanDerWaalsContact C-N 3.31Å; E388-V390 PolarHBondContact O-N 3.08Å; E388-K617 IonicContact OE1-NZ 3.98Å; E388-K617 PolarHBondContact OE1-NZ 2.8Å; E388-K617 IonicContact OE2-NZ 3.06Å; E388-K617 PolarHBondContact OE2-NZ 2.8Å
389	R	52.8	Low	61.4	Low	235 Å²	235	98.8 Å²	98.8	89%	0.887	52%	0.517	S	S	*	.			trans	-66	92.2	178.1	-69.1	-173.4	-173	-178.6	3	108.7	E387 S391	E387-R389 PolarHBondContact O-N 2.84Å; E387-R389 VanDerWaalsContact O-N 3.11Å; R389-S391 VanDerWaalsContact C-N 3.28Å; R389-S391 PolarHBondContact O-N 3.47Å
390	V	42.7	Very low	58.2	Low	122 Å²	122	105.9 Å²	105.9	74%	0.739	56%	0.556	S	S	*	*			trans	-65.8	93	171.8	-175.9	0	0	0	0	107.9	E388 K392	E388-V390 VanDerWaalsContact C-N 3.31Å; E388-V390 PolarHBondContact O-N 3.08Å; V390-K392 PolarHBondContact O-N 3.38Å
391	S	38.2	Very low	55.1	Low	105 Å²	105	113.6 Å²	113.6	73%	0.734	59%	0.589	S	S	*	*			trans	-53.6	105.4	169.1	-62.1	0	0	0	0	108.3	R389	R389-S391 VanDerWaalsContact C-N 3.28Å; R389-S391 PolarHBondContact O-N 3.47Å
392	K	34.8	Very low	51.7	Low	184 Å²	184	124.5 Å²	124.5	80%	0.8	63%	0.631	S	S	*	*			trans	-52.1	128.3	170.4	-73.3	-177.8	177.8	177.9	0	107.1	V390 L394	V390-K392 PolarHBondContact O-N 3.38Å; K392-L394 PolarHBondContact O-N 2.87Å
393	P	35.5	Very low	48.4	Very low	115 Å²	115	133.7 Å²	133.7	75%	0.747	66%	0.662	S	S	*	*			trans	-53.3	120	175.3	-26.3	34.7	0	0	0	109	L395	P393-L395 PolarHBondContact O-N 2.92Å
394	L	34	Very low	45	Very low	170 Å²	170	138 Å²	138	89%	0.89	69%	0.692	S	S	*	*			trans	-61.7	112.4	175.2	-72	172.5	0	0	0	107.2	K392 L396	K392-L394 PolarHBondContact O-N 2.87Å; L394-L396 PolarHBondContact O-N 3.46Å
395	L	35.8	Very low	41.9	Very low	168 Å²	168	144.1 Å²	144.1	88%	0.88	72%	0.722	S	S	*	*			trans	-62.3	111.4	175.5	-72.1	173.6	0	0	0	107.7	P393 G397	P393-L395 PolarHBondContact O-N 2.92Å; L395-G397 PolarHBondContact O-N 3.03Å
396	L	41.9	Very low	38.8	Very low	185 Å²	185	153.3 Å²	153.3	97%	0.969	76%	0.755	S	S	*	*			trans	-69.7	81.3	-175	-170.2	69.2	0	0	0	110.2	L394	L394-L396 PolarHBondContact O-N 3.46Å
397	G	31.2	Very low	36.4	Very low	64 Å²	64	159.5 Å²	159.5	66%	0.66	78%	0.782	S	S	*	*			trans	-106.8	95.8	-164.9	0	0	0	0	0	114.1	L395	L395-G397 PolarHBondContact O-N 3.03Å
398	K	30.8	Very low	34.2	Very low	208 Å²	208	162.1 Å²	162.1	90%	0.904	80%	0.803	S	S	*	*			trans	72.2	133.9	169.7	-60.6	179	176.8	176.9	0	116.6
399	M	31.5	Very low	32.4	Very low	163 Å²	163	165.3 Å²	165.3	80%	0.803	82%	0.824	S	S	*	*			trans	-69.6	156.1	171.7	-48.6	110.3	67.9	0	0	111.1
400	N	27.6	Very low	31.3	Very low	168 Å²	168	161.7 Å²	161.7	90%	0.898	82%	0.816	S	S	*	*			trans	-132.1	138.7	142.8	-140.4	-9.3	0	0	0	109.4
401	K	32.2	Very low	30.5	Very low	177 Å²	177	163.6 Å²	163.6	77%	0.77	82%	0.822	S	S	*	*			trans	-91.7	123.6	-176.4	-71.1	177.5	177.9	176	0	109.5
402	Y	27.8	Very low	30	Very low	231 Å²	231	168 Å²	168	91%	0.906	82%	0.823	S	S	*	*			trans	-138.1	162	150.1	-130.8	-93.6	0	0	0	113.1
403	R	27.6	Very low	29.5	Very low	219 Å²	219	170.5 Å²	170.5	83%	0.826	83%	0.829	S	S	*	*			trans	-73.8	136.6	-153.9	-177.3	-178.3	-106.8	154.7	-9.3	113.9
404	S	25.5	Very low	29.1	Very low	91 Å²	91	170.6 Å²	170.6	64%	0.636	82%	0.823	S	S	*	*			trans	-43.7	137.4	165	155.1	0	0	0	0	114.3
405	L	27.4	Very low	28.6	Very low	168 Å²	168	166.1 Å²	166.1	88%	0.88	82%	0.818	S	S	*	*			trans	-120.1	150.4	134.8	-136.4	79.1	0	0	0	108.6
406	R	27.2	Very low	28	Very low	213 Å²	213	164.3 Å²	164.3	80%	0.804	81%	0.809	S	S	*	*			trans	-111.9	134	171.5	-71.6	-178.3	174.3	-166	-1.4	108.3
407	E	25.3	Very low	27.2	Very low	199 Å²	199	161.8 Å²	161.8	93%	0.93	80%	0.801	S	S	*	*			trans	-127	136.4	142.2	-80	-177.6	160.5	0	0	108
408	T	26	Very low	26.9	Very low	125 Å²	125	164.9 Å²	164.9	77%	0.767	81%	0.808	S	S	*	*			trans	-118.8	136.2	173.7	43.7	0	0	0	0	106.9
409	D	24.2	Very low	26.8	Very low	162 Å²	162	161 Å²	161	87%	0.866	80%	0.801	S	S	*	*			trans	-137.9	159.5	136.1	-143.1	-18.3	0	0	0	111
410	H	29.8	Very low	26.4	Very low	158 Å²	158	162.1 Å²	162.1	73%	0.731	80%	0.804	S	S	*	*			trans	-88.9	150.7	174.5	-82.6	-53.7	0	0	0	110.3
411	D	25.8	Very low	26.2	Very low	162 Å²	162	161.1 Å²	161.1	87%	0.866	80%	0.799	S	S	*	*				-141.7	161.6	110.6	-142.8	-23.6	0	0	0	111.1
412	R	28.6	Very low	26	Very low	198 Å²	198	159.5 Å²	159.5	75%	0.747	80%	0.797	S	S	*	*			trans	-153.3	108.7	-157.7	179.3	-168.8	-179.1	-157.5	1.5	111
413	Y	24.1	Very low	26	Very low	237 Å²	237	156.8 Å²	156.8	93%	0.929	79%	0.792	S	S	*	*			trans	-128.5	140.9	157	-129.1	-92.9	0	0	0	111.3
414	N	26.6	Very low	26.1	Very low	117 Å²	117	154.4 Å²	154.4	63%	0.626	79%	0.791	S	S	*	*			trans	-145.2	140.1	-167.1	-171.5	63.2	0	0	0	111	N416	N414-N416 PolarHBondContact ND2-OD1 2.86Å
415	G	22.6	Very low	26.3	Very low	76 Å²	76	156.2 Å²	156.2	78%	0.784	80%	0.8	S	S	*	*			trans	-136.2	90.3	179.2	0	0	0	0	0	111.5
416	N	25.1	Very low	26.2	Very low	130 Å²	130	159.2 Å²	159.2	70%	0.695	80%	0.8	S	S	*	*			trans	-85.2	157.5	173.8	-72.1	1.8	0	0	0	111.3	N414	N414-N416 PolarHBondContact ND2-OD1 2.86Å
417	V	23.4	Very low	26.1	Very low	132 Å²	132	153.8 Å²	153.8	80%	0.8	80%	0.8	S	S	*	*			trans	160.5	131.6	145.3	149.9	0	0	0	0	107.8
418	T	26.5	Very low	26.1	Very low	129 Å²	129	149.3 Å²	149.3	79%	0.791	80%	0.797	S	S	*	*			cis	-151.5	168	-19.2	24.5	0	0	0	0	108.3
419	V	28.3	Very low	26.3	Very low	127 Å²	127	153 Å²	153	77%	0.77	80%	0.803	S	S	*	*			trans	-102.1	139	174.4	174.8	0	0	0	0	110.7	N421	V419-N421 HydrophobicContact CG1-CB 4.43Å
420	E	22.3	Very low	26.3	Very low	185 Å²	185	154.4 Å²	154.4	86%	0.864	80%	0.801	S	S	*	*			trans	-128.2	151.8	152.6	-76.6	-154.7	134.5	0	0	110.5
421	N	25	Very low	26.2	Very low	147 Å²	147	155 Å²	155	79%	0.786	80%	0.804	S	S	*	*			trans	-158.2	112.8	-168.2	-160.8	-1.4	0	0	0	110.2	V419	V419-N421 HydrophobicContact CG1-CB 4.43Å
422	I	26.9	Very low	26.2	Very low	144 Å²	144	152 Å²	152	74%	0.738	80%	0.796	S	S	*	*			trans	-129.5	104.2	-172.4	-58.8	-175.9	0	0	0	112.7
423	H	27.7	Very low	26	Very low	173 Å²	173	147.3 Å²	147.3	80%	0.801	79%	0.793	S	S	*	*			trans	35.1	131.8	139.5	-77.5	82.9	0	0	0	123.2
424	Q	29.2	Very low	26.3	Very low	169 Å²	169	141.3 Å²	141.3	79%	0.79	79%	0.786	S	S	*	*			trans	-69.5	162.5	152.5	-61.7	178.9	-10.5	0	0	112.2
425	P	31.2	Very low	26.4	Very low	130 Å²	130	143.9 Å²	143.9	84%	0.844	79%	0.792	S	S	*	*			trans	-122.6	179.4	132.7	36.8	-30.9	0	0	0	113.1
426	R	23.6	Very low	26.7	Very low	231 Å²	231	144.2 Å²	144.2	87%	0.872	78%	0.775	S	S	*	*			trans	-135.6	141.5	-154.9	-152.5	-174.9	-168.5	-175.7	5.4	113.5
427	A	26.7	Very low	26.9	Very low	98 Å²	98	146.4 Å²	146.4	81%	0.81	78%	0.779	S	S	*	*			trans	66.8	134.4	151	0	0	0	0	0	122.3
428	A	24.8	Very low	27.1	Very low	105 Å²	105	144.4 Å²	144.4	87%	0.868	77%	0.771	S	S	*	*			trans	-149	147.3	142.1	0	0	0	0	0	110.3
429	K	30.6	Very low	27.2	Very low	202 Å²	202	146.5 Å²	146.5	88%	0.878	77%	0.771	S	S	*	*			trans	-135.2	139.8	172.9	-76.8	-177	176.7	179.7	0	109.7
430	K	24.7	Very low	27.2	Very low	193 Å²	193	147.9 Å²	147.9	84%	0.839	77%	0.774	S	S	*	*			trans	-154.2	119.8	140.3	-71.5	-150.4	174.7	177.5	0	107.9
431	H	27.2	Very low	27.5	Very low	170 Å²	170	147.3 Å²	147.3	79%	0.787	78%	0.775	S	S	*	*				64.2	134.5	92.8	-65.8	-74.3	0	0	0	114.2
432	S	25.9	Very low	27.6	Very low	100 Å²	100	148.1 Å²	148.1	70%	0.699	77%	0.773	S	S	*	*			cis	-159.3	-150.8	-15	46.7	0	0	0	0	106.9
433	S	24.6	Very low	27.6	Very low	98 Å²	98	147.8 Å²	147.8	69%	0.685	77%	0.773	S	S	*	*			cis	-177.6	160.5	-0.2	17.6	0	0	0	0	105.2
434	S	29.2	Very low	27.5	Very low	111 Å²	111	150.1 Å²	150.1	78%	0.776	78%	0.775	S	S	*	*			cis	-170.4	-165.6	-8.9	56.9	0	0	0	0	105.7
435	K	29.4	Very low	27.3	Very low	172 Å²	172	152.4 Å²	152.4	75%	0.748	78%	0.782	S	S	*	*			cis	-172.1	172	-1.6	-131.5	-164.1	172.4	-129.3	0	104.7
436	D	27.6	Very low	26.9	Very low	82 Å²	82	151.7 Å²	151.7	44%	0.439	78%	0.779	S	S	.	*			cis	-163.3	120.9	-13.4	-149	5.3	0	0	0	109.4
437	K	30.2	Very low	26.9	Very low	176 Å²	176	148.5 Å²	148.5	77%	0.765	78%	0.778	S	S	*	*			trans	67.2	170.3	152.5	-64	161.8	-173.3	131.5	0	119.1
438	S	27.6	Very low	26.8	Very low	91 Å²	91	154.6 Å²	154.6	64%	0.636	78%	0.78	S	S	*	*			cis	-152.8	153	12.3	44.6	0	0	0	0	115
439	Q	29.1	Very low	26.6	Very low	172 Å²	172	158.5 Å²	158.5	80%	0.804	78%	0.777	S	S	*	*			trans	62.9	131	149.6	-70.8	159.1	-12.4	0	0	118.5
440	L	28.8	Very low	26.2	Very low	157 Å²	157	156.2 Å²	156.2	82%	0.822	77%	0.774	S	S	*	*			cis	99.8	112.8	37.4	-86.1	177	0	0	0	113.4
441	I	27.1	Very low	26.1	Very low	173 Å²	173	152.7 Å²	152.7	89%	0.887	77%	0.774	S	S	*	*				178.5	156.2	125.4	-94.5	162.9	0	0	0	111.9
442	H	28.5	Very low	25.8	Very low	163 Å²	163	147.8 Å²	147.8	76%	0.755	77%	0.769	S	S	*	*			trans	-85	-178.9	179.6	-115.1	-121.2	0	0	0	111.2
443	D	25.5	Very low	25.7	Very low	137 Å²	137	152 Å²	152	73%	0.733	78%	0.777	S	S	*	*			cis	-168.2	-176.4	36.3	-147	-10.8	0	0	0	114.9
444	R	27.1	Very low	25.5	Very low	222 Å²	222	152.7 Å²	152.7	84%	0.838	78%	0.778	S	S	*	*			trans	-76.2	149.8	174.4	-66.6	160.8	140.6	176.3	-6.5	114.6
445	K	24.2	Very low	25.2	Very low	217 Å²	217	153.6 Å²	153.6	94%	0.943	78%	0.779	S	S	*	*				-160.1	-176.7	128.7	-118.9	167.4	-173.5	172.9	0	114.4
446	C	23.7	Very low	24.8	Very low	116 Å²	116	151.1 Å²	151.1	78%	0.784	78%	0.777	S	S	*	*			trans	-138.3	-179.9	-162.7	-174.3	0	0	0	0	110.6
447	I	23.2	Very low	24.5	Very low	163 Å²	163	152.6 Å²	152.6	84%	0.836	79%	0.79	S	S	*	*			trans	109.4	158.4	164.9	-59.2	171.8	0	0	0	115.7
448	R	22.9	Very low	24.1	Very low	227 Å²	227	154.1 Å²	154.1	86%	0.857	79%	0.792	S	S	*	*			trans	-97.7	167.9	-153	-56.3	161.7	162.2	161.3	-8.9	114.7
449	K	22.2	Very low	23.9	Very low	187 Å²	187	157.5 Å²	157.5	81%	0.813	80%	0.798	S	S	*	*			trans	74.7	109.3	142.5	-87.1	-174.1	172.4	-168.1	0	120.9
450	L	22.2	Very low	23.6	Very low	153 Å²	153	156.5 Å²	156.5	80%	0.801	79%	0.791	S	S	*	*				63.7	139.9	115.9	-118.6	77.2	0	0	0	122.9
451	S	22.2	Very low	23.3	Very low	120 Å²	120	159 Å²	159	84%	0.839	80%	0.795	S	S	*	*			trans	63.5	139.5	160.6	50.4	0	0	0	0	119
452	G	21.7	Very low	23.2	Very low	67 Å²	67	156.2 Å²	156.2	69%	0.691	78%	0.778	S	S	*	*			cis	171.1	157.5	-7.7	0	0	0	0	0	114.2
453	E	22.9	Very low	22.9	Very low	187 Å²	187	155.4 Å²	155.4	87%	0.874	78%	0.779	S	S	*	*			trans	63.6	164.5	170.1	-48	-162.9	149.9	0	0	116.8
454	T	21.2	Very low	22.9	Very low	114 Å²	114	154.4 Å²	154.4	70%	0.699	77%	0.773	S	S	*	*			cis	-154.2	175.6	3.3	-15.1	0	0	0	0	107.4
455	V	21.6	Very low	22.9	Very low	130 Å²	130	151 Å²	151	79%	0.788	77%	0.767	S	S	*	*			cis	-150.8	-159.2	2.9	-148.1	0	0	0	0	108.6
456	V	21.6	Very low	23	Very low	119 Å²	119	147.6 Å²	147.6	72%	0.721	76%	0.756	S	S	*	*			trans	87.7	78.2	155.6	-159.3	0	0	0	0	120.5
457	T	21	Very low	23	Very low	114 Å²	114	150.2 Å²	150.2	70%	0.699	76%	0.762	S	S	*	*				32.4	138.1	129.1	63	0	0	0	0	123.4
458	Y	22.2	Very low	23.1	Very low	208 Å²	208	145.4 Å²	145.4	82%	0.816	75%	0.753	S	S	*	*				-154.7	171.7	100.1	-117.1	-82.8	0	0	0	112.9
459	Q	22.9	Very low	23.1	Very low	161 Å²	161	142.6 Å²	142.6	75%	0.752	76%	0.755	S	S	*	*			trans	-68.1	146.9	-167	-67.2	151.8	-34.2	0	0	113.5
460	K	22.8	Very low	23.3	Very low	151 Å²	151	137.5 Å²	137.5	66%	0.657	74%	0.743	S	S	*	*				66.9	120.4	52.6	176.7	167	169.6	151.8	0	114.4	E462	K460-E462 WeakPolarHBondContact CE-OE1 3.07Å; K460-E462 VanDerWaalsContact CE-OE2 3.22Å; K460-E462 WeakPolarHBondContact CE-OE2 3.38Å; K460-E462 IonicContact NZ-OE1 2.68Å; K460-E462 PolarHBondContact NZ-OE1 2.87Å; K460-E462 IonicContact NZ-OE2 2.66Å; K460-E462 PolarHBondContact NZ-OE2 3.17Å
461	K	22.3	Very low	23.4	Very low	209 Å²	209	138.3 Å²	138.3	91%	0.909	75%	0.748	S	S	*	*			trans	-146.6	110.8	153.8	-157.4	172.1	-171.4	177.9	0	110.2
462	E	25.1	Very low	23.6	Very low	115 Å²	115	139 Å²	139	54%	0.537	74%	0.739	S	S	.	*			trans	-101.1	172.3	171.5	-80	159.8	-152.1	0	0	109.9	K460	K460-E462 WeakPolarHBondContact CE-OE1 3.07Å; K460-E462 VanDerWaalsContact CE-OE2 3.22Å; K460-E462 WeakPolarHBondContact CE-OE2 3.38Å; K460-E462 IonicContact NZ-OE1 2.68Å; K460-E462 PolarHBondContact NZ-OE1 2.87Å; K460-E462 IonicContact NZ-OE2 2.66Å; K460-E462 PolarHBondContact NZ-OE2 3.17Å
463	N	23.2	Very low	23.8	Very low	146 Å²	146	144.7 Å²	144.7	78%	0.781	75%	0.745	S	S	*	*				-160.3	119	128.2	-89.4	-11.8	0	0	0	106.2
464	L	25.8	Very low	23.8	Very low	116 Å²	116	139.6 Å²	139.6	61%	0.607	74%	0.735	S	S	*	*				70.5	143.9	84.1	-88.9	85.2	0	0	0	113.7
465	E	25.5	Very low	23.9	Very low	150 Å²	150	144.9 Å²	144.9	70%	0.701	74%	0.742	S	S	*	*			cis	-176.8	170.1	-17.4	-113.6	175.3	-154.4	0	0	106.1
466	M	26.8	Very low	23.9	Very low	146 Å²	146	146.2 Å²	146.2	72%	0.719	74%	0.744	S	S	*	*			cis	-173.9	147	-38.1	163.4	170.8	65.5	0	0	108.8
467	N	22.9	Very low	24	Very low	171 Å²	171	148.7 Å²	148.7	91%	0.914	75%	0.749	S	S	*	*			trans	-175.4	140.4	161.4	-93.6	-30.3	0	0	0	108.7
468	G	25.2	Very low	24.3	Very low	62 Å²	62	150.3 Å²	150.3	64%	0.639	75%	0.754	S	S	*	*			cis	175.1	127	-10	0	0	0	0	0	111.4
469	D	24.3	Very low	24.3	Very low	168 Å²	168	145.3 Å²	145.3	90%	0.898	75%	0.749	S	S	*	*			trans	53.1	165.4	164.2	-64.6	-34.3	0	0	0	122.7
470	S	25.6	Very low	24.3	Very low	81 Å²	81	146.6 Å²	146.6	57%	0.566	76%	0.755	S	S	*	*			cis	161.8	129.4	-45.3	174.5	0	0	0	0	109.9
471	L	24.5	Very low	24.3	Very low	170 Å²	170	144.5 Å²	144.5	89%	0.89	76%	0.76	S	S	*	*			trans	172.7	168.5	146.3	-114	123.6	0	0	0	112.3
472	M	26.5	Very low	25.2	Very low	134 Å²	134	139.4 Å²	139.4	66%	0.66	75%	0.748	S	S	*	*				-166.7	139.7	-82.8	-99.4	-68.9	-160	0	0	112.4
473	F	25	Very low	25.3	Very low	187 Å²	187	141.5 Å²	141.5	82%	0.82	76%	0.762	S	S	*	*			trans	62.5	135.8	150.9	-94.2	-64.2	0	0	0	127
474	A	23.3	Very low	25.4	Very low	79 Å²	79	140.8 Å²	140.8	65%	0.653	76%	0.758	S	S	*	*			trans	76.9	131	137.9	0	0	0	0	0	120.5
475	R	23.4	Very low	25.3	Very low	225 Å²	225	144.1 Å²	144.1	85%	0.849	77%	0.771	S	S	*	*				-170	151	65.8	-91.9	-178.6	169.9	162.3	-2.2	115.7
476	L	22.1	Very low	25.4	Very low	158 Å²	158	142.1 Å²	142.1	83%	0.827	77%	0.774	S	S	*	*			trans	68.3	144.9	140.3	-67	169.5	0	0	0	123.8
477	M	23.9	Very low	26.1	Very low	171 Å²	171	140.6 Å²	140.6	84%	0.842	77%	0.774	S	S	*	*			trans	-92.3	-174.1	163.3	-60.1	-83.7	-161.8	0	0	109
478	N	26	Very low	26.4	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	77%	0.767	S	S	*	*			cis	-166	-163.9	18.6	-151.3	-2.7	0	0	0	110.9
479	S	23.9	Very low	26.5	Very low	103 Å²	103	143.2 Å²	143.2	72%	0.72	78%	0.779	S	S	*	*			trans	93.2	136.8	159.4	105.3	0	0	0	0	116.3
480	E	21.9	Very low	26.4	Very low	188 Å²	188	141.6 Å²	141.6	88%	0.879	77%	0.77	S	S	*	*			cis	-136.5	-178.8	-0.8	-73.7	-159.8	127.8	0	0	113.6
481	S	23.8	Very low	26.8	Very low	108 Å²	108	142.5 Å²	142.5	76%	0.755	78%	0.776	S	S	*	*			trans	-114.5	-151.2	177.8	68.5	0	0	0	0	108.9
482	P	39.9	Very low	27	Very low	101 Å²	101	141.1 Å²	141.1	66%	0.656	77%	0.765	S	S	*	*			cis	-136.8	169.6	4.6	26.9	-1	0	0	0	118.2
483	L	26.8	Very low	27.1	Very low	159 Å²	159	142.3 Å²	142.3	83%	0.832	77%	0.767	S	S	*	*			trans	48.1	138.9	143.7	-58.5	165.7	0	0	0	121.2
484	N	26.2	Very low	27.2	Very low	132 Å²	132	141.5 Å²	141.5	71%	0.706	77%	0.765	S	S	*	*			cis	97.2	97.3	25.3	-175.8	95.6	0	0	0	115.2
485	E	23	Very low	27.3	Very low	186 Å²	186	142.4 Å²	142.4	87%	0.869	77%	0.773	S	S	*	*			trans	-174.9	-179.6	142.7	-110	170.9	-165.8	0	0	113.3
486	S	29.3	Very low	27.6	Very low	108 Å²	108	136.4 Å²	136.4	76%	0.755	77%	0.765	S	S	*	*			trans	-141.4	164.6	179	-44.8	0	0	0	0	108.1
487	P	40.8	Very low	27.9	Very low	113 Å²	113	138.1 Å²	138.1	73%	0.734	77%	0.769	S	S	*	*				-157.7	-139.3	57.2	41.4	-15.2	0	0	0	115
488	T	28.2	Very low	28.1	Very low	126 Å²	126	134.9 Å²	134.9	77%	0.773	76%	0.763	S	S	*	*			trans	74.9	101.5	163.1	40.3	0	0	0	0	121.6
489	D	27.2	Very low	28.2	Very low	163 Å²	163	137.3 Å²	137.3	87%	0.872	77%	0.77	S	S	*	*				21.7	168.7	121.1	-127	-25.3	0	0	0	125
490	D	23	Very low	28.4	Very low	133 Å²	133	137 Å²	137	71%	0.711	77%	0.768	S	S	*	*			trans	88.5	107.3	166.9	-111.5	-31.6	0	0	0	120.6
491	S	33.2	Very low	28.8	Very low	101 Å²	101	135 Å²	135	71%	0.706	76%	0.763	S	S	*	*				37.9	147.9	125.7	-43.9	0	0	0	0	121.8
492	E	28.9	Very low	29.2	Very low	140 Å²	140	135 Å²	135	65%	0.654	76%	0.758	S	S	*	*			cis	-156.3	156.9	31.4	-88.7	-159.3	143.5	0	0	113.1
493	K	30	Very low	28.7	Very low	159 Å²	159	137.5 Å²	137.5	69%	0.691	77%	0.766	S	S	*	*			trans	54	167.9	140.3	-66.7	177.2	-168.2	141.8	0	120.3
494	E	26.4	Very low	28.8	Very low	170 Å²	170	134.8 Å²	134.8	79%	0.794	77%	0.767	S	S	*	*			cis	-169.6	144.7	-27.7	-97.1	-99.5	133.7	0	0	104.4
495	A	25.8	Very low	28.8	Very low	99 Å²	99	136.1 Å²	136.1	82%	0.818	77%	0.773	S	S	*	*			trans	164.4	89.8	148.3	0	0	0	0	0	111
496	S	28.6	Very low	29.1	Very low	98 Å²	98	132.9 Å²	132.9	69%	0.685	77%	0.772	S	S	*	*			trans	-74.5	145.8	157.6	55.8	0	0	0	0	110.3
497	H	29.2	Very low	29.4	Very low	194 Å²	194	137.5 Å²	137.5	90%	0.898	78%	0.781	S	S	*	*			trans	-149.7	119.3	136.4	-104.6	-70.1	0	0	0	110.8
498	S	29.1	Very low	28.7	Very low	103 Å²	103	135.9 Å²	135.9	72%	0.72	78%	0.778	S	S	*	*			trans	-108.3	141.4	170	53.3	0	0	0	0	109
499	E	26.4	Very low	28.9	Very low	200 Å²	200	136 Å²	136	94%	0.935	78%	0.783	S	S	*	*			trans	-125.9	142	151.3	-71.5	-157.4	145.9	0	0	109.9
500	S	29.5	Very low	28.8	Very low	97 Å²	97	136.8 Å²	136.8	68%	0.678	78%	0.782	S	S	*	*			trans	-138.4	152.8	-176.2	57	0	0	0	0	108.2
501	N	29.3	Very low	29	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	78%	0.782	S	S	*	*			trans	-173.3	116.5	145.8	-86.3	-27.3	0	0	0	106.5
502	V	31.6	Very low	28.6	Very low	109 Å²	109	140.2 Å²	140.2	66%	0.661	79%	0.794	S	S	*	*				51.8	137.9	87.8	-51.2	0	0	0	0	114.9
503	D	29.3	Very low	28.4	Very low	153 Å²	153	138.8 Å²	138.8	82%	0.818	80%	0.799	S	S	*	*			cis	-163.8	144.7	-18	-99.3	-27.8	0	0	0	107.5
504	A	29.7	Very low	28.2	Very low	102 Å²	102	136.2 Å²	136.2	84%	0.843	81%	0.808	S	S	*	*			trans	-167.5	126.2	162.8	0	0	0	0	0	112.5
505	D	26.9	Very low	28.2	Very low	159 Å²	159	133.5 Å²	133.5	85%	0.85	81%	0.807	S	S	*	*			trans	-78.2	150.3	170.9	-67	-70.1	0	0	0	112.9
506	S	29.7	Very low	28.2	Very low	119 Å²	119	138.8 Å²	138.8	83%	0.832	81%	0.812	S	S	*	*				-172	138.5	123.1	-81.2	0	0	0	0	112.3
507	E	34.4	Very low	28	Very low	204 Å²	204	143.1 Å²	143.1	95%	0.953	82%	0.822	S	S	*	*			trans	-74.6	128.5	162.9	-63.8	-173.8	129.3	0	0	109.7
508	A	26	Very low	27.7	Very low	80 Å²	80	139.9 Å²	139.9	66%	0.661	82%	0.816	S	S	*	*			trans	-139.1	127.9	168.8	0	0	0	0	0	110.6
509	S	32.6	Very low	27.3	Very low	127 Å²	127	144 Å²	144	89%	0.888	82%	0.823	S	S	*	*			trans	-86.5	107.9	166.3	-64.7	0	0	0	0	108.4	S511	S509-S511 PolarHBondContact O-N 3.34Å
510	E	26	Very low	27.1	Very low	181 Å²	181	142.2 Å²	142.2	85%	0.846	82%	0.819	S	S	*	*			trans	-94.1	100.3	177.1	-64	-156.2	136.8	0	0	111.4
511	S	26.3	Very low	26.9	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	83%	0.831	S	S	*	*			trans	-76.9	113.9	157.2	52.7	0	0	0	0	108.9	S509 S513	S509-S511 PolarHBondContact O-N 3.34Å; S511-S513 PolarHBondContact O-N 2.82Å
512	E	26.1	Very low	26.6	Very low	202 Å²	202	152.5 Å²	152.5	94%	0.944	84%	0.838	S	S	*	*			trans	-66.1	100.9	179.2	-73.3	-165.7	127.3	0	0	112.2
513	S	24.6	Very low	26.1	Very low	110 Å²	110	152.7 Å²	152.7	77%	0.769	85%	0.845	S	S	*	*			trans	-137.5	75.1	163.8	66.2	0	0	0	0	110.4	S511	S511-S513 PolarHBondContact O-N 2.82Å
514	A	25.3	Very low	25.8	Very low	106 Å²	106	151 Å²	151	88%	0.876	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-98.7	127.9	177.7	0	0	0	0	0	111.7
515	S	26.1	Very low	25.5	Very low	112 Å²	112	152 Å²	152	78%	0.783	85%	0.845	S	S	*	*	P	Polyproline II helix	trans	-73.6	145.9	178.6	53.9	0	0	0	0	112.7	Q517	S515-Q517 PolarHBondContact O-N 3.43Å
516	K	26.2	Very low	25.4	Very low	211 Å²	211	148 Å²	148	92%	0.917	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-54.9	129.4	169.3	-61.7	171.4	-178.4	173.1	0	110.9
517	Q	24.2	Very low	25.1	Very low	189 Å²	189	148.7 Å²	148.7	88%	0.883	85%	0.847	S	S	*	*			trans	-116.7	146.2	153.5	-90.1	-168	-21.6	0	0	110.2	S515	S515-Q517 PolarHBondContact O-N 3.43Å
518	T	22.4	Very low	24.6	Very low	126 Å²	126	142.5 Å²	142.5	77%	0.773	84%	0.838	S	S	*	*			trans	-95.6	115	-178.7	-57	0	0	0	0	109.1
519	E	21.3	Very low	24.6	Very low	188 Å²	188	145.3 Å²	145.3	88%	0.879	85%	0.846	S	S	*	*	P	Polyproline II helix	trans	-83.6	136.1	158.8	-75.8	-143.8	123	0	0	110.4
520	L	22.1	Very low	24.2	Very low	163 Å²	163	147.5 Å²	147.5	85%	0.853	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-89.6	126.1	179.5	-80	158.1	0	0	0	110.2	R522	L520-R522 PolarHBondContact O-N 3.49Å
521	F	24.6	Very low	24.1	Very low	210 Å²	210	145.6 Å²	145.6	92%	0.921	84%	0.843	S	S	*	*	P	Polyproline II helix	trans	-63.7	130.2	170.1	-91	-94.2	0	0	0	111	S523	F521-S523 PolarHBondContact O-N 2.68Å
522	R	22.7	Very low	24	Very low	248 Å²	248	148.2 Å²	148.2	94%	0.936	85%	0.849	S	S	*	*			trans	-70.5	108.4	178.3	-166.7	-176.2	-158.6	168.8	6.6	110.3	L520	L520-R522 PolarHBondContact O-N 3.49Å
523	S	22.2	Very low	23.9	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	84%	0.841	S	S	*	*			trans	-76.8	150.7	175.7	52.1	0	0	0	0	112.5	F521	F521-S523 PolarHBondContact O-N 2.68Å
524	S	23.1	Very low	24.4	Very low	117 Å²	117	142.4 Å²	142.4	82%	0.818	84%	0.84	S	S	*	*			trans	-106	152.5	162.9	-165.9	0	0	0	0	109.7
525	S	23.5	Very low	24.4	Very low	122 Å²	122	144.4 Å²	144.4	85%	0.853	84%	0.835	S	S	*	*			trans	-77.3	151	-169.9	48.4	0	0	0	0	114.1
526	G	23.6	Very low	24.3	Very low	75 Å²	75	149.6 Å²	149.6	77%	0.773	84%	0.839	S	S	*	*			trans	-157	-7.5	-173.1	0	0	0	0	0	120.8
527	S	23.9	Very low	25.3	Very low	135 Å²	135	144.4 Å²	144.4	94%	0.944	83%	0.827	S	S	*	*			trans	64.2	144.7	174.4	-159	0	0	0	0	118.6
528	G	24.4	Very low	25.9	Very low	73 Å²	73	141 Å²	141	75%	0.753	82%	0.821	S	S	*	*			trans	163.3	123.9	173.6	0	0	0	0	0	112.3
529	V	25.8	Very low	26	Very low	139 Å²	139	140.4 Å²	140.4	84%	0.842	82%	0.822	S	S	*	*			trans	-107	151.7	-173.5	176.2	0	0	0	0	111.5
530	H	23	Very low	26.2	Very low	173 Å²	173	136.2 Å²	136.2	80%	0.801	82%	0.82	S	S	*	*			trans	-56	149.6	177.4	-61	-99.1	0	0	0	115.1
531	T	25.4	Very low	26.3	Very low	142 Å²	142	132.2 Å²	132.2	87%	0.871	82%	0.818	S	S	*	*				-174.2	166.8	120	19.7	0	0	0	0	112.2
532	D	24.4	Very low	26.3	Very low	158 Å²	158	130.8 Å²	130.8	85%	0.845	81%	0.814	S	S	*	*			trans	-97.8	130.7	-161.6	-55.2	-92.6	0	0	0	116.7
533	G	22.6	Very low	26.3	Very low	75 Å²	75	126.1 Å²	126.1	77%	0.773	81%	0.807	S	S	*	*			trans	58.5	-166.2	147.6	0	0	0	0	0	120.1
534	P	36.5	Very low	26.4	Very low	115 Å²	115	125.5 Å²	125.5	75%	0.747	80%	0.798	S	S	*	*			cis	-139.4	-175.5	-22.4	42	-25.2	0	0	0	114.8
535	L	24.1	Very low	26.5	Very low	147 Å²	147	130.1 Å²	130.1	77%	0.77	80%	0.799	S	S	*	*			trans	74.2	101.7	157.3	-56.9	173.3	0	0	0	123.4
536	Y	24.9	Very low	26.6	Very low	221 Å²	221	129.4 Å²	129.4	87%	0.867	79%	0.789	S	S	*	*				70.4	170.3	120.3	-84.6	-46.3	0	0	0	123.7
537	P	47	Very low	26.6	Very low	103 Å²	103	134.9 Å²	134.9	67%	0.669	79%	0.792	S	S	*	*			trans	-123.1	-173.1	-144.3	45.4	-28.7	0	0	0	115.3
538	P	35.6	Very low	26.8	Very low	116 Å²	116	137.3 Å²	137.3	75%	0.753	79%	0.788	S	S	*	*				-133.2	161.3	101.1	9.7	14.2	0	0	0	113.2
539	S	25.1	Very low	26.8	Very low	115 Å²	115	139.5 Å²	139.5	80%	0.804	79%	0.787	S	S	*	*				66.7	132.2	59.1	-152.5	0	0	0	0	113.6
540	A	25.4	Very low	27.2	Very low	100 Å²	100	140.8 Å²	140.8	83%	0.826	79%	0.79	S	S	*	*			cis	-162.9	173.5	-14.1	0	0	0	0	0	109.4
541	G	24.7	Very low	27.6	Very low	78 Å²	78	135 Å²	135	80%	0.804	77%	0.768	S	S	*	*			trans	176.8	97.4	173.1	0	0	0	0	0	116.3
542	E	24.2	Very low	28.1	Very low	181 Å²	181	129.7 Å²	129.7	85%	0.846	74%	0.742	S	S	*	*			trans	-80	151.7	164.8	-64.7	179.4	98.1	0	0	110
543	L	23.2	Very low	28.8	Very low	149 Å²	149	128.7 Å²	128.7	78%	0.78	74%	0.737	S	S	*	*				-170.8	123.2	71.8	-159.1	75.6	0	0	0	113.8
544	V	24	Very low	29.7	Very low	101 Å²	101	133.4 Å²	133.4	61%	0.612	74%	0.736	S	S	*	*			trans	17.6	122.6	137.4	-165.4	0	0	0	0	120.2
545	Y	24.9	Very low	30.1	Very low	214 Å²	214	133.7 Å²	133.7	84%	0.839	73%	0.727	S	S	*	*				-161.8	157	107.7	-122.7	-87.8	0	0	0	115.5
546	T	25.5	Very low	31.4	Very low	107 Å²	107	129.6 Å²	129.6	66%	0.656	71%	0.705	S	S	*	*			trans	-67.3	155.6	-161.1	58.4	0	0	0	0	118.4
547	K	23.7	Very low	32.8	Very low	191 Å²	191	121.9 Å²	121.9	83%	0.83	69%	0.687	S	S	*	*				-154.1	163.9	121	-118.2	171.5	-175.1	176.9	0	113.8
548	E	27.7	Very low	33.2	Very low	185 Å²	185	123.1 Å²	123.1	86%	0.864	68%	0.684	S	S	*	*			trans	-78.2	149.1	-162	-57.4	150.9	123.1	0	0	114.4
549	T	25.7	Very low	34.3	Very low	120 Å²	120	118.1 Å²	118.1	74%	0.736	65%	0.652	S	S	*	*			trans	-142.9	97.1	174.3	27.8	0	0	0	0	113.5	S551	T549-S551 PolarHBondContact O-N 3.05Å; T549-S551 PolarHBondContact O-OG 3.04Å
550	D	34	Very low	36.2	Very low	166 Å²	166	113.8 Å²	113.8	89%	0.888	62%	0.619	S	S	*	*			trans	-59.3	112.1	162.8	174.5	30.3	0	0	0	110.4
551	S	31.7	Very low	37.9	Very low	50 Å²	50	112.1 Å²	112.1	35%	0.35	60%	0.602	S	S	.	*			trans	-153.6	2	-169	54.8	0	0	0	0	116.1	T549 D553 K554	T549-S551 PolarHBondContact O-N 3.05Å; T549-S551 PolarHBondContact O-OG 3.04Å; S551-D553 PolarHBondContact O-N 3.25Å; S551-K554 PolarHBondContact O-N 3.16Å
552	G	35.2	Very low	39.6	Very low	31 Å²	31	112.8 Å²	112.8	32%	0.32	58%	0.584	S	S	.	*	H	α-helix	trans	-58.1	-42.7	-164.3	0	0	0	0	0	115.8	K554 Q555 M556	G552-K554 VanDerWaalsContact C-N 3.25Å; G552-K554 PolarHBondContact O-N 3.34Å; G552-Q555 PolarHBondContact O-N 2.86Å; G552-M556 PolarHBondContact O-N 3.33Å
553	D	39.5	Very low	41.1	Very low	138 Å²	138	104.9 Å²	104.9	74%	0.738	55%	0.547	S	S	*	.	H	α-helix	trans	-62.4	-29	-174.7	-71.6	-15.5	0	0	0	113.9	S551 M556	S551-D553 PolarHBondContact O-N 3.25Å; D553-M556 WeakPolarHBondContact OD1-CE 3.27Å
554	K	40.6	Very low	42.6	Very low	173 Å²	173	105 Å²	105	75%	0.752	54%	0.544	S	S	*	.	H	α-helix	trans	-77.7	-45.9	176	-75	-168.1	172.2	-169.7	0	111.7	S551 G552 M556 A557 E558	S551-K554 PolarHBondContact O-N 3.16Å; G552-K554 VanDerWaalsContact C-N 3.25Å; G552-K554 PolarHBondContact O-N 3.34Å; K554-M556 VanDerWaalsContact C-N 3.28Å; K554-M556 PolarHBondContact O-N 2.82Å; K554-A557 PolarHBondContact O-N 2.73Å; K554-E558 PolarHBondContact O-N 2.72Å; K554-E558 VanDerWaalsContact O-N 3.12Å
555	Q	45.1	Very low	44	Very low	121 Å²	121	100.9 Å²	100.9	57%	0.565	52%	0.518	S	S	*	.	H	α-helix	trans	-61.2	-36.7	179.5	-69.6	-178.3	-16.4	0	0	112	G552 E558 A559	G552-Q555 PolarHBondContact O-N 2.86Å; Q555-E558 PolarHBondContact O-N 2.94Å; Q555-A559 WeakPolarHBondContact O-CB 3.39Å; Q555-A559 PolarHBondContact O-N 2.94Å
556	M	52.6	Low	44.6	Very low	62 Å²	62	100.3 Å²	100.3	31%	0.305	52%	0.515	S	S	.	.	H	α-helix	trans	-65.1	-41	176.1	-71.8	-173.3	-71	0	0	112.9	G552 D553 K554 E558 A559 I560	G552-M556 PolarHBondContact O-N 3.33Å; D553-M556 WeakPolarHBondContact OD1-CE 3.27Å; K554-M556 VanDerWaalsContact C-N 3.28Å; K554-M556 PolarHBondContact O-N 2.82Å; M556-E558 VanDerWaalsContact C-N 3.32Å; M556-E558 PolarHBondContact O-N 3.42Å; M556-A559 PolarHBondContact O-N 2.98Å; M556-I560 VanDerWaalsContact O-CG1 3.28Å; M556-I560 WeakPolarHBondContact O-CG1 3.35Å; M556-I560 PolarHBondContact O-N 3.08Å; M556-I560 VanDerWaalsContact O-N 3.12Å
557	A	53.7	Low	45.2	Very low	58 Å²	58	99.4 Å²	99.4	48%	0.479	51%	0.513	S	S	.	.	H	α-helix	trans	-67.7	-34	177.7	0	0	0	0	0	112.7	K554 S561	K554-A557 PolarHBondContact O-N 2.73Å; A557-S561 PolarHBondContact O-OG 3.36Å
558	E	55.4	Low	45.4	Very low	130 Å²	130	95.8 Å²	95.8	61%	0.607	51%	0.507	S	S	*	.	H	α-helix	trans	-68.7	-49.4	174.6	-164.8	167.6	-173.1	0	0	110.9	K554 Q555 M556 I560 S561 E562	K554-E558 PolarHBondContact O-N 2.72Å; K554-E558 VanDerWaalsContact O-N 3.12Å; Q555-E558 PolarHBondContact O-N 2.94Å; M556-E558 VanDerWaalsContact C-N 3.32Å; M556-E558 PolarHBondContact O-N 3.42Å; E558-I560 PolarHBondContact O-N 3.11Å; E558-S561 WeakPolarHBondContact O-CA 3.47Å; E558-S561 WeakPolarHBondContact O-CB 3.16Å; E558-S561 PolarHBondContact O-N 2.59Å; E558-E562 PolarHBondContact O-N 2.72Å
559	A	57.6	Low	45.6	Very low	11 Å²	11	93.1 Å²	93.1	9%	0.091	50%	0.503	C	S	.	.	H	α-helix	trans	-61	-39.2	179	0	0	0	0	0	114.1	L319 Q555 M556 S561 L563	L319-A559 HydrophobicContact CD1-CB 4.34Å; Q555-A559 WeakPolarHBondContact O-CB 3.39Å; Q555-A559 PolarHBondContact O-N 2.94Å; M556-A559 PolarHBondContact O-N 2.98Å; A559-S561 PolarHBondContact O-N 3.48Å; A559-L563 WeakPolarHBondContact O-CB 3.45Å; A559-L563 PolarHBondContact O-N 2.8Å; A559-L563 VanDerWaalsContact O-N 3.08Å
560	I	65.1	Low	45.5	Very low	23 Å²	23	93 Å²	93	12%	0.118	50%	0.502	C	S	.	.	H	α-helix	trans	-60.3	-34.3	173.6	-70	167.4	0	0	0	111.4	A316 L319 M556 E558 L565	A316-I560 HydrophobicContact CB-CD1 4.42Å; L319-I560 HydrophobicContact CD1-CB 4.42Å; L319-I560 HydrophobicContact CD1-CG1 3.45Å; L319-I560 VanDerWaalsContact CD1-CG1 3.45Å; M556-I560 VanDerWaalsContact O-CG1 3.28Å; M556-I560 WeakPolarHBondContact O-CG1 3.35Å; M556-I560 PolarHBondContact O-N 3.08Å; M556-I560 VanDerWaalsContact O-N 3.12Å; E558-I560 PolarHBondContact O-N 3.11Å; I560-L565 HydrophobicContact CG2-CB 4.46Å; I560-L565 PolarHBondContact O-N 2.96Å
561	S	61.6	Low	45.2	Very low	66 Å²	66	88.8 Å²	88.8	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-79.9	-49.3	-178.7	-54.1	0	0	0	0	111.2	A557 E558 A559 L563 H564	A557-S561 PolarHBondContact O-OG 3.36Å; E558-S561 WeakPolarHBondContact O-CA 3.47Å; E558-S561 WeakPolarHBondContact O-CB 3.16Å; E558-S561 PolarHBondContact O-N 2.59Å; A559-S561 PolarHBondContact O-N 3.48Å; S561-L563 PolarHBondContact O-N 3.12Å; S561-H564 PolarHBondContact O-N 2.82Å; S561-H564 VanDerWaalsContact O-N 3.11Å
562	E	60.3	Low	44.9	Very low	92 Å²	92	95 Å²	95	43%	0.43	52%	0.52	S	S	.	.	H	α-helix	trans	-59.1	-42.4	179.7	-81.1	-70.4	112	0	0	113.2	T327 E558 H564	T327-E562 WeakPolarHBondContact CB-OE2 3.04Å; T327-E562 HydrophobicContact CG2-CB 3.76Å; T327-E562 WeakPolarHBondContact CG2-O 3.32Å; T327-E562 WeakPolarHBondContact CG2-OE2 3.48Å; T327-E562 PolarHBondContact OG1-OE2 3.32Å; E558-E562 PolarHBondContact O-N 2.72Å; E562-H564 PolarHBondContact O-N 2.82Å; E562-H564 VanDerWaalsContact O-N 3.16Å; E562-H564 PolarHBondContact O-ND1 3.48Å
563	L	56.5	Low	44.6	Very low	14 Å²	14	102.4 Å²	102.4	7%	0.073	55%	0.547	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	10.9	178.3	-69.2	177.5	0	0	0	114.2	L319 P325 T327 A330 R335 V338 A559 S561 L565	L319-L563 HydrophobicContact CD2-CD1 3.56Å; P325-L563 HydrophobicContact CB-CD1 4.19Å; P325-L563 HydrophobicContact CG-CD1 3.95Å; P325-L563 VanDerWaalsContact O-CD1 3.24Å; P325-L563 WeakPolarHBondContact O-CD1 3.48Å; T327-L563 HydrophobicContact CG2-CD2 4.27Å; A330-L563 HydrophobicContact CB-CD2 4.36Å; R335-L563 HydrophobicContact CG-CD2 4.38Å; V338-L563 HydrophobicContact CG1-CD1 4.38Å; A559-L563 WeakPolarHBondContact O-CB 3.45Å; A559-L563 PolarHBondContact O-N 2.8Å; A559-L563 VanDerWaalsContact O-N 3.08Å; S561-L563 PolarHBondContact O-N 3.12Å; L563-L565 VanDerWaalsContact C-N 3.27Å; L563-L565 HydrophobicContact CB-CG 4.47Å; L563-L565 PolarHBondContact O-N 2.98Å
564	H	54	Low	43.9	Very low	152 Å²	152	103.3 Å²	103.3	70%	0.704	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.6	39.3	174.8	-67.3	65.9	0	0	0	113.3	S561 E562 R566	S561-H564 PolarHBondContact O-N 2.82Å; S561-H564 VanDerWaalsContact O-N 3.11Å; E562-H564 PolarHBondContact O-N 2.82Å; E562-H564 VanDerWaalsContact O-N 3.16Å; E562-H564 PolarHBondContact O-ND1 3.48Å; H564-R566 PolarHBondContact O-N 3.43Å
565	L	53.4	Low	43.1	Very low	14 Å²	14	104.5 Å²	104.5	7%	0.073	56%	0.557	C	S	.	*			trans	-77.5	4.4	178.6	-74.7	174.6	0	0	0	114	Q315 L319 V338 I560 L563 S567	Q315-L565 PolarHBondContact NE2-O 3.5Å; L319-L565 HydrophobicContact CD1-CD1 4.11Å; L319-L565 HydrophobicContact CD2-CD1 4.03Å; L319-L565 HydrophobicContact CG-CD1 4.1Å; V338-L565 HydrophobicContact CG1-CD1 4.09Å; V338-L565 HydrophobicContact CG1-CD2 4.06Å; V338-L565 HydrophobicContact CG1-CG 4.45Å; I560-L565 HydrophobicContact CG2-CB 4.46Å; I560-L565 PolarHBondContact O-N 2.96Å; L563-L565 VanDerWaalsContact C-N 3.27Å; L563-L565 HydrophobicContact CB-CG 4.47Å; L563-L565 PolarHBondContact O-N 2.98Å; L565-S567 PolarHBondContact O-N 3.5Å
566	R	38.4	Very low	42.2	Very low	202 Å²	202	106.8 Å²	106.8	76%	0.762	57%	0.574	S	S	*	*			trans	-77.7	119.6	172.5	-74.4	-172.7	174.1	-159.1	0.4	110.9	H564 T568	H564-R566 PolarHBondContact O-N 3.43Å; R566-T568 PolarHBondContact O-N 3.42Å; R566-T568 VanDerWaalsContact O-N 3.17Å
567	S	36.9	Very low	40.8	Very low	88 Å²	88	112.7 Å²	112.7	62%	0.615	59%	0.592	S	S	*	*			trans	-80	88.6	172.8	54.5	0	0	0	0	111.7	L565	L565-S567 PolarHBondContact O-N 3.5Å
568	T	28.1	Very low	39.4	Very low	115 Å²	115	116.2 Å²	116.2	71%	0.706	60%	0.599	S	S	*	*			trans	-79.1	119.9	154	47	0	0	0	0	108.5	R566 T570	R566-T568 PolarHBondContact O-N 3.42Å; R566-T568 VanDerWaalsContact O-N 3.17Å; T568-T570 PolarHBondContact O-N 2.73Å
569	V	31.3	Very low	37.9	Very low	129 Å²	129	116.2 Å²	116.2	78%	0.782	60%	0.603	S	S	*	*			trans	-80.1	86.7	179.7	-177.4	0	0	0	0	109.4
570	T	24.8	Very low	36.3	Very low	119 Å²	119	123 Å²	123	73%	0.73	63%	0.633	S	S	*	*			trans	-137.4	108.1	169.2	50.3	0	0	0	0	108.4	T568	T568-T570 PolarHBondContact O-N 2.73Å
571	G	26.7	Very low	34.7	Very low	76 Å²	76	127.4 Å²	127.4	78%	0.784	66%	0.663	S	S	*	*			trans	-90.4	117.7	-178.3	0	0	0	0	0	112.3
572	H	25.3	Very low	32.9	Very low	180 Å²	180	130.8 Å²	130.8	83%	0.833	68%	0.675	S	S	*	*			trans	-140.3	133	159.9	-97.2	-92.4	0	0	0	108
573	Q	29.3	Very low	31	Very low	188 Å²	188	132.4 Å²	132.4	88%	0.879	70%	0.697	S	S	*	*			trans	-146.3	134.5	164.6	-70.7	-164.8	-84.7	0	0	108.7
574	D	24.9	Very low	29.5	Very low	156 Å²	156	138.5 Å²	138.5	83%	0.834	73%	0.728	S	S	*	*			trans	-86.9	166.2	174.8	-57.9	-72	0	0	0	111.5
575	F	25	Very low	27.9	Very low	199 Å²	199	136.8 Å²	136.8	87%	0.873	73%	0.733	S	S	*	*			trans	-92.3	150	-176.8	-73.6	-99.1	0	0	0	112.4
576	D	24.6	Very low	26.4	Very low	169 Å²	169	142.9 Å²	142.9	90%	0.904	77%	0.766	S	S	*	*			trans	-150.6	168.6	140.2	-122.6	-35.8	0	0	0	111.9
577	R	24.4	Very low	25.7	Very low	186 Å²	186	141.1 Å²	141.1	70%	0.702	77%	0.771	S	S	*	*			trans	-135.5	167.7	-154.7	-176.2	177.9	142.7	-76.5	-13.5	114
578	E	23.4	Very low	25.3	Very low	131 Å²	131	144.3 Å²	144.3	61%	0.612	78%	0.781	S	S	*	*			trans	89.7	146.7	169.7	-53.7	-152.8	165.4	0	0	116.8
579	N	25.1	Very low	25.1	Very low	130 Å²	130	144.1 Å²	144.1	70%	0.695	78%	0.783	S	S	*	*			cis	-153.8	174.7	-20.3	-108.6	-30.8	0	0	0	110.9
580	Q	23.7	Very low	24.9	Very low	153 Å²	153	147.9 Å²	147.9	72%	0.715	79%	0.789	S	S	*	*			trans	-90.7	170.7	-172.2	-114.1	-178.2	57.5	0	0	113.8
581	P	31.5	Very low	24.9	Very low	117 Å²	117	150.3 Å²	150.3	76%	0.76	80%	0.797	S	S	*	*			cis	-147.9	152.5	49	40.2	-18.4	0	0	0	121.5
582	L	22.6	Very low	25	Very low	136 Å²	136	156 Å²	156	71%	0.712	80%	0.803	S	S	*	*			trans	12.5	131.2	146	-63.3	163.3	0	0	0	123.6
583	S	22.4	Very low	25.3	Very low	127 Å²	127	150.6 Å²	150.6	89%	0.888	80%	0.796	S	S	*	*			trans	-147.5	161.8	137.8	-172.5	0	0	0	0	109.6
584	I	23.5	Very low	25.3	Very low	142 Å²	142	150.9 Å²	150.9	73%	0.728	79%	0.794	S	S	*	*			trans	-131.7	125.8	-162.3	-59.3	170.9	0	0	0	113
585	S	21.5	Very low	25.5	Very low	116 Å²	116	152.6 Å²	152.6	81%	0.811	80%	0.797	S	S	*	*			trans	-168.3	124.6	143.5	43.6	0	0	0	0	114.5
586	N	21.5	Very low	25.8	Very low	142 Å²	142	149 Å²	149	76%	0.759	79%	0.786	S	S	*	*			trans	0.6	126.2	162.2	-53.9	-15.7	0	0	0	120.9
587	N	24	Very low	26.1	Very low	164 Å²	164	151.5 Å²	151.5	88%	0.877	78%	0.783	S	S	*	*				-165	170.9	112.6	-102.5	-58.4	0	0	0	111.8
588	L	27	Very low	26.6	Very low	156 Å²	156	148.5 Å²	148.5	82%	0.817	79%	0.787	S	S	*	*			trans	-94	157.4	-162.1	-97.5	69.4	0	0	0	116.5
589	C	25.3	Very low	27.9	Very low	111 Å²	111	146.5 Å²	146.5	75%	0.75	78%	0.778	S	S	*	*			trans	87.8	148.1	166.2	-60.3	0	0	0	0	118.4
590	F	26.3	Very low	29.6	Very low	208 Å²	208	142.5 Å²	142.5	91%	0.912	76%	0.76	S	S	*	*			trans	66	115.7	-170.3	-64.4	-82.6	0	0	0	115.7
591	L	25.5	Very low	31.6	Very low	170 Å²	170	138.3 Å²	138.3	89%	0.89	75%	0.746	S	S	*	*			trans	-150.4	86.9	176.9	-166	90.5	0	0	0	111.1
592	E	28.5	Very low	33.2	Very low	196 Å²	196	141 Å²	141	92%	0.916	75%	0.748	S	S	*	*			trans	-120.4	163.6	152.9	-76.1	-166.6	122.6	0	0	107.9
593	G	32.1	Very low	35.8	Very low	66 Å²	66	138.1 Å²	138.1	68%	0.68	73%	0.734	S	S	*	*			trans	96.5	19.3	167.3	0	0	0	0	0	118.5
594	K	27.9	Very low	38.4	Very low	193 Å²	193	132.8 Å²	132.8	84%	0.839	70%	0.697	S	S	*	*	S	Bend	trans	-128.2	108.9	163.1	-78.3	-174.1	178.1	174.6	0	111.8	L596	K594-L596 PolarHBondContact O-N 3.14Å
595	H	30.5	Very low	41.5	Very low	192 Å²	192	127.6 Å²	127.6	89%	0.889	67%	0.669	S	S	*	*			trans	24.1	79.1	169.3	-107.1	-70	0	0	0	114.4	R597	H595-R597 PolarHBondContact O-N 3.12Å
596	L	29.6	Very low	44.5	Very low	124 Å²	124	126 Å²	126	65%	0.649	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-56.1	131.9	158.7	-88.5	77.9	0	0	0	107.3	K594	K594-L596 PolarHBondContact O-N 3.14Å
597	R	31	Very low	47.7	Very low	222 Å²	222	120.2 Å²	120.2	84%	0.838	62%	0.619	S	S	*	*	P	Polyproline II helix	trans	-51.1	151.7	158.3	-86	178.6	163.2	-178.5	-5.9	108.4	H595 H599	H595-R597 PolarHBondContact O-N 3.12Å; R597-H599 PolarHBondContact O-N 2.98Å
598	P	35.9	Very low	50.5	Low	122 Å²	122	112.5 Å²	112.5	79%	0.792	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-48.8	130.8	170.4	23.2	-34.3	0	0	0	108.8	S600	P598-S600 PolarHBondContact O-N 2.87Å
599	H	49.6	Very low	53.3	Low	90 Å²	90	106.8 Å²	106.8	42%	0.417	55%	0.551	S	S	.	*	P	Polyproline II helix	trans	-49.9	128.4	178.1	-73.2	-86.3	0	0	0	108.1	I371 R597	I371-H599 HydrophobicContact CD1-CB 3.97Å; I371-H599 VanDerWaalsContact CD1-O 3.26Å; I371-H599 WeakPolarHBondContact CD1-O 3.08Å; R597-H599 PolarHBondContact O-N 2.98Å
600	S	61.3	Low	56	Low	45 Å²	45	110.1 Å²	110.1	32%	0.315	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-54.9	132.7	173.4	44.5	0	0	0	0	107.8	P598 Q602 N603 A604	P598-S600 PolarHBondContact O-N 2.87Å; S600-Q602 PolarHBondContact O-N 3.35Å; S600-N603 PolarHBondContact O-N 3.01Å; S600-N603 VanDerWaalsContact OG-CG 3.24Å; S600-N603 PolarHBondContact OG-OD1 3.37Å; S600-N603 VanDerWaalsContact OG-OD1 3.07Å; S600-A604 PolarHBondContact O-N 3.47Å
601	P	66.9	Low	58.6	Low	65 Å²	65	104.4 Å²	104.4	42%	0.422	54%	0.538	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.5	-26.4	178.9	-32.3	38.5	0	0	0	113.5	M364 A369 N603	M364-P601 HydrophobicContact SD-CB 3.83Å; A369-P601 HydrophobicContact CB-CG 3.9Å; P601-N603 VanDerWaalsContact C-N 3.33Å; P601-N603 PolarHBondContact O-N 3.11Å
602	Q	63.8	Low	61.4	Low	174 Å²	174	99.3 Å²	99.3	81%	0.813	51%	0.507	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-30	173.4	-65.4	158.6	-11.2	0	0	114.3	S600	S600-Q602 PolarHBondContact O-N 3.35Å
603	N	77.5	Confident	64.1	Low	76 Å²	76	97 Å²	97	41%	0.406	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.7	-7.8	-172.4	-61.9	37.5	0	0	0	113.2	S600 P601 F605 Q606	S600-N603 PolarHBondContact O-N 3.01Å; S600-N603 VanDerWaalsContact OG-CG 3.24Å; S600-N603 PolarHBondContact OG-OD1 3.37Å; S600-N603 VanDerWaalsContact OG-OD1 3.07Å; P601-N603 VanDerWaalsContact C-N 3.33Å; P601-N603 PolarHBondContact O-N 3.11Å; N603-F605 PolarHBondContact O-N 3.22Å; N603-F605 VanDerWaalsContact O-N 3.1Å; N603-Q606 WeakPolarHBondContact O-CB 3.14Å; N603-Q606 PolarHBondContact O-N 3.12Å
604	A	77.8	Confident	66.5	Low	15 Å²	15	96.6 Å²	96.6	12%	0.124	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-24.6	-176.1	0	0	0	0	0	114.1	T362 I371 S600	T362-A604 HydrophobicContact CG2-CB 4.4Å; I371-A604 HydrophobicContact CD1-CB 3.66Å; I371-A604 HydrophobicContact CG1-CB 4.17Å; I371-A604 HydrophobicContact CG2-CB 4.5Å; S600-A604 PolarHBondContact O-N 3.47Å
605	F	86.9	Confident	69.2	Low	32 Å²	32	91.8 Å²	91.8	14%	0.14	47%	0.471	C	S	.	.	T	Hydrogen-bonded Turn	trans	-119.9	21.1	-174.9	-60.3	-70.4	0	0	0	112.4	T362 M364 N603 M631 R671 Q673	T362-F605 HydrophobicContact CG2-CD1 4.17Å; T362-F605 HydrophobicContact CG2-CE1 3.65Å; T362-F605 HydrophobicContact CG2-CZ 4.02Å; M364-F605 HydrophobicContact CB-CE2 3.84Å; M364-F605 HydrophobicContact CB-CZ 3.72Å; M364-F605 HydrophobicContact CE-CE2 4.03Å; M364-F605 HydrophobicContact SD-CE2 4.02Å; N603-F605 PolarHBondContact O-N 3.22Å; N603-F605 VanDerWaalsContact O-N 3.1Å; F605-M631 HydrophobicContact CB-CE 3.56Å; F605-M631 HydrophobicContact CD1-CE 3.7Å; F605-M631 HydrophobicContact CD2-CE 3.68Å; F605-M631 HydrophobicContact CE1-CE 4.28Å; F605-M631 HydrophobicContact CE2-CE 4.27Å; F605-M631 HydrophobicContact CG-CE 3.35Å; F605-R671 HydrophobicContact CE2-CB 4.27Å; F605-R671 HydrophobicContact CZ-CB 3.93Å; F605-Q673 HydrophobicContact CD1-CB 3.71Å; F605-Q673 HydrophobicContact CE1-CB 3.95Å
606	Q	86.4	Confident	71.4	Confident	83 Å²	83	88.1 Å²	88.1	39%	0.388	47%	0.467	S	S	.	.			trans	-78.4	133.4	-175.6	-166.2	179.6	5.3	0	0	111.9	N603 S717 A718 M725	N603-Q606 WeakPolarHBondContact O-CB 3.14Å; N603-Q606 PolarHBondContact O-N 3.12Å; Q606-S717 CarbonylContact O-C 3.6Å; Q606-A718 HydrophobicContact CB-CB 3.87Å; Q606-A718 HydrophobicContact CG-CB 3.86Å; Q606-A718 WeakPolarHBondContact O-CB 3.31Å; Q606-A718 PolarHBondContact O-N 2.78Å; Q606-M725 HydrophobicContact CG-CE 4.24Å
607	T	87.4	Confident	73.7	Confident	20 Å²	20	88.4 Å²	88.4	12%	0.123	46%	0.463	C	S	.	.	B	Isolated β-bridge	trans	-94.8	159.9	176.2	47.3	0	0	0	0	112.6	S609 L675 P714 C716 M725	T607-S609 VanDerWaalsContact C-N 3.29Å; T607-S609 WeakPolarHBondContact CB-O 3.3Å; T607-S609 PolarHBondContact O-N 3.41Å; T607-S609 PolarHBondContact OG1-O 3.12Å; T607-L675 HydrophobicContact CG2-CD1 4.35Å; T607-L675 HydrophobicContact CG2-CD2 3.81Å; T607-P714 WeakPolarHBondContact CG2-O 3.45Å; T607-C716 CarbonylContact C-O 3.55Å; T607-C716 WeakPolarHBondContact CA-O 3.07Å; T607-M725 WeakPolarHBondContact O-CE 3.16Å
608	L	83.8	Confident	76.4	Confident	3 Å²	3	79.6 Å²	79.6	2%	0.016	43%	0.431	C	S	.	.	S	Bend	trans	-61	-35.4	176.9	-72.6	-179.8	0	0	0	113.4	A713 C716 S717 C720 A723 M725 G726 V729	L608-A713 HydrophobicContact CB-CB 4.33Å; L608-C716 HydrophobicContact CB-CB 4.41Å; L608-C716 HydrophobicContact CD1-CB 3.45Å; L608-C716 VanDerWaalsContact CD1-CB 3.45Å; L608-C716 HydrophobicContact CG-CB 3.74Å; L608-C716 PolarHBondContact N-O 3.41Å; L608-S717 VanDerWaalsContact CD2-O 3.31Å; L608-S717 WeakPolarHBondContact CD2-O 3.37Å; L608-S717 WeakPolarHBondContact CG-O 3.46Å; L608-C720 HydrophobicContact CD1-CB 4.07Å; L608-C720 HydrophobicContact CD2-CB 4.27Å; L608-C720 HydrophobicContact CG-CB 4.26Å; L608-A723 HydrophobicContact CD1-CB 3.6Å; L608-M725 HydrophobicContact CD2-SD 4.43Å; L608-G726 PolarHBondContact O-N 3.03Å; L608-V729 HydrophobicContact CD1-CG2 3.84Å
609	S	85.4	Confident	79.1	Confident	35 Å²	35	74 Å²	74	25%	0.245	40%	0.395	C	S	.	.	S	Bend	trans	-131.9	179.6	-179.8	70.2	0	0	0	0	111.3	T607 A713 P714	T607-S609 VanDerWaalsContact C-N 3.29Å; T607-S609 WeakPolarHBondContact CB-O 3.3Å; T607-S609 PolarHBondContact O-N 3.41Å; T607-S609 PolarHBondContact OG1-O 3.12Å; S609-A713 WeakPolarHBondContact OG-CB 3.28Å; S609-P714 WeakPolarHBondContact OG-CA 3.34Å; S609-P714 WeakPolarHBondContact OG-CD 3.27Å; S609-P714 VanDerWaalsContact OG-N 3.1Å
610	Q	81.3	Confident	81.2	Confident	181 Å²	181	70 Å²	70	85%	0.846	38%	0.377	S	S	*	.	P	Polyproline II helix	trans	-58.7	142.3	175.1	-66.7	-178.8	-6.3	0	0	111.6
611	T	80.4	Confident	82.9	Confident	89 Å²	89	67.9 Å²	67.9	55%	0.546	36%	0.362	S	S	.	.	P	Polyproline II helix	trans	-55.5	136.3	178.5	-46.4	0	0	0	0	111.5	I613 Y626	T611-I613 PolarHBondContact O-N 3.38Å; T611-Y626 HydrophobicContact CG2-CD2 4.36Å; T611-Y626 HydrophobicContact CG2-CE2 3.77Å
612	Y	85.9	Confident	84.3	Confident	62 Å²	62	66.7 Å²	66.7	24%	0.243	35%	0.351	C	S	.	.	P	Polyproline II helix	trans	-62.4	128.6	175.7	-171.7	-108.3	0	0	0	111.3	T614 E618 Q622 F715	Y612-T614 HydrophobicContact CD1-CG2 3.8Å; Y612-T614 HydrophobicContact CE1-CG2 3.89Å; Y612-E618 PolarHBondContact OH-OE1 3.28Å; Y612-E618 VanDerWaalsContact OH-OE1 3.1Å; Y612-Q622 HydrophobicContact CD1-CB 4.13Å; Y612-Q622 HydrophobicContact CD2-CB 4.32Å; Y612-Q622 HydrophobicContact CE1-CB 3.59Å; Y612-Q622 HydrophobicContact CE2-CB 3.84Å; Y612-Q622 HydrophobicContact CE2-CG 4.3Å; Y612-Q622 HydrophobicContact CG-CB 4.47Å; Y612-Q622 VanDerWaalsContact CZ-CB 3.44Å; Y612-F715 HydrophobicContact CG-CE1 4.44Å; Y612-F715 HydrophobicContact CG-CZ 4.11Å
613	I	84.8	Confident	85.7	Confident	147 Å²	147	58.8 Å²	58.8	75%	0.754	32%	0.315	S	S	*	.			trans	-96.3	108.4	177.5	-57.3	176.7	0	0	0	108	T611	T611-I613 PolarHBondContact O-N 3.38Å
614	T	83	Confident	86.6	Confident	58 Å²	58	55.2 Å²	55.2	36%	0.356	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-76.8	145.5	176.1	49.8	0	0	0	0	111.8	Y612 Y626	Y612-T614 HydrophobicContact CD1-CG2 3.8Å; Y612-T614 HydrophobicContact CE1-CG2 3.89Å; T614-Y626 HydrophobicContact CG2-CD1 3.6Å; T614-Y626 HydrophobicContact CG2-CE1 4.24Å; T614-Y626 HydrophobicContact CG2-CG 3.94Å
615	T	83.5	Confident	87.4	Confident	92 Å²	92	54.5 Å²	54.5	56%	0.564	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-93.6	157.6	172.3	60.6	0	0	0	0	111.6	K617 E618	T615-K617 PolarHBondContact O-N 3.1Å; T615-E618 WeakPolarHBondContact CB-OE2 3.32Å; T615-E618 PolarHBondContact N-OE2 2.72Å; T615-E618 WeakPolarHBondContact O-CB 3.26Å; T615-E618 PolarHBondContact O-N 3.47Å; T615-E618 WeakPolarHBondContact OG1-CB 3.29Å; T615-E618 PolarHBondContact OG1-OE2 3.15Å
616	S	76.6	Confident	87.8	Confident	116 Å²	116	57.1 Å²	57.1	81%	0.811	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	131.1	-179.3	-166.8	0	0	0	0	111	E618	S616-E618 PolarHBondContact O-N 2.92Å
617	K	79.1	Confident	88.1	Confident	130 Å²	130	57 Å²	57	57%	0.565	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.6	4.6	-178	-52.2	174.6	174.1	-84	0	116.4	E388 T615 R702	E388-K617 IonicContact OE1-NZ 3.98Å; E388-K617 PolarHBondContact OE1-NZ 2.8Å; E388-K617 IonicContact OE2-NZ 3.06Å; E388-K617 PolarHBondContact OE2-NZ 2.8Å; T615-K617 PolarHBondContact O-N 3.1Å; K617-R702 PolarHBondContact O-NH2 2.73Å
618	E	87.3	Confident	88.4	Confident	37 Å²	37	58.6 Å²	58.6	17%	0.173	30%	0.304	C	S	.	.			trans	-51.8	151.1	174.6	-155.5	-176.8	127.7	0	0	112.3	Y612 T615 S616 S620	Y612-E618 PolarHBondContact OH-OE1 3.28Å; Y612-E618 VanDerWaalsContact OH-OE1 3.1Å; T615-E618 WeakPolarHBondContact CB-OE2 3.32Å; T615-E618 PolarHBondContact N-OE2 2.72Å; T615-E618 WeakPolarHBondContact O-CB 3.26Å; T615-E618 PolarHBondContact O-N 3.47Å; T615-E618 WeakPolarHBondContact OG1-CB 3.29Å; T615-E618 PolarHBondContact OG1-OE2 3.15Å; S616-E618 PolarHBondContact O-N 2.92Å; E618-S620 WeakPolarHBondContact OE1-CB 3.44Å; E618-S620 PolarHBondContact OE1-OG 2.78Å
619	C	91.6	Very high	89	Confident	3 Å²	3	58.7 Å²	58.7	2%	0.02	31%	0.305	C	S	.	.			trans	-146.5	54.3	172.2	-164.6	0	0	0	0	110	V704 D705	C619-V704 CarbonylContact O-C 3.57Å; C619-V704 WeakPolarHBondContact O-CA 3.36Å; C619-V704 VanDerWaalsContact O-CG1 3.31Å; C619-V704 WeakPolarHBondContact O-CG1 3.47Å; C619-D705 PolarHBondContact O-N 3Å
620	S	95.3	Very high	89.4	Confident	7 Å²	7	58.9 Å²	58.9	5%	0.049	31%	0.306	C	S	.	.	B	Isolated β-bridge	trans	-90.1	161.2	175.5	73	0	0	0	0	111.8	E618 Q622 S623 C624 D705	E618-S620 WeakPolarHBondContact OE1-CB 3.44Å; E618-S620 PolarHBondContact OE1-OG 2.78Å; S620-Q622 PolarHBondContact O-N 3.37Å; S620-Q622 PolarHBondContact OG-N 2.86Å; S620-S623 PolarHBondContact N-OG 2.83Å; S620-S623 PolarHBondContact O-N 2.93Å; S620-S623 VanDerWaalsContact O-N 3.1Å; S620-S623 PolarHBondContact O-OG 3.01Å; S620-S623 PolarHBondContact OG-N 3.5Å; S620-C624 PolarHBondContact O-N 2.95Å; S620-C624 PolarHBondContact O-SG 2.7Å; S620-D705 CarbonylContact C-O 3.55Å; S620-D705 WeakPolarHBondContact CA-O 3.47Å
621	V	96.6	Very high	89.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-53.2	-38	166.1	161.9	0	0	0	0	111.5	L383 C624 L625 L685 L687 V704 D705 F706 L710 L809	L383-V621 HydrophobicContact CD1-CG1 4.45Å; V621-C624 PolarHBondContact O-N 2.81Å; V621-L625 HydrophobicContact CG1-CD1 3.78Å; V621-L625 HydrophobicContact CG1-CG 4.43Å; V621-L625 WeakPolarHBondContact O-CB 2.98Å; V621-L625 WeakPolarHBondContact O-CG 3.47Å; V621-L625 PolarHBondContact O-N 3.4Å; V621-L685 HydrophobicContact CG1-CD1 3.55Å; V621-L687 HydrophobicContact CG2-CD2 4.43Å; V621-V704 HydrophobicContact CG2-CG1 4.32Å; V621-D705 PolarHBondContact N-O 2.75Å; V621-F706 HydrophobicContact CB-CB 4.5Å; V621-F706 HydrophobicContact CG2-CB 3.71Å; V621-L710 HydrophobicContact CG1-CD1 4.35Å; V621-L710 HydrophobicContact CG1-CD2 4.27Å; V621-L809 HydrophobicContact CG2-CD1 3.67Å
622	Q	95.2	Very high	90.5	Very high	41 Å²	41	54.3 Å²	54.3	19%	0.192	28%	0.28	C	S	.	.	H	α-helix	trans	-65.9	-38.9	177.2	-58.7	91.1	-67.9	0	0	112.2	Y612 S620 L625 Y626 L710 F715	Y612-Q622 HydrophobicContact CD1-CB 4.13Å; Y612-Q622 HydrophobicContact CD2-CB 4.32Å; Y612-Q622 HydrophobicContact CE1-CB 3.59Å; Y612-Q622 HydrophobicContact CE2-CB 3.84Å; Y612-Q622 HydrophobicContact CE2-CG 4.3Å; Y612-Q622 HydrophobicContact CG-CB 4.47Å; Y612-Q622 VanDerWaalsContact CZ-CB 3.44Å; S620-Q622 PolarHBondContact O-N 3.37Å; S620-Q622 PolarHBondContact OG-N 2.86Å; Q622-L625 PolarHBondContact O-N 3.14Å; Q622-Y626 VanDerWaalsContact O-CB 3.3Å; Q622-Y626 WeakPolarHBondContact O-CB 3.48Å; Q622-Y626 PolarHBondContact O-N 3.27Å; Q622-L710 HydrophobicContact CG-CD1 3.87Å; Q622-F715 HydrophobicContact CB-CZ 4.26Å
623	S	94.5	Very high	91	Very high	7 Å²	7	55.5 Å²	55.5	5%	0.049	29%	0.29	C	S	.	.	H	α-helix	trans	-67.7	-36.4	174.5	73.7	0	0	0	0	112.4	S620 Q627	S620-S623 PolarHBondContact N-OG 2.83Å; S620-S623 PolarHBondContact O-N 2.93Å; S620-S623 VanDerWaalsContact O-N 3.1Å; S620-S623 PolarHBondContact O-OG 3.01Å; S620-S623 PolarHBondContact OG-N 3.5Å; S623-Q627 PolarHBondContact O-N 2.94Å
624	C	95.5	Very high	91.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.007	26%	0.262	C	S	.	.	H	α-helix	trans	-70.7	-39.8	174.7	-68.1	0	0	0	0	112.4	L383 P384 S620 V621 Q627 F628	L383-C624 HydrophobicContact CB-CB 4.08Å; L383-C624 HydrophobicContact CD1-CB 4.11Å; P384-C624 PolarHBondContact O-SG 2.72Å; S620-C624 PolarHBondContact O-N 2.95Å; S620-C624 PolarHBondContact O-SG 2.7Å; V621-C624 PolarHBondContact O-N 2.81Å; C624-Q627 PolarHBondContact O-N 2.88Å; C624-F628 WeakPolarHBondContact O-CB 3.48Å; C624-F628 PolarHBondContact O-N 3.1Å
625	L	95.9	Very high	92	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.9	-46.3	171.2	-80.6	163.4	0	0	0	111.1	L383 V621 Q622 Q627 F628 T629 L710 L712 F715	L383-L625 HydrophobicContact CD1-CD2 4.33Å; L383-L625 HydrophobicContact CD1-CG 4.02Å; L383-L625 HydrophobicContact CD2-CD2 3.85Å; L383-L625 HydrophobicContact CD2-CG 4.13Å; V621-L625 HydrophobicContact CG1-CD1 3.78Å; V621-L625 HydrophobicContact CG1-CG 4.43Å; V621-L625 WeakPolarHBondContact O-CB 2.98Å; V621-L625 WeakPolarHBondContact O-CG 3.47Å; V621-L625 PolarHBondContact O-N 3.4Å; Q622-L625 PolarHBondContact O-N 3.14Å; L625-Q627 VanDerWaalsContact C-N 3.3Å; L625-Q627 PolarHBondContact O-N 2.65Å; L625-F628 PolarHBondContact O-N 3.47Å; L625-F628 VanDerWaalsContact O-N 3.11Å; L625-T629 PolarHBondContact O-N 3.04Å; L625-T629 PolarHBondContact O-OG1 3.41Å; L625-T629 VanDerWaalsContact O-OG1 3.12Å; L625-L710 HydrophobicContact CD1-CD1 4.23Å; L625-L710 HydrophobicContact CD1-CD2 4.15Å; L625-L712 HydrophobicContact CD1-CD1 4.24Å; L625-F715 HydrophobicContact CB-CD1 3.87Å; L625-F715 HydrophobicContact CB-CD2 4.04Å; L625-F715 HydrophobicContact CB-CE1 3.79Å; L625-F715 HydrophobicContact CB-CE2 3.95Å; L625-F715 HydrophobicContact CB-CG 4Å; L625-F715 HydrophobicContact CB-CZ 3.82Å; L625-F715 HydrophobicContact CD1-CD2 4.04Å; L625-F715 HydrophobicContact CD1-CE2 3.94Å
626	Y	94.3	Very high	92.4	Very high	87 Å²	87	50 Å²	50	34%	0.341	27%	0.267	S	S	.	.	H	α-helix	trans	-56.2	-43.3	175.1	174.3	-99.6	0	0	0	112	T611 T614 Q622 T629 S630	T611-Y626 HydrophobicContact CG2-CD2 4.36Å; T611-Y626 HydrophobicContact CG2-CE2 3.77Å; T614-Y626 HydrophobicContact CG2-CD1 3.6Å; T614-Y626 HydrophobicContact CG2-CE1 4.24Å; T614-Y626 HydrophobicContact CG2-CG 3.94Å; Q622-Y626 VanDerWaalsContact O-CB 3.3Å; Q622-Y626 WeakPolarHBondContact O-CB 3.48Å; Q622-Y626 PolarHBondContact O-N 3.27Å; Y626-T629 CarbonylContact O-C 3.58Å; Y626-S630 WeakPolarHBondContact O-CA 3.46Å; Y626-S630 WeakPolarHBondContact O-CB 3.39Å; Y626-S630 PolarHBondContact O-N 3.39Å
627	Q	92.6	Very high	93.1	Very high	81 Å²	81	52.6 Å²	52.6	38%	0.379	27%	0.271	S	S	.	.	H	α-helix	trans	-64.6	-45.9	174.5	-170.2	-176	11.9	0	0	111.6	S623 C624 L625 T629 S630	S623-Q627 PolarHBondContact O-N 2.94Å; C624-Q627 PolarHBondContact O-N 2.88Å; L625-Q627 VanDerWaalsContact C-N 3.3Å; L625-Q627 PolarHBondContact O-N 2.65Å; Q627-T629 VanDerWaalsContact C-N 3.29Å; Q627-T629 PolarHBondContact O-N 2.96Å; Q627-S630 WeakPolarHBondContact O-CB 3.26Å; Q627-S630 PolarHBondContact O-N 2.84Å; Q627-S630 VanDerWaalsContact O-N 3.15Å; Q627-S630 PolarHBondContact O-OG 3.35Å
628	F	95.2	Very high	93.7	Very high	53 Å²	53	52.1 Å²	52.1	23%	0.232	28%	0.275	C	S	.	.	H	α-helix	trans	-61.2	-35.3	179.6	-179.8	-91.9	0	0	0	113	L359 I381 L383 C624 L625	L359-F628 HydrophobicContact CD1-CE1 4.16Å; L359-F628 HydrophobicContact CD1-CZ 3.98Å; L359-F628 HydrophobicContact CD2-CE1 4.04Å; I381-F628 HydrophobicContact CG2-CD1 3.87Å; I381-F628 HydrophobicContact CG2-CD2 4.23Å; I381-F628 HydrophobicContact CG2-CE1 3.63Å; I381-F628 HydrophobicContact CG2-CE2 4Å; I381-F628 HydrophobicContact CG2-CG 4.17Å; I381-F628 HydrophobicContact CG2-CZ 3.7Å; L383-F628 HydrophobicContact CD2-CB 3.81Å; L383-F628 HydrophobicContact CD2-CD2 4.42Å; L383-F628 HydrophobicContact CD2-CG 4.03Å; C624-F628 WeakPolarHBondContact O-CB 3.48Å; C624-F628 PolarHBondContact O-N 3.1Å; L625-F628 PolarHBondContact O-N 3.47Å; L625-F628 VanDerWaalsContact O-N 3.11Å
629	T	95.4	Very high	94	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.031	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	16.3	175.9	66.3	0	0	0	0	113.8	L625 Y626 Q627 Q673 L674 F715	L625-T629 PolarHBondContact O-N 3.04Å; L625-T629 PolarHBondContact O-OG1 3.41Å; L625-T629 VanDerWaalsContact O-OG1 3.12Å; Y626-T629 CarbonylContact O-C 3.58Å; Q627-T629 VanDerWaalsContact C-N 3.29Å; Q627-T629 PolarHBondContact O-N 2.96Å; T629-Q673 WeakPolarHBondContact O-CG 3.3Å; T629-Q673 PolarHBondContact O-NE2 2.99Å; T629-L674 VanDerWaalsContact CA-O 3.26Å; T629-L674 WeakPolarHBondContact CA-O 3.44Å; T629-L674 WeakPolarHBondContact CB-O 3.45Å; T629-L674 WeakPolarHBondContact CG2-O 3.25Å; T629-F715 HydrophobicContact CG2-CB 4.04Å
630	S	92.9	Very high	94.2	Very high	39 Å²	39	56.7 Å²	56.7	27%	0.273	30%	0.296	S	S	.	.	P	Polyproline II helix	trans	-71.9	155.5	179.4	65.5	0	0	0	0	111.5	Y626 Q627 E632	Y626-S630 WeakPolarHBondContact O-CA 3.46Å; Y626-S630 WeakPolarHBondContact O-CB 3.39Å; Y626-S630 PolarHBondContact O-N 3.39Å; Q627-S630 WeakPolarHBondContact O-CB 3.26Å; Q627-S630 PolarHBondContact O-N 2.84Å; Q627-S630 VanDerWaalsContact O-N 3.15Å; Q627-S630 PolarHBondContact O-OG 3.35Å; S630-E632 PolarHBondContact O-N 3.47Å
631	M	92.8	Very high	94.1	Very high	88 Å²	88	60.2 Å²	60.2	43%	0.433	31%	0.314	S	S	.	.	P	Polyproline II helix	trans	-81.3	118.8	176.9	-174.7	176.2	-66.9	0	0	110.1	F605 R671 K672	F605-M631 HydrophobicContact CB-CE 3.56Å; F605-M631 HydrophobicContact CD1-CE 3.7Å; F605-M631 HydrophobicContact CD2-CE 3.68Å; F605-M631 HydrophobicContact CE1-CE 4.28Å; F605-M631 HydrophobicContact CE2-CE 4.27Å; F605-M631 HydrophobicContact CG-CE 3.35Å; M631-R671 HydrophobicContact CG-CB 4.34Å; M631-R671 HydrophobicContact SD-CB 4.1Å; M631-R671 HydrophobicContact SD-CG 4.22Å; M631-K672 CarbonylContact C-O 3.58Å; M631-K672 WeakPolarHBondContact CA-O 3.45Å
632	E	93.7	Very high	94	Very high	87 Å²	87	60.4 Å²	60.4	41%	0.407	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	142.2	175.8	-63.4	173.2	164	0	0	110.3	S630 R671 K672	S630-E632 PolarHBondContact O-N 3.47Å; E632-R671 WeakPolarHBondContact O-CA 3.33Å; E632-K672 HydrophobicContact CB-CB 4.38Å; E632-K672 PolarHBondContact N-O 2.86Å; E632-K672 PolarHBondContact O-N 3.41Å; E632-K672 IonicContact OE1-NZ 3.24Å; E632-K672 WeakPolarHBondContact OE2-CD 3.38Å; E632-K672 IonicContact OE2-NZ 3.7Å; E632-K672 PolarHBondContact OE2-NZ 2.73Å
633	L	95	Very high	94	Very high	87 Å²	87	64.7 Å²	64.7	46%	0.455	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.2	173.7	-167.8	68.8	0	0	0	109.9	M635 R671	L633-M635 HydrophobicContact CD2-CE 4.01Å; L633-M635 HydrophobicContact CD2-CG 3.98Å; L633-M635 HydrophobicContact CD2-SD 3.57Å; L633-M635 VanDerWaalsContact CD2-SD 3.57Å; L633-M635 HydrophobicContact CG-CG 3.81Å; L633-M635 HydrophobicContact CG-SD 4.11Å; L633-M635 PolarHBondContact O-N 3Å; L633-R671 HydrophobicContact CD1-CG 3.73Å
634	L	94.8	Very high	93.9	Very high	33 Å²	33	67 Å²	67	17%	0.173	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	104.3	-179.1	-61.5	-176.8	0	0	0	109.8	V363 N638 N669 A670 K672	V363-L634 HydrophobicContact CG1-CD1 4.34Å; L634-N638 WeakPolarHBondContact CB-O 3.18Å; L634-N669 WeakPolarHBondContact O-CA 3.37Å; L634-A670 HydrophobicContact CB-CB 4.23Å; L634-A670 WeakPolarHBondContact CB-O 3.49Å; L634-A670 HydrophobicContact CD1-CB 4.23Å; L634-A670 PolarHBondContact N-O 2.7Å; L634-A670 PolarHBondContact O-N 2.94Å; L634-K672 HydrophobicContact CD1-CB 4Å; L634-K672 HydrophobicContact CD1-CD 4.36Å; L634-K672 HydrophobicContact CD2-CD 4.48Å; L634-K672 HydrophobicContact CG-CB 4.14Å
635	M	93.8	Very high	93.8	Very high	98 Å²	98	67.7 Å²	67.7	48%	0.483	35%	0.352	S	S	.	.			trans	-137.4	173	-177.5	-58.5	-160.7	-62.2	0	0	112.1	L633 N637 N638	L633-M635 HydrophobicContact CD2-CE 4.01Å; L633-M635 HydrophobicContact CD2-CG 3.98Å; L633-M635 HydrophobicContact CD2-SD 3.57Å; L633-M635 VanDerWaalsContact CD2-SD 3.57Å; L633-M635 HydrophobicContact CG-CG 3.81Å; L633-M635 HydrophobicContact CG-SD 4.11Å; L633-M635 PolarHBondContact O-N 3Å; M635-N637 PolarHBondContact O-N 3.26Å; M635-N638 PolarHBondContact O-N 3.35Å
636	G	92.6	Very high	93.6	Very high	51 Å²	51	68.6 Å²	68.6	53%	0.526	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	61	-125.3	176.9	0	0	0	0	0	111.2	N638 K639	G636-N638 PolarHBondContact O-N 2.88Å; G636-K639 WeakPolarHBondContact O-CG 3.39Å
637	N	91.3	Very high	93.5	Very high	170 Å²	170	69.2 Å²	69.2	91%	0.909	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-69	-20.8	177.4	-60.2	4.3	0	0	0	112.5	M635 K639	M635-N637 PolarHBondContact O-N 3.26Å; N637-K639 VanDerWaalsContact C-N 3.35Å; N637-K639 PolarHBondContact O-N 3.33Å
638	N	92.8	Very high	93.3	Very high	120 Å²	120	68.3 Å²	68.3	64%	0.642	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-92.4	15.5	-176.5	-62.4	-23.1	0	0	0	113.5	L634 M635 G636	L634-N638 WeakPolarHBondContact CB-O 3.18Å; M635-N638 PolarHBondContact O-N 3.35Å; G636-N638 PolarHBondContact O-N 2.88Å
639	K	93.6	Very high	92.9	Very high	87 Å²	87	69 Å²	69	38%	0.378	36%	0.362	S	S	.	.			trans	-60.8	144.8	-178.7	-82	177.8	174.9	-168.5	0	112.6	G636 N637 T668 N669	G636-K639 WeakPolarHBondContact O-CG 3.39Å; N637-K639 VanDerWaalsContact C-N 3.35Å; N637-K639 PolarHBondContact O-N 3.33Å; K639-T668 WeakPolarHBondContact CB-O 3.45Å; K639-N669 VanDerWaalsContact CE-OD1 3.27Å; K639-N669 WeakPolarHBondContact CE-OD1 3.45Å
640	L	94.6	Very high	92.4	Very high	48 Å²	48	71.9 Å²	71.9	25%	0.251	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	124.5	176.3	177	68.3	0	0	0	110.8	V363 C365 C642 Y667 T668 A670	V363-L640 HydrophobicContact CG1-CD1 4.36Å; V363-L640 HydrophobicContact CG1-CD2 3.87Å; C365-L640 HydrophobicContact CB-CD2 4.26Å; L640-C642 PolarHBondContact O-N 3.07Å; L640-C642 VanDerWaalsContact O-N 3.08Å; L640-Y667 CarbonylContact O-C 3.57Å; L640-Y667 WeakPolarHBondContact O-CA 3.29Å; L640-T668 PolarHBondContact N-O 3.2Å; L640-T668 PolarHBondContact O-N 2.9Å; L640-T668 PolarHBondContact O-OG1 3.11Å; L640-A670 HydrophobicContact CB-CB 3.67Å; L640-A670 HydrophobicContact CD2-CB 3.75Å; L640-A670 HydrophobicContact CG-CB 4.36Å
641	L	94.4	Very high	92	Very high	82 Å²	82	75.7 Å²	75.7	43%	0.429	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	103.8	161.5	175.5	56	0	0	0	109.1	Y667	L641-Y667 HydrophobicContact CB-CD1 4.05Å; L641-Y667 HydrophobicContact CB-CE1 3.73Å; L641-Y667 HydrophobicContact CD1-CD2 4.5Å; L641-Y667 HydrophobicContact CD1-CE2 4.24Å
642	C	94.4	Very high	91.4	Very high	4 Å²	4	79.2 Å²	79.2	3%	0.027	40%	0.397	C	S	.	.			trans	-91.5	111	-176.8	-173.9	0	0	0	0	111.1	C365 C368 L640 N644 C645 T646 V666 T668	C365-C642 VanDerWaalsContact SG-SG 3.69Å; C368-C642 VanDerWaalsContact SG-SG 3.66Å; L640-C642 PolarHBondContact O-N 3.07Å; L640-C642 VanDerWaalsContact O-N 3.08Å; C642-N644 VanDerWaalsContact C-N 3.29Å; C642-N644 PolarHBondContact O-N 2.82Å; C642-C645 HydrophobicContact CB-CB 3.98Å; C642-C645 PolarHBondContact O-N 3.13Å; C642-C645 VanDerWaalsContact SG-SG 3.7Å; C642-T646 WeakPolarHBondContact O-CB 3.29Å; C642-T646 PolarHBondContact O-N 2.98Å; C642-T646 PolarHBondContact O-OG1 2.81Å; C642-V666 PolarHBondContact N-O 2.84Å; C642-T668 HydrophobicContact CB-CG2 3.84Å
643	E	93.6	Very high	90.6	Very high	130 Å²	130	78.8 Å²	78.8	61%	0.607	39%	0.394	S	S	*	.	H	α-helix	trans	-54.3	-43.5	174	-74.6	-170.1	-143.9	0	0	112.8	T646 K647	E643-T646 PolarHBondContact O-N 3.11Å; E643-K647 HydrophobicContact CB-CD 4.49Å; E643-K647 WeakPolarHBondContact O-CB 3.24Å; E643-K647 WeakPolarHBondContact O-CD 3.42Å; E643-K647 VanDerWaalsContact O-CG 3.26Å; E643-K647 WeakPolarHBondContact O-CG 3.36Å; E643-K647 PolarHBondContact O-N 2.66Å; E643-K647 IonicContact OE2-NZ 3.97Å; E643-K647 PolarHBondContact OE2-NZ 2.98Å
644	N	92.8	Very high	89.6	Confident	55 Å²	55	81.4 Å²	81.4	29%	0.294	41%	0.405	S	S	.	.	H	α-helix	trans	-68.3	-44.1	-174.7	-168.2	48.5	0	0	0	111.5	C368 N370 C642 T646 K647 N648	C368-N644 PolarHBondContact SG-ND2 2.7Å; N370-N644 HydrophobicContact CB-CB 4.25Å; C642-N644 VanDerWaalsContact C-N 3.29Å; C642-N644 PolarHBondContact O-N 2.82Å; N644-T646 VanDerWaalsContact C-N 3.3Å; N644-T646 PolarHBondContact O-N 3.13Å; N644-K647 PolarHBondContact O-N 2.8Å; N644-N648 WeakPolarHBondContact O-CB 3.15Å; N644-N648 PolarHBondContact O-N 3.49Å; N644-N648 PolarHBondContact O-ND2 3.11Å
645	C	93.5	Very high	88.5	Confident	17 Å²	17	86.8 Å²	86.8	12%	0.115	43%	0.429	C	S	.	.	H	α-helix	trans	-63.8	-35.7	172	-63.9	0	0	0	0	112.1	C642 N648 K649 V666 T668	C642-C645 HydrophobicContact CB-CB 3.98Å; C642-C645 PolarHBondContact O-N 3.13Å; C642-C645 VanDerWaalsContact SG-SG 3.7Å; C645-N648 PolarHBondContact O-N 3Å; C645-K649 WeakPolarHBondContact O-CB 3.42Å; C645-K649 PolarHBondContact O-N 3.42Å; C645-V666 HydrophobicContact CB-CB 3.9Å; C645-V666 HydrophobicContact CB-CG1 3.73Å; C645-T668 HydrophobicContact CB-CG2 4.16Å
646	T	92.7	Very high	87.4	Confident	18 Å²	18	87.6 Å²	87.6	11%	0.11	44%	0.439	C	S	.	.	H	α-helix	trans	-66.2	-47.6	176.2	-55.2	0	0	0	0	111.5	C642 E643 N644 N648 K649 Q650 V666	C642-T646 WeakPolarHBondContact O-CB 3.29Å; C642-T646 PolarHBondContact O-N 2.98Å; C642-T646 PolarHBondContact O-OG1 2.81Å; E643-T646 PolarHBondContact O-N 3.11Å; N644-T646 VanDerWaalsContact C-N 3.3Å; N644-T646 PolarHBondContact O-N 3.13Å; T646-N648 VanDerWaalsContact C-N 3.32Å; T646-N648 PolarHBondContact O-N 2.73Å; T646-K649 PolarHBondContact O-N 2.89Å; T646-Q650 WeakPolarHBondContact O-CG 3.44Å; T646-Q650 PolarHBondContact O-N 3.04Å; T646-V666 PolarHBondContact OG1-N 2.98Å
647	K	90.5	Very high	85.9	Confident	100 Å²	100	88 Å²	88	44%	0.435	43%	0.434	S	S	.	.	H	α-helix	trans	-61.8	-36.7	175.8	-72.9	161.6	177.1	169	0	112.2	E643 N644 K651	E643-K647 HydrophobicContact CB-CD 4.49Å; E643-K647 WeakPolarHBondContact O-CB 3.24Å; E643-K647 WeakPolarHBondContact O-CD 3.42Å; E643-K647 VanDerWaalsContact O-CG 3.26Å; E643-K647 WeakPolarHBondContact O-CG 3.36Å; E643-K647 PolarHBondContact O-N 2.66Å; E643-K647 IonicContact OE2-NZ 3.97Å; E643-K647 PolarHBondContact OE2-NZ 2.98Å; N644-K647 PolarHBondContact O-N 2.8Å; K647-K651 WeakPolarHBondContact O-CG 3.41Å; K647-K651 PolarHBondContact O-N 2.93Å
648	N	88.5	Confident	84.4	Confident	63 Å²	63	90.7 Å²	90.7	34%	0.337	44%	0.438	S	S	.	.	H	α-helix	trans	-70.2	-42.6	174.3	-69.7	-12.2	0	0	0	112.1	N644 C645 T646 Q650 K651 Y652	N644-N648 WeakPolarHBondContact O-CB 3.15Å; N644-N648 PolarHBondContact O-N 3.49Å; N644-N648 PolarHBondContact O-ND2 3.11Å; C645-N648 PolarHBondContact O-N 3Å; T646-N648 VanDerWaalsContact C-N 3.32Å; T646-N648 PolarHBondContact O-N 2.73Å; N648-Q650 VanDerWaalsContact C-N 3.32Å; N648-Q650 PolarHBondContact O-N 3.31Å; N648-K651 PolarHBondContact O-N 2.8Å; N648-Y652 WeakPolarHBondContact O-CD2 3.15Å; N648-Y652 PolarHBondContact O-N 3.47Å; N648-Y652 VanDerWaalsContact O-N 3.14Å
649	K	87.4	Confident	83	Confident	67 Å²	67	88.1 Å²	88.1	29%	0.291	43%	0.433	S	S	.	.	H	α-helix	trans	-60.5	-40	174.4	178.2	-177.5	170.6	-167.8	0	111.9	C645 T646 Q653 V663 E664 V666	C645-K649 WeakPolarHBondContact O-CB 3.42Å; C645-K649 PolarHBondContact O-N 3.42Å; T646-K649 PolarHBondContact O-N 2.89Å; K649-Q653 VanDerWaalsContact O-CG 3.3Å; K649-Q653 WeakPolarHBondContact O-CG 3.35Å; K649-Q653 PolarHBondContact O-N 3.47Å; K649-Q653 VanDerWaalsContact O-N 3.13Å; K649-V663 HydrophobicContact CD-CG1 4.37Å; K649-V663 HydrophobicContact CG-CG1 4.48Å; K649-E664 PolarHBondContact NZ-O 2.88Å; K649-V666 HydrophobicContact CB-CG2 3.96Å; K649-V666 HydrophobicContact CD-CG2 3.35Å; K649-V666 HydrophobicContact CG-CG2 4.31Å
650	Q	85.8	Confident	81.4	Confident	66 Å²	66	93.8 Å²	93.8	31%	0.308	46%	0.461	S	S	.	.	H	α-helix	trans	-58.4	-54.4	175.1	-75.2	167.6	-29.9	0	0	111.3	T646 N648 Y652 Q653 E654 V663	T646-Q650 WeakPolarHBondContact O-CG 3.44Å; T646-Q650 PolarHBondContact O-N 3.04Å; N648-Q650 VanDerWaalsContact C-N 3.32Å; N648-Q650 PolarHBondContact O-N 3.31Å; Q650-Y652 PolarHBondContact O-N 2.88Å; Q650-Q653 WeakPolarHBondContact O-CA 3.16Å; Q650-Q653 PolarHBondContact O-N 3.13Å; Q650-E654 WeakPolarHBondContact O-CG 3.39Å; Q650-E654 PolarHBondContact O-N 3.15Å; Q650-V663 HydrophobicContact CG-CB 4.06Å; Q650-V663 HydrophobicContact CG-CG1 3.8Å; Q650-V663 HydrophobicContact CG-CG2 4.14Å
651	K	84.5	Confident	80.1	Confident	118 Å²	118	100.2 Å²	100.2	51%	0.513	49%	0.487	S	S	.	.	H	α-helix	trans	-54.7	-48.3	177.9	-70.2	175.3	179.8	-177.4	0	113.2	K647 N648 Q653 E654 E655	K647-K651 WeakPolarHBondContact O-CG 3.41Å; K647-K651 PolarHBondContact O-N 2.93Å; N648-K651 PolarHBondContact O-N 2.8Å; K651-Q653 PolarHBondContact O-N 3.4Å; K651-E654 PolarHBondContact O-N 3.09Å; K651-E655 WeakPolarHBondContact O-CB 3.31Å; K651-E655 WeakPolarHBondContact O-CG 3.14Å; K651-E655 PolarHBondContact O-N 2.82Å
652	Y	80.2	Confident	78.8	Confident	163 Å²	163	106.4 Å²	106.4	64%	0.639	51%	0.511	S	S	*	.	H	α-helix	trans	-63.2	-26.4	177.5	-76	-57.1	0	0	0	113.4	N648 Q650 T656	N648-Y652 WeakPolarHBondContact O-CD2 3.15Å; N648-Y652 PolarHBondContact O-N 3.47Å; N648-Y652 VanDerWaalsContact O-N 3.14Å; Q650-Y652 PolarHBondContact O-N 2.88Å; Y652-T656 WeakPolarHBondContact O-CB 3.01Å; Y652-T656 WeakPolarHBondContact O-CG2 3.16Å; Y652-T656 PolarHBondContact O-N 3.49Å; Y652-T656 PolarHBondContact O-OG1 2.6Å
653	Q	76.4	Confident	77.6	Confident	77 Å²	77	108.6 Å²	108.6	36%	0.36	52%	0.524	S	S	.	.	H	α-helix	trans	-82.8	-35.3	176.2	-72.3	-178.1	-36.9	0	0	112.4	K649 Q650 K651 T656 S657	K649-Q653 VanDerWaalsContact O-CG 3.3Å; K649-Q653 WeakPolarHBondContact O-CG 3.35Å; K649-Q653 PolarHBondContact O-N 3.47Å; K649-Q653 VanDerWaalsContact O-N 3.13Å; Q650-Q653 WeakPolarHBondContact O-CA 3.16Å; Q650-Q653 PolarHBondContact O-N 3.13Å; K651-Q653 PolarHBondContact O-N 3.4Å; Q653-T656 PolarHBondContact O-N 3.21Å; Q653-S657 PolarHBondContact O-N 3.14Å; Q653-S657 PolarHBondContact O-OG 3.28Å
654	E	74.4	Confident	77.1	Confident	143 Å²	143	109.5 Å²	109.5	67%	0.668	53%	0.528	S	S	*	.	H	α-helix	trans	-63.9	-41	171	-69.8	161.5	-167.3	0	0	111.3	Q650 K651 T656	Q650-E654 WeakPolarHBondContact O-CG 3.39Å; Q650-E654 PolarHBondContact O-N 3.15Å; K651-E654 PolarHBondContact O-N 3.09Å; E654-T656 VanDerWaalsContact C-N 3.25Å; E654-T656 PolarHBondContact O-N 3.1Å
655	E	71.8	Confident	76.9	Confident	146 Å²	146	108 Å²	108	68%	0.682	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	-16	175.9	-72.9	174	-174.8	0	0	113.9	K651	K651-E655 WeakPolarHBondContact O-CB 3.31Å; K651-E655 WeakPolarHBondContact O-CG 3.14Å; K651-E655 PolarHBondContact O-N 2.82Å
656	T	68.7	Low	76.9	Confident	115 Å²	115	108.8 Å²	108.8	71%	0.706	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.5	-7.8	-172.8	58.6	0	0	0	0	115.8	Y652 Q653 E654	Y652-T656 WeakPolarHBondContact O-CB 3.01Å; Y652-T656 WeakPolarHBondContact O-CG2 3.16Å; Y652-T656 PolarHBondContact O-N 3.49Å; Y652-T656 PolarHBondContact O-OG1 2.6Å; Q653-T656 PolarHBondContact O-N 3.21Å; E654-T656 VanDerWaalsContact C-N 3.25Å; E654-T656 PolarHBondContact O-N 3.1Å
657	S	62.6	Low	77	Confident	58 Å²	58	114.5 Å²	114.5	41%	0.406	55%	0.55	S	S	.	.			trans	-153.2	130.6	-177.2	63.4	0	0	0	0	115.4	Q653 A659	Q653-S657 PolarHBondContact O-N 3.14Å; Q653-S657 PolarHBondContact O-OG 3.28Å; S657-A659 VanDerWaalsContact C-N 3.26Å; S657-A659 PolarHBondContact O-N 3.28Å
658	F	60	Low	77.2	Confident	228 Å²	228	109.9 Å²	109.9	100%	1	53%	0.53	S	S	*	.			trans	-83.5	20.2	177.2	-79	-85.3	0	0	0	114.4
659	A	62.2	Low	77.6	Confident	65 Å²	65	108.7 Å²	108.7	54%	0.537	52%	0.524	S	S	.	.	S	Bend	trans	-119.2	120.7	-170.7	0	0	0	0	0	112.1	S657 K661	S657-A659 VanDerWaalsContact C-N 3.26Å; S657-A659 PolarHBondContact O-N 3.28Å; A659-K661 VanDerWaalsContact C-N 3.27Å; A659-K661 PolarHBondContact O-N 2.8Å
660	E	59.7	Low	78	Confident	206 Å²	206	105.5 Å²	105.5	96%	0.963	51%	0.51	S	S	*	.			trans	-67.8	73.2	-179.4	-62.7	-175.6	158.9	0	0	113.1
661	K	67.3	Low	78.5	Confident	183 Å²	183	107.4 Å²	107.4	80%	0.796	51%	0.514	S	S	*	.			trans	-87.4	125.3	165.7	-80.6	-174.4	173.8	179.4	0	109.9	A659 V663	A659-K661 VanDerWaalsContact C-N 3.27Å; A659-K661 PolarHBondContact O-N 2.8Å; K661-V663 WeakPolarHBondContact O-CG2 3.15Å; K661-V663 PolarHBondContact O-N 2.74Å
662	K	67.5	Low	79	Confident	213 Å²	213	104 Å²	104	93%	0.926	50%	0.499	S	S	*	.			trans	-54.5	106.7	172.5	-173.8	179.5	-177.2	-178.4	0	109.8	E664	K662-E664 PolarHBondContact O-N 2.78Å
663	V	69.6	Low	79.7	Confident	50 Å²	50	97.2 Å²	97.2	30%	0.303	47%	0.473	S	S	.	.	P	Polyproline II helix	trans	-71.7	116.4	-172.4	-176.3	0	0	0	0	110.7	K649 Q650 K661	K649-V663 HydrophobicContact CD-CG1 4.37Å; K649-V663 HydrophobicContact CG-CG1 4.48Å; Q650-V663 HydrophobicContact CG-CB 4.06Å; Q650-V663 HydrophobicContact CG-CG1 3.8Å; Q650-V663 HydrophobicContact CG-CG2 4.14Å; K661-V663 WeakPolarHBondContact O-CG2 3.15Å; K661-V663 PolarHBondContact O-N 2.74Å
664	E	83.5	Confident	80.6	Confident	148 Å²	148	95 Å²	95	69%	0.692	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-71.7	134.1	175.1	-174.2	176.3	-142.6	0	0	111.5	K649 K662	K649-E664 PolarHBondContact NZ-O 2.88Å; K662-E664 PolarHBondContact O-N 2.78Å
665	G	88.9	Confident	81.6	Confident	23 Å²	23	88.5 Å²	88.5	24%	0.237	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-61.6	147.9	-177.3	0	0	0	0	0	113.8	Y667	G665-Y667 WeakPolarHBondContact O-CD2 3.39Å
666	V	92.9	Very high	82.8	Confident	34 Å²	34	81.5 Å²	81.5	21%	0.206	40%	0.401	C	S	.	.			trans	-94	106.4	-175.2	-175.3	0	0	0	0	110.8	C642 C645 T646 K649 T668	C642-V666 PolarHBondContact N-O 2.84Å; C645-V666 HydrophobicContact CB-CB 3.9Å; C645-V666 HydrophobicContact CB-CG1 3.73Å; T646-V666 PolarHBondContact OG1-N 2.98Å; K649-V666 HydrophobicContact CB-CG2 3.96Å; K649-V666 HydrophobicContact CD-CG2 3.35Å; K649-V666 HydrophobicContact CG-CG2 4.31Å; V666-T668 HydrophobicContact CG1-CG2 3.92Å
667	Y	94.8	Very high	84	Confident	138 Å²	138	76 Å²	76	54%	0.541	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	113.8	175.8	-69	-90.7	0	0	0	111.1	L640 L641 G665	L640-Y667 CarbonylContact O-C 3.57Å; L640-Y667 WeakPolarHBondContact O-CA 3.29Å; L641-Y667 HydrophobicContact CB-CD1 4.05Å; L641-Y667 HydrophobicContact CB-CE1 3.73Å; L641-Y667 HydrophobicContact CD1-CD2 4.5Å; L641-Y667 HydrophobicContact CD1-CE2 4.24Å; G665-Y667 WeakPolarHBondContact O-CD2 3.39Å
668	T	94.8	Very high	85.4	Confident	3 Å²	3	73.9 Å²	73.9	2%	0.018	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	155.7	-173.8	60	0	0	0	0	111.6	C365 E367 K639 L640 C642 C645 V666	C365-T668 PolarHBondContact SG-OG1 2.92Å; E367-T668 HydrophobicContact CB-CG2 4.2Å; E367-T668 HydrophobicContact CG-CG2 3.56Å; K639-T668 WeakPolarHBondContact CB-O 3.45Å; L640-T668 PolarHBondContact N-O 3.2Å; L640-T668 PolarHBondContact O-N 2.9Å; L640-T668 PolarHBondContact O-OG1 3.11Å; C642-T668 HydrophobicContact CB-CG2 3.84Å; C645-T668 HydrophobicContact CB-CG2 4.16Å; V666-T668 HydrophobicContact CG1-CG2 3.92Å
669	N	96.6	Very high	87	Confident	39 Å²	39	63.3 Å²	63.3	21%	0.209	31%	0.308	C	S	.	.			trans	-63.8	149.1	161.5	-72.2	4.3	0	0	0	110	E366 L634 K639	E366-N669 HydrophobicContact CB-CB 4.36Å; E366-N669 HydrophobicContact CG-CB 4.34Å; E366-N669 PolarHBondContact N-O 3.38Å; E366-N669 VanDerWaalsContact OE2-CB 3.31Å; E366-N669 WeakPolarHBondContact OE2-CB 3.2Å; L634-N669 WeakPolarHBondContact O-CA 3.37Å; K639-N669 VanDerWaalsContact CE-OD1 3.27Å; K639-N669 WeakPolarHBondContact CE-OD1 3.45Å
670	A	96.1	Very high	88.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.2	177.8	0	0	0	0	0	112.3	V363 M364 L634 L640	V363-A670 HydrophobicContact CG1-CB 4.04Å; M364-A670 CarbonylContact O-C 3.46Å; M364-A670 WeakPolarHBondContact O-CA 3.49Å; M364-A670 VanDerWaalsContact O-CB 3.31Å; M364-A670 WeakPolarHBondContact O-CB 3.41Å; L634-A670 HydrophobicContact CB-CB 4.23Å; L634-A670 WeakPolarHBondContact CB-O 3.49Å; L634-A670 HydrophobicContact CD1-CB 4.23Å; L634-A670 PolarHBondContact N-O 2.7Å; L634-A670 PolarHBondContact O-N 2.94Å; L640-A670 HydrophobicContact CB-CB 3.67Å; L640-A670 HydrophobicContact CD2-CB 3.75Å; L640-A670 HydrophobicContact CG-CB 4.36Å
671	R	95.9	Very high	90.2	Very high	105 Å²	105	52.2 Å²	52.2	40%	0.396	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	132	171.1	-63.7	178.6	-164.8	-165.7	1.5	109.3	V363 M364 E366 F605 M631 E632 L633	V363-R671 CarbonylContact C-O 3.45Å; V363-R671 VanDerWaalsContact CA-O 3.3Å; V363-R671 WeakPolarHBondContact CA-O 3.34Å; M364-R671 PolarHBondContact N-O 3.21Å; M364-R671 PolarHBondContact O-N 3.39Å; E366-R671 HydrophobicContact CG-CG 4.37Å; E366-R671 IonicContact OE1-CZ 3.8Å; E366-R671 IonicContact OE1-NE 2.74Å; E366-R671 PolarHBondContact OE1-NE 3.46Å; E366-R671 IonicContact OE1-NH2 3.49Å; E366-R671 PolarHBondContact OE1-NH2 3.2Å; F605-R671 HydrophobicContact CE2-CB 4.27Å; F605-R671 HydrophobicContact CZ-CB 3.93Å; M631-R671 HydrophobicContact CG-CB 4.34Å; M631-R671 HydrophobicContact SD-CB 4.1Å; M631-R671 HydrophobicContact SD-CG 4.22Å; E632-R671 WeakPolarHBondContact O-CA 3.33Å; L633-R671 HydrophobicContact CD1-CG 3.73Å
672	K	94.9	Very high	91.6	Very high	46 Å²	46	43.5 Å²	43.5	20%	0.2	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.2	177.5	170.5	174.3	166.9	-71.2	0	109.6	T362 V363 M631 E632 L634 L674	T362-K672 CarbonylContact O-C 3.48Å; T362-K672 VanDerWaalsContact O-CA 3.32Å; T362-K672 WeakPolarHBondContact O-CA 3.48Å; V363-K672 HydrophobicContact CG2-CB 4.2Å; V363-K672 HydrophobicContact CG2-CD 4.44Å; V363-K672 HydrophobicContact CG2-CG 4.14Å; M631-K672 CarbonylContact C-O 3.58Å; M631-K672 WeakPolarHBondContact CA-O 3.45Å; E632-K672 HydrophobicContact CB-CB 4.38Å; E632-K672 PolarHBondContact N-O 2.86Å; E632-K672 PolarHBondContact O-N 3.41Å; E632-K672 IonicContact OE1-NZ 3.24Å; E632-K672 WeakPolarHBondContact OE2-CD 3.38Å; E632-K672 IonicContact OE2-NZ 3.7Å; E632-K672 PolarHBondContact OE2-NZ 2.73Å; L634-K672 HydrophobicContact CD1-CB 4Å; L634-K672 HydrophobicContact CD1-CD 4.36Å; L634-K672 HydrophobicContact CD2-CD 4.48Å; L634-K672 HydrophobicContact CG-CB 4.14Å; K672-L674 VanDerWaalsContact NZ-CD1 3.35Å
673	Q	95.3	Very high	93	Very high	21 Å²	21	33.3 Å²	33.3	10%	0.098	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	142.7	171.4	-164.4	-179.3	12.8	0	0	110	T362 F605 T629 L675	T362-Q673 PolarHBondContact N-O 3.29Å; T362-Q673 PolarHBondContact O-N 2.78Å; F605-Q673 HydrophobicContact CD1-CB 3.71Å; F605-Q673 HydrophobicContact CE1-CB 3.95Å; T629-Q673 WeakPolarHBondContact O-CG 3.3Å; T629-Q673 PolarHBondContact O-NE2 2.99Å; Q673-L675 HydrophobicContact CG-CG 4.23Å
674	L	95.8	Very high	94.4	Very high	32 Å²	32	31 Å²	31	17%	0.168	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	133.7	165.5	-68.4	93.6	0	0	0	109.6	L359 T360 T629 K672	L359-L674 HydrophobicContact CD1-CD2 4.31Å; T360-L674 WeakPolarHBondContact O-CA 3.25Å; T629-L674 VanDerWaalsContact CA-O 3.26Å; T629-L674 WeakPolarHBondContact CA-O 3.44Å; T629-L674 WeakPolarHBondContact CB-O 3.45Å; T629-L674 WeakPolarHBondContact CG2-O 3.25Å; K672-L674 VanDerWaalsContact NZ-CD1 3.35Å
675	L	95.8	Very high	95.1	Very high	5 Å²	5	23.9 Å²	23.9	3%	0.026	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	149	175.5	-71.8	173.5	0	0	0	110.3	L359 T360 T607 Q673 S677	L359-L675 CarbonylContact C-O 3.44Å; L359-L675 WeakPolarHBondContact CA-O 3.18Å; T360-L675 PolarHBondContact N-O 2.88Å; T360-L675 PolarHBondContact O-N 3.15Å; T607-L675 HydrophobicContact CG2-CD1 4.35Å; T607-L675 HydrophobicContact CG2-CD2 3.81Å; Q673-L675 HydrophobicContact CG-CG 4.23Å; L675-S677 PolarHBondContact O-N 2.9Å
676	I	95.6	Very high	95.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.113	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	119.6	178.3	-55.7	169.2	0	0	0	109.1	L359 F378 I381 A678 V679 L712 F715 C716 S717	L359-I676 HydrophobicContact CD2-CG1 3.82Å; F378-I676 HydrophobicContact CE1-CG2 4.29Å; F378-I676 HydrophobicContact CZ-CG2 4.28Å; I381-I676 HydrophobicContact CD1-CD1 3.63Å; I381-I676 HydrophobicContact CD1-CG1 4.14Å; I676-A678 WeakPolarHBondContact CG2-O 3.39Å; I676-V679 HydrophobicContact CG2-CG1 3.73Å; I676-L712 HydrophobicContact CD1-CD1 3.91Å; I676-L712 HydrophobicContact CD1-CD2 3.89Å; I676-L712 HydrophobicContact CD1-CG 3.92Å; I676-F715 HydrophobicContact CD1-CB 4.42Å; I676-F715 PolarHBondContact N-O 3.33Å; I676-C716 CarbonylContact O-C 3.59Å; I676-C716 WeakPolarHBondContact O-CA 3.46Å; I676-S717 PolarHBondContact O-N 3.34Å
677	S	93.9	Very high	95.8	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	-6.9	-175.7	71.9	0	0	0	0	114.5	E358 T360 K375 L675 C720 K721	E358-S677 CarbonylContact O-C 3.54Å; E358-S677 WeakPolarHBondContact O-CA 3.42Å; E358-S677 PolarHBondContact O-N 2.96Å; E358-S677 PolarHBondContact O-OG 3.42Å; E358-S677 VanDerWaalsContact O-OG 3.13Å; E358-S677 PolarHBondContact OE1-OG 2.94Å; T360-S677 WeakPolarHBondContact OG1-CB 3.48Å; T360-S677 PolarHBondContact OG1-OG 2.86Å; K375-S677 PolarHBondContact NZ-OG 2.85Å; L675-S677 PolarHBondContact O-N 2.9Å; S677-C720 VanDerWaalsContact C-SG 3.55Å; S677-C720 CarbonylContact O-C 3.59Å; S677-C720 WeakPolarHBondContact O-CA 3.32Å; S677-K721 PolarHBondContact O-N 2.85Å
678	A	93.2	Very high	95.8	Very high	13 Å²	13	19.9 Å²	19.9	11%	0.107	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	134.5	156.4	0	0	0	0	0	109.1	G357 E358 I676 K721	G357-A678 VanDerWaalsContact CA-O 3.29Å; G357-A678 WeakPolarHBondContact CA-O 3.29Å; E358-A678 HydrophobicContact CB-CB 3.54Å; E358-A678 PolarHBondContact N-O 3.25Å; E358-A678 PolarHBondContact O-N 3.49Å; I676-A678 WeakPolarHBondContact CG2-O 3.39Å; A678-K721 HydrophobicContact CB-CB 4.03Å; A678-K721 HydrophobicContact CB-CD 4.07Å
679	V	93.1	Very high	95.7	Very high	6 Å²	6	19.8 Å²	19.8	4%	0.036	10%	0.096	C	C	.	.			trans	-100.8	132.5	-178.8	-60.7	0	0	0	0	111	I676 L712 C716 V729 Y731	I676-V679 HydrophobicContact CG2-CG1 3.73Å; V679-L712 HydrophobicContact CB-CD2 4.41Å; V679-L712 HydrophobicContact CG1-CD2 3.81Å; V679-C716 VanDerWaalsContact CG1-SG 3.56Å; V679-V729 HydrophobicContact CG1-CG1 4.31Å; V679-V729 HydrophobicContact CG2-CG1 4.15Å; V679-Y731 WeakPolarHBondContact CB-OH 3.27Å
680	P	94.6	Very high	95.3	Very high	4 Å²	4	20.3 Å²	20.3	3%	0.026	10%	0.097	C	C	.	.			trans	-75.8	163.1	-178.3	32.1	-36.5	0	0	0	112.1	F378 V682 L683 Y731	F378-P680 HydrophobicContact CE2-CG 4.44Å; P680-V682 VanDerWaalsContact C-N 3.3Å; P680-V682 WeakPolarHBondContact CB-O 3.32Å; P680-V682 WeakPolarHBondContact CG-O 3.48Å; P680-L683 HydrophobicContact CG-CB 4.2Å; P680-L683 HydrophobicContact CG-CD1 4.28Å; P680-Y731 PolarHBondContact O-OH 3.48Å
681	A	93.9	Very high	94.7	Very high	33 Å²	33	23.4 Å²	23.4	27%	0.273	11%	0.111	S	C	.	.	S	Bend	trans	-67.7	-34.4	171.9	0	0	0	0	0	111.7	I354 R813	I354-A681 PolarHBondContact O-N 3.35Å; A681-R813 WeakPolarHBondContact O-CB 3.46Å; A681-R813 PolarHBondContact O-N 2.91Å
682	V	96.4	Very high	93.9	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	115.4	172.6	176.1	0	0	0	0	108.7	T212 I354 F355 P680 I684 Y734 Y811 E812	T212-V682 HydrophobicContact CG2-CG2 3.72Å; I354-V682 HydrophobicContact CG2-CB 3.98Å; I354-V682 HydrophobicContact CG2-CG2 3.62Å; I354-V682 PolarHBondContact O-N 2.9Å; F355-V682 HydrophobicContact CD1-CB 3.92Å; F355-V682 HydrophobicContact CD1-CG1 3.9Å; F355-V682 HydrophobicContact CE1-CB 4.01Å; F355-V682 HydrophobicContact CE1-CG1 3.77Å; F355-V682 HydrophobicContact CE1-CG2 4.47Å; P680-V682 VanDerWaalsContact C-N 3.3Å; P680-V682 WeakPolarHBondContact CB-O 3.32Å; P680-V682 WeakPolarHBondContact CG-O 3.48Å; V682-I684 HydrophobicContact CG1-CG1 4.24Å; V682-Y734 HydrophobicContact CG1-CE1 4.29Å; V682-Y734 VanDerWaalsContact CG1-OH 3.27Å; V682-Y734 WeakPolarHBondContact CG1-OH 3.35Å; V682-Y811 CarbonylContact C-O 3.55Å; V682-Y811 VanDerWaalsContact CA-O 3.32Å; V682-Y811 WeakPolarHBondContact CA-O 3.46Å; V682-E812 HydrophobicContact CG2-CG 4.36Å
683	L	97.7	Very high	92.9	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	125.9	173	176.1	67	0	0	0	109.2	F378 I381 P680 L685 L710 L712 Y731 Y811	F378-L683 HydrophobicContact CE2-CD1 4.12Å; I381-L683 HydrophobicContact CD1-CD1 4.25Å; I381-L683 HydrophobicContact CG1-CD1 4.44Å; P680-L683 HydrophobicContact CG-CB 4.2Å; P680-L683 HydrophobicContact CG-CD1 4.28Å; L683-L685 HydrophobicContact CD1-CD2 3.95Å; L683-L685 HydrophobicContact CD2-CD1 4.37Å; L683-L685 HydrophobicContact CD2-CD2 4.07Å; L683-L685 HydrophobicContact CD2-CG 4.23Å; L683-L685 HydrophobicContact CG-CD2 3.96Å; L683-L685 HydrophobicContact CG-CG 4.13Å; L683-L710 HydrophobicContact CD2-CD2 4.14Å; L683-L712 HydrophobicContact CD2-CD1 3.87Å; L683-L712 HydrophobicContact CD2-CD2 4.09Å; L683-Y731 HydrophobicContact CB-CD1 3.92Å; L683-Y731 HydrophobicContact CB-CE1 3.71Å; L683-Y811 PolarHBondContact N-O 3.3Å; L683-Y811 PolarHBondContact O-N 3.25Å
684	I	98.6	Very high	92.2	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	130.4	171.3	-52.9	-177.5	0	0	0	108.1	L299 F355 D380 I381 V682 L809 F810	L299-I684 HydrophobicContact CD1-CD1 4.42Å; L299-I684 HydrophobicContact CD2-CD1 3.85Å; L299-I684 HydrophobicContact CD2-CG2 4.06Å; F355-I684 HydrophobicContact CD1-CD1 3.79Å; F355-I684 HydrophobicContact CD1-CG1 4.37Å; F355-I684 HydrophobicContact CE1-CD1 4.09Å; D380-I684 CarbonylContact C-O 3.53Å; D380-I684 WeakPolarHBondContact CA-O 3.28Å; D380-I684 HydrophobicContact CB-CB 3.9Å; D380-I684 HydrophobicContact CB-CG2 3.89Å; D380-I684 WeakPolarHBondContact CB-O 3.4Å; I381-I684 PolarHBondContact N-O 3.4Å; V682-I684 HydrophobicContact CG1-CG1 4.24Å; I684-L809 WeakPolarHBondContact CA-O 3.33Å; I684-F810 HydrophobicContact CD1-CD1 3.99Å; I684-F810 HydrophobicContact CD1-CE1 3.59Å; I684-F810 HydrophobicContact CD1-CZ 4.34Å; I684-F810 HydrophobicContact CG1-CD1 3.98Å; I684-F810 HydrophobicContact CG1-CE1 4.06Å; I684-F810 HydrophobicContact CG2-CZ 4.5Å
685	L	98.6	Very high	91.3	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	122	174.9	-58.3	177.8	0	0	0	109.2	I381 L383 V621 L683 L710 L808 L809 Y811	I381-L685 HydrophobicContact CB-CD2 3.83Å; I381-L685 HydrophobicContact CD1-CD2 4.45Å; I381-L685 HydrophobicContact CG1-CD2 4.34Å; L383-L685 HydrophobicContact CD1-CB 4.41Å; L383-L685 HydrophobicContact CD1-CD1 4.31Å; L383-L685 HydrophobicContact CD1-CD2 4.3Å; V621-L685 HydrophobicContact CG1-CD1 3.55Å; L683-L685 HydrophobicContact CD1-CD2 3.95Å; L683-L685 HydrophobicContact CD2-CD1 4.37Å; L683-L685 HydrophobicContact CD2-CD2 4.07Å; L683-L685 HydrophobicContact CD2-CG 4.23Å; L683-L685 HydrophobicContact CG-CD2 3.96Å; L683-L685 HydrophobicContact CG-CG 4.13Å; L685-L710 HydrophobicContact CD1-CD2 4.04Å; L685-L808 CarbonylContact O-C 3.59Å; L685-L808 WeakPolarHBondContact O-CA 3.38Å; L685-L809 HydrophobicContact CB-CB 4.36Å; L685-L809 PolarHBondContact N-O 2.66Å; L685-L809 PolarHBondContact O-N 3.46Å; L685-Y811 HydrophobicContact CD1-CD2 4.24Å; L685-Y811 HydrophobicContact CD1-CE2 4Å
686	H	98.3	Very high	90.3	Very high	13 Å²	13	36.5 Å²	36.5	6%	0.06	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.9	169.1	159.8	-139.7	0	0	0	108.9	Q296 D380 I381 S382 L383 Y807 L808	Q296-H686 VanDerWaalsContact CD-ND1 3.3Å; Q296-H686 HydrophobicContact CG-CB 4.47Å; Q296-H686 PolarHBondContact NE2-ND1 3.49Å; Q296-H686 PolarHBondContact OE1-CE1 3.49Å; Q296-H686 PolarHBondContact OE1-ND1 3.12Å; D380-H686 WeakPolarHBondContact OD2-CB 3.27Å; I381-H686 PolarHBondContact O-N 2.96Å; S382-H686 CarbonylContact C-O 3.57Å; S382-H686 WeakPolarHBondContact CA-O 3.48Å; S382-H686 WeakPolarHBondContact CB-ND1 3.48Å; S382-H686 PolarHBondContact OG-ND1 3.49Å; L383-H686 PolarHBondContact N-O 3.29Å; H686-Y807 AromaticContact CD2-CE2 3.41Å; H686-Y807 VanDerWaalsContact CD2-CE2 3.41Å; H686-Y807 WeakPolarHBondContact CD2-CE2 3.32Å; H686-Y807 AromaticContact CD2-CZ 3.52Å; H686-Y807 PolarHBondContact CD2-OH 3.34Å; H686-Y807 AromaticContact NE2-CE2 3.21Å; H686-Y807 WeakPolarHBondContact NE2-CE2 3.38Å; H686-Y807 AromaticContact NE2-CZ 3.41Å; H686-Y807 PolarHBondContact NE2-OH 3Å; H686-L808 HydrophobicContact CB-CD2 3.65Å
687	L	97.4	Very high	89.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	112.6	171.7	-62.9	-178.2	0	0	0	108.8	L383 I385 V621 R689 V704 A806 Y807 L809	L383-L687 HydrophobicContact CB-CD2 4.18Å; L383-L687 HydrophobicContact CD1-CD2 4.14Å; I385-L687 HydrophobicContact CD1-CB 4.04Å; I385-L687 HydrophobicContact CG1-CB 4.34Å; V621-L687 HydrophobicContact CG2-CD2 4.43Å; L687-R689 PolarHBondContact O-N 3.32Å; L687-V704 HydrophobicContact CD1-CB 3.84Å; L687-V704 HydrophobicContact CD1-CG1 3.9Å; L687-V704 HydrophobicContact CD1-CG2 4.16Å; L687-V704 HydrophobicContact CD2-CG1 4.36Å; L687-A806 HydrophobicContact CD1-CB 4.45Å; L687-Y807 PolarHBondContact N-O 2.89Å; L687-L809 HydrophobicContact CD1-CD1 4.28Å
688	K	94.8	Very high	89.1	Confident	98 Å²	98	45.9 Å²	45.9	43%	0.426	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.3	76.5	-177.8	-71.2	176	169.4	163.7	0	111.7	S382 L383 F690	S382-K688 WeakPolarHBondContact O-CE 3.15Å; S382-K688 PolarHBondContact O-NZ 3.38Å; S382-K688 VanDerWaalsContact O-NZ 3.12Å; L383-K688 VanDerWaalsContact O-CB 3.27Å; L383-K688 WeakPolarHBondContact O-CB 3.47Å; L383-K688 WeakPolarHBondContact O-CG 3.49Å; L383-K688 PolarHBondContact O-N 2.91Å; K688-F690 VanDerWaalsContact C-N 3.33Å
689	R	93.3	Very high	89	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	25%	0.253	C	S	.	.			trans	-76.6	-19.7	178.8	-72.1	-169.5	-178.4	-70.3	-9.5	113.2	I385 L687 K699 V700 R702 A806 Y807	I385-R689 HydrophobicContact CD1-CB 4.4Å; I385-R689 HydrophobicContact CD1-CG 3.56Å; L687-R689 PolarHBondContact O-N 3.32Å; R689-K699 HydrophobicContact CB-CG 4.41Å; R689-K699 CarbonylContact O-C 3.59Å; R689-K699 VanDerWaalsContact O-CA 3.25Å; R689-K699 WeakPolarHBondContact O-CA 3.4Å; R689-V700 PolarHBondContact NH1-O 3.12Å; R689-V700 PolarHBondContact O-N 3.12Å; R689-R702 PolarHBondContact NH1-O 2.81Å; R689-A806 VanDerWaalsContact CZ-O 3.24Å; R689-A806 PolarHBondContact NE-O 3.42Å; R689-A806 PolarHBondContact NH2-O 3.2Å; R689-Y807 HydrophobicContact CB-CD2 4.38Å; R689-Y807 HydrophobicContact CG-CD2 4.46Å
690	F	88.6	Confident	88.9	Confident	51 Å²	51	46.1 Å²	46.1	22%	0.224	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	121.5	-175.9	-55.7	-49.3	0	0	0	109.4	D294 K688 K699 H739 M743 Y807	D294-F690 WeakPolarHBondContact OD2-CE2 3.29Å; K688-F690 VanDerWaalsContact C-N 3.33Å; F690-K699 HydrophobicContact CD1-CB 4.24Å; F690-K699 HydrophobicContact CD1-CG 4.01Å; F690-K699 HydrophobicContact CE1-CB 4.41Å; F690-K699 HydrophobicContact CE1-CD 4.08Å; F690-K699 HydrophobicContact CE1-CG 3.89Å; F690-H739 AromaticContact CE1-ND1 3.82Å; F690-H739 AromaticContact CZ-CE1 3.77Å; F690-H739 AromaticContact CZ-ND1 3.42Å; F690-H739 WeakPolarHBondContact CZ-ND1 3.26Å; F690-M743 HydrophobicContact CB-CE 3.97Å; F690-M743 HydrophobicContact CB-SD 3.59Å; F690-M743 VanDerWaalsContact CB-SD 3.59Å; F690-M743 HydrophobicContact CD1-SD 3.35Å; F690-M743 WeakPolarHBondContact CD1-SD 3.34Å; F690-M743 HydrophobicContact CE1-SD 4.27Å; F690-M743 HydrophobicContact CG-SD 3.79Å; F690-Y807 AromaticContact CD2-CE2 3.96Å; F690-Y807 HydrophobicContact CD2-CE2 3.96Å; F690-Y807 HydrophobicContact CE2-CD2 4.33Å; F690-Y807 AromaticContact CE2-CE2 3.67Å; F690-Y807 HydrophobicContact CE2-CE2 3.67Å; F690-Y807 AromaticContact CE2-CZ 3.96Å; F690-Y807 HydrophobicContact CZ-CE2 4.5Å
691	H	82.6	Confident	88.6	Confident	65 Å²	65	49.9 Å²	49.9	30%	0.301	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	159.4	173.4	84.7	91.6	0	0	0	113.1	E387 R698	E387-H691 IonicContact OE2-NE2 2.73Å; H691-R698 PolarHBondContact CE1-NE 3.18Å; H691-R698 PolarHBondContact CE1-NH2 2.96Å; H691-R698 PolarHBondContact N-O 3.03Å; H691-R698 VanDerWaalsContact N-O 3.1Å; H691-R698 VanDerWaalsContact NE2-CZ 3.34Å; H691-R698 PolarHBondContact NE2-NE 3.48Å; H691-R698 PolarHBondContact NE2-NH2 3.07Å; H691-R698 PolarHBondContact O-N 3.32Å
692	Q	79.8	Confident	88.5	Confident	130 Å²	130	52 Å²	52	61%	0.607	27%	0.273	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	146.4	174.2	-172.4	165	-15	0	0	110.7	G694 S696 L697	Q692-G694 WeakPolarHBondContact CG-O 3.28Å; Q692-G694 PolarHBondContact NE2-O 3.05Å; Q692-S696 CarbonylContact C-O 3.58Å; Q692-S696 WeakPolarHBondContact CA-O 3.29Å; Q692-L697 HydrophobicContact CB-CD2 3.86Å; Q692-L697 HydrophobicContact CG-CD2 3.99Å
693	A	74.3	Confident	88.4	Confident	38 Å²	38	55.1 Å²	55.1	31%	0.314	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	92.4	175.6	0	0	0	0	0	108.3	L695 S696 R698	A693-L695 PolarHBondContact O-N 3.35Å; A693-S696 PolarHBondContact N-O 3.2Å; A693-S696 PolarHBondContact O-N 3.23Å; A693-R698 VanDerWaalsContact CB-NH1 3.34Å
694	G	79.3	Confident	88.3	Confident	61 Å²	61	55.1 Å²	55.1	63%	0.629	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.1	-124.8	-166.9	0	0	0	0	0	110.7	Q692 S696	Q692-G694 WeakPolarHBondContact CG-O 3.28Å; Q692-G694 PolarHBondContact NE2-O 3.05Å; G694-S696 VanDerWaalsContact C-N 3.31Å
695	L	78.3	Confident	88.2	Confident	183 Å²	183	59.4 Å²	59.4	96%	0.958	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-3.3	176	-59	176.9	0	0	0	114	A693	A693-L695 PolarHBondContact O-N 3.35Å
696	S	74.4	Confident	88.2	Confident	71 Å²	71	60 Å²	60	50%	0.497	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.9	-175.7	-167.2	0	0	0	0	112.1	Q692 A693 G694	Q692-S696 CarbonylContact C-O 3.58Å; Q692-S696 WeakPolarHBondContact CA-O 3.29Å; A693-S696 PolarHBondContact N-O 3.2Å; A693-S696 PolarHBondContact O-N 3.23Å; G694-S696 VanDerWaalsContact C-N 3.31Å
697	L	80.1	Confident	88	Confident	91 Å²	91	60.8 Å²	60.8	48%	0.476	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	120.2	169.5	-67.8	179.2	0	0	0	109.2	Q692 M743	Q692-L697 HydrophobicContact CB-CD2 3.86Å; Q692-L697 HydrophobicContact CG-CD2 3.99Å; L697-M743 HydrophobicContact CB-CE 3.79Å; L697-M743 HydrophobicContact CB-CG 4.18Å; L697-M743 HydrophobicContact CD1-CE 4.39Å; L697-M743 HydrophobicContact CD2-CE 4.07Å; L697-M743 HydrophobicContact CG-CE 4.3Å
698	R	84.5	Confident	87.9	Confident	106 Å²	106	63.2 Å²	63.2	40%	0.4	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	149.6	-178.1	77.8	178	-169.7	-121.9	4.4	113.9	E387 H691 A693	E387-R698 IonicContact OE2-CZ 2.65Å; E387-R698 VanDerWaalsContact OE2-CZ 3.3Å; E387-R698 IonicContact OE2-NE 3.44Å; E387-R698 PolarHBondContact OE2-NE 3.22Å; E387-R698 VanDerWaalsContact OE2-NE 3.14Å; E387-R698 IonicContact OE2-NH2 3.57Å; E387-R698 PolarHBondContact OE2-NH2 2.86Å; H691-R698 PolarHBondContact CE1-NE 3.18Å; H691-R698 PolarHBondContact CE1-NH2 2.96Å; H691-R698 PolarHBondContact N-O 3.03Å; H691-R698 VanDerWaalsContact N-O 3.1Å; H691-R698 VanDerWaalsContact NE2-CZ 3.34Å; H691-R698 PolarHBondContact NE2-NE 3.48Å; H691-R698 PolarHBondContact NE2-NH2 3.07Å; H691-R698 PolarHBondContact O-N 3.32Å; A693-R698 VanDerWaalsContact CB-NH1 3.34Å
699	K	90.6	Very high	88	Confident	22 Å²	22	63 Å²	63	10%	0.096	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	124.2	173.6	-175.8	-169.3	173.6	-149.2	0	110.7	R689 F690 N701 H739 G741	R689-K699 HydrophobicContact CB-CG 4.41Å; R689-K699 CarbonylContact O-C 3.59Å; R689-K699 VanDerWaalsContact O-CA 3.25Å; R689-K699 WeakPolarHBondContact O-CA 3.4Å; F690-K699 HydrophobicContact CD1-CB 4.24Å; F690-K699 HydrophobicContact CD1-CG 4.01Å; F690-K699 HydrophobicContact CE1-CB 4.41Å; F690-K699 HydrophobicContact CE1-CD 4.08Å; F690-K699 HydrophobicContact CE1-CG 3.89Å; K699-N701 VanDerWaalsContact CD-OD1 3.29Å; K699-N701 WeakPolarHBondContact CD-OD1 3.39Å; K699-N701 WeakPolarHBondContact CE-OD1 3.47Å; K699-N701 PolarHBondContact NZ-OD1 3.34Å; K699-N701 PolarHBondContact O-N 2.94Å; K699-N701 VanDerWaalsContact O-N 3.17Å; K699-N701 PolarHBondContact O-ND2 3.46Å; K699-H739 PolarHBondContact NZ-O 2.72Å; K699-G741 WeakPolarHBondContact CD-O 3.45Å; K699-G741 PolarHBondContact NZ-O 2.91Å
700	V	90.3	Very high	88.1	Confident	2 Å²	2	63 Å²	63	1%	0.012	33%	0.334	C	S	.	.			trans	-73.7	98.6	171.4	-175.1	0	0	0	0	109.1	I385 E387 R689 R702	I385-V700 HydrophobicContact CB-CG1 4.19Å; I385-V700 HydrophobicContact CD1-CB 4.29Å; I385-V700 HydrophobicContact CD1-CG1 4.14Å; I385-V700 HydrophobicContact CG2-CG1 3.82Å; E387-V700 HydrophobicContact CG-CG1 3.89Å; E387-V700 HydrophobicContact CG-CG2 4.21Å; R689-V700 PolarHBondContact NH1-O 3.12Å; R689-V700 PolarHBondContact O-N 3.12Å; V700-R702 VanDerWaalsContact C-N 3.29Å; V700-R702 HydrophobicContact CG1-CB 3.85Å
701	N	90	Very high	88.4	Confident	83 Å²	83	62.6 Å²	62.6	44%	0.444	33%	0.334	S	S	.	.			trans	-88.4	7.8	174.9	-62.9	-64	0	0	0	112.9	K699 H703 Q805	K699-N701 VanDerWaalsContact CD-OD1 3.29Å; K699-N701 WeakPolarHBondContact CD-OD1 3.39Å; K699-N701 WeakPolarHBondContact CE-OD1 3.47Å; K699-N701 PolarHBondContact NZ-OD1 3.34Å; K699-N701 PolarHBondContact O-N 2.94Å; K699-N701 VanDerWaalsContact O-N 3.17Å; K699-N701 PolarHBondContact O-ND2 3.46Å; N701-H703 PolarHBondContact O-N 3.39Å; N701-Q805 PolarHBondContact OD1-OE1 3.24Å
702	R	90.8	Very high	89	Confident	78 Å²	78	59.5 Å²	59.5	29%	0.294	32%	0.32	S	S	.	.			trans	-58.9	130.2	172.1	-164.8	-174.8	178.1	179.3	0.5	109.1	I386 K617 R689 V700	I386-R702 PolarHBondContact O-NH1 2.62Å; K617-R702 PolarHBondContact O-NH2 2.73Å; R689-R702 PolarHBondContact NH1-O 2.81Å; V700-R702 VanDerWaalsContact C-N 3.29Å; V700-R702 HydrophobicContact CG1-CB 3.85Å
703	H	94	Very high	89.6	Confident	66 Å²	66	53.3 Å²	53.3	31%	0.306	29%	0.291	S	S	.	.			trans	-63	145.6	168.4	-174.4	69.7	0	0	0	109.4	N701 D705 L802 S803 A804	N701-H703 PolarHBondContact O-N 3.39Å; H703-D705 IonicContact CD2-OD1 2.73Å; H703-D705 IonicContact NE2-OD1 2.72Å; H703-L802 PolarHBondContact CE1-O 2.92Å; H703-S803 PolarHBondContact ND1-O 3.23Å; H703-A804 PolarHBondContact CE1-O 3.14Å; H703-A804 PolarHBondContact ND1-O 3.39Å
704	V	95.9	Very high	90.5	Very high	0 Å²	0	52.4 Å²	52.4	0%	0	28%	0.282	C	S	.	.			trans	-125.4	120	177.2	178.4	0	0	0	0	105.6	I385 C619 V621 L687 F706	I385-V704 HydrophobicContact CD1-CG2 4.17Å; I385-V704 HydrophobicContact CG1-CG2 4.31Å; I385-V704 HydrophobicContact CG2-CG2 3.78Å; C619-V704 CarbonylContact O-C 3.57Å; C619-V704 WeakPolarHBondContact O-CA 3.36Å; C619-V704 VanDerWaalsContact O-CG1 3.31Å; C619-V704 WeakPolarHBondContact O-CG1 3.47Å; V621-V704 HydrophobicContact CG2-CG1 4.32Å; L687-V704 HydrophobicContact CD1-CB 3.84Å; L687-V704 HydrophobicContact CD1-CG1 3.9Å; L687-V704 HydrophobicContact CD1-CG2 4.16Å; L687-V704 HydrophobicContact CD2-CG1 4.36Å; V704-F706 WeakPolarHBondContact O-CD1 3.32Å; V704-F706 PolarHBondContact O-N 2.73Å
705	D	96.8	Very high	91.2	Very high	89 Å²	89	49.6 Å²	49.6	48%	0.476	25%	0.252	S	S	.	.	B	Isolated β-bridge	trans	-71.5	126.3	-175.9	-53.7	-71.4	0	0	0	109.8	C619 S620 V621 H703	C619-D705 PolarHBondContact O-N 3Å; S620-D705 CarbonylContact C-O 3.55Å; S620-D705 WeakPolarHBondContact CA-O 3.47Å; V621-D705 PolarHBondContact N-O 2.75Å; H703-D705 IonicContact CD2-OD1 2.73Å; H703-D705 IonicContact NE2-OD1 2.72Å
706	F	97.3	Very high	92	Very high	13 Å²	13	40.9 Å²	40.9	6%	0.057	21%	0.207	C	C	.	.			trans	-125.5	129.3	177.4	47	-94.9	0	0	0	111.3	V621 V704 L733 I736 A801 L802 A804 A806 L809	V621-F706 HydrophobicContact CB-CB 4.5Å; V621-F706 HydrophobicContact CG2-CB 3.71Å; V704-F706 WeakPolarHBondContact O-CD1 3.32Å; V704-F706 PolarHBondContact O-N 2.73Å; F706-L733 HydrophobicContact CD2-CD2 3.69Å; F706-L733 HydrophobicContact CE2-CD2 3.97Å; F706-I736 HydrophobicContact CE2-CD1 3.57Å; F706-I736 HydrophobicContact CE2-CG1 4.45Å; F706-I736 HydrophobicContact CZ-CD1 3.91Å; F706-A801 WeakPolarHBondContact CZ-O 3.26Å; F706-L802 HydrophobicContact CD2-CD2 3.91Å; F706-L802 HydrophobicContact CE2-CD2 3.8Å; F706-L802 VanDerWaalsContact CZ-O 3.3Å; F706-L802 WeakPolarHBondContact CZ-O 3.3Å; F706-A804 HydrophobicContact CZ-CB 4.49Å; F706-A806 HydrophobicContact CD1-CB 3.98Å; F706-A806 HydrophobicContact CE1-CB 3.45Å; F706-A806 VanDerWaalsContact CE1-CB 3.45Å; F706-A806 HydrophobicContact CZ-CB 3.96Å; F706-L809 HydrophobicContact CB-CD1 3.77Å; F706-L809 HydrophobicContact CB-CD2 4.35Å; F706-L809 HydrophobicContact CD1-CD1 4.13Å; F706-L809 HydrophobicContact CD1-CD2 4.03Å; F706-L809 HydrophobicContact CD2-CD2 3.81Å; F706-L809 HydrophobicContact CE1-CD2 4.31Å; F706-L809 HydrophobicContact CE2-CD2 4.05Å; F706-L809 HydrophobicContact CG-CD1 3.98Å; F706-L809 HydrophobicContact CG-CD2 3.8Å; F706-L809 HydrophobicContact CZ-CD2 4.31Å
707	P	96	Very high	92.7	Very high	30 Å²	30	38 Å²	38	20%	0.195	19%	0.186	C	C	.	.			trans	-79.8	153.5	-176.5	33.9	-37.4	0	0	0	111.9	M709 L710 Y811	P707-M709 WeakPolarHBondContact CB-O 3.41Å; P707-M709 PolarHBondContact O-N 3.06Å; P707-L710 HydrophobicContact CG-CB 4.1Å; P707-L710 HydrophobicContact CG-CD1 4.17Å; P707-Y811 WeakPolarHBondContact O-CE1 3.36Å; P707-Y811 PolarHBondContact O-OH 3.13Å
708	L	95.1	Very high	93	Very high	50 Å²	50	35 Å²	35	26%	0.262	18%	0.175	S	C	.	.	S	Bend	trans	-64.9	-28.9	168.3	-65.9	168.3	0	0	0	112.5	G732 L733 W785 E798 L802	L708-G732 WeakPolarHBondContact O-CA 3.33Å; L708-L733 PolarHBondContact O-N 3.18Å; L708-W785 HydrophobicContact CD2-CZ2 4.02Å; L708-E798 HydrophobicContact CD1-CG 4.08Å; L708-E798 WeakPolarHBondContact CD1-OE1 3.44Å; L708-E798 HydrophobicContact CD2-CG 3.96Å; L708-E798 VanDerWaalsContact CD2-OE2 3.23Å; L708-E798 WeakPolarHBondContact CD2-OE2 3.38Å; L708-L802 HydrophobicContact CD1-CD1 4.24Å; L708-L802 HydrophobicContact CD2-CD1 4.23Å; L708-L802 HydrophobicContact CD2-CD2 3.77Å; L708-L802 HydrophobicContact CD2-CG 4.26Å; L708-L802 HydrophobicContact CG-CD1 4.07Å; L708-L802 HydrophobicContact CG-CD2 4.11Å
709	M	96.1	Very high	92.9	Very high	94 Å²	94	34.9 Å²	34.9	46%	0.463	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	109	178.3	-72.9	-59	-57.1	0	0	109	P707 L730 Y731 V814	P707-M709 WeakPolarHBondContact CB-O 3.41Å; P707-M709 PolarHBondContact O-N 3.06Å; M709-L730 HydrophobicContact CE-CB 3.84Å; M709-L730 HydrophobicContact CE-CD1 4.35Å; M709-L730 HydrophobicContact CE-CG 4.47Å; M709-Y731 CarbonylContact C-O 3.46Å; M709-Y731 WeakPolarHBondContact CA-O 3.37Å; M709-V814 HydrophobicContact CE-CG2 3.88Å; M709-V814 HydrophobicContact SD-CG2 4.46Å
710	L	96.1	Very high	92.5	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.9	176.3	178.4	63.4	0	0	0	109.3	V621 Q622 L625 L683 L685 P707 L712 L730 Y731 Y811	V621-L710 HydrophobicContact CG1-CD1 4.35Å; V621-L710 HydrophobicContact CG1-CD2 4.27Å; Q622-L710 HydrophobicContact CG-CD1 3.87Å; L625-L710 HydrophobicContact CD1-CD1 4.23Å; L625-L710 HydrophobicContact CD1-CD2 4.15Å; L683-L710 HydrophobicContact CD2-CD2 4.14Å; L685-L710 HydrophobicContact CD1-CD2 4.04Å; P707-L710 HydrophobicContact CG-CB 4.1Å; P707-L710 HydrophobicContact CG-CD1 4.17Å; L710-L712 HydrophobicContact CD2-CD1 4.45Å; L710-L730 CarbonylContact O-C 3.48Å; L710-L730 WeakPolarHBondContact O-CA 3.44Å; L710-Y731 PolarHBondContact N-O 3.34Å; L710-Y731 PolarHBondContact O-N 3.08Å; L710-Y811 HydrophobicContact CB-CD1 4.08Å; L710-Y811 HydrophobicContact CB-CE1 3.63Å; L710-Y811 HydrophobicContact CD2-CE1 4.34Å; L710-Y811 HydrophobicContact CD2-CE2 4.32Å
711	D	94.9	Very high	91.9	Very high	42 Å²	42	38.8 Å²	38.8	23%	0.225	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	117.8	166.8	-166.5	-12.2	0	0	0	108.6	A713 K728 V729 L730	D711-A713 WeakPolarHBondContact OD1-CB 3.36Å; D711-A713 PolarHBondContact OD1-N 3.35Å; D711-A713 VanDerWaalsContact OD1-N 3.14Å; D711-K728 WeakPolarHBondContact OD2-CB 3.47Å; D711-K728 WeakPolarHBondContact OD2-CD 3.44Å; D711-K728 VanDerWaalsContact OD2-CG 3.26Å; D711-K728 WeakPolarHBondContact OD2-CG 3.34Å; D711-V729 PolarHBondContact OD1-N 2.86Å; D711-L730 HydrophobicContact CB-CD2 3.95Å
712	L	94.8	Very high	90.8	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.212	C	C	.	.			trans	-90	-12.4	-176.1	-158.6	68.8	0	0	0	112.6	L625 I676 V679 L683 L710 P714 F715 C716 V729 Y731	L625-L712 HydrophobicContact CD1-CD1 4.24Å; I676-L712 HydrophobicContact CD1-CD1 3.91Å; I676-L712 HydrophobicContact CD1-CD2 3.89Å; I676-L712 HydrophobicContact CD1-CG 3.92Å; V679-L712 HydrophobicContact CB-CD2 4.41Å; V679-L712 HydrophobicContact CG1-CD2 3.81Å; L683-L712 HydrophobicContact CD2-CD1 3.87Å; L683-L712 HydrophobicContact CD2-CD2 4.09Å; L710-L712 HydrophobicContact CD2-CD1 4.45Å; L712-P714 VanDerWaalsContact C-N 3.34Å; L712-F715 HydrophobicContact CD1-CD2 4.23Å; L712-F715 PolarHBondContact O-N 3.1Å; L712-C716 PolarHBondContact O-N 3.05Å; L712-C716 PolarHBondContact O-SG 2.89Å; L712-V729 HydrophobicContact CB-CB 4.15Å; L712-V729 HydrophobicContact CB-CG1 4.19Å; L712-V729 PolarHBondContact N-O 3.38Å; L712-Y731 HydrophobicContact CB-CD2 4.06Å; L712-Y731 HydrophobicContact CB-CE2 4.06Å; L712-Y731 HydrophobicContact CD2-CD2 4.28Å; L712-Y731 HydrophobicContact CD2-CE2 3.66Å
713	A	92.8	Very high	89.9	Confident	1 Å²	1	37.7 Å²	37.7	1%	0.008	21%	0.207	C	C	.	.	G	3₁₀ helix	trans	-53.2	-36.7	-174.5	0	0	0	0	0	115.4	L608 S609 D711 F715 C716 D727 V729	L608-A713 HydrophobicContact CB-CB 4.33Å; S609-A713 WeakPolarHBondContact OG-CB 3.28Å; D711-A713 WeakPolarHBondContact OD1-CB 3.36Å; D711-A713 PolarHBondContact OD1-N 3.35Å; D711-A713 VanDerWaalsContact OD1-N 3.14Å; A713-F715 PolarHBondContact O-N 3.39Å; A713-F715 VanDerWaalsContact O-N 3.12Å; A713-C716 PolarHBondContact O-N 3.32Å; A713-D727 WeakPolarHBondContact CB-O 3.3Å; A713-V729 HydrophobicContact CB-CB 4.37Å; A713-V729 HydrophobicContact CB-CG2 4.02Å
714	P	93.3	Very high	88.7	Confident	19 Å²	19	37.8 Å²	37.8	12%	0.123	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-64.9	-14.4	177.7	-23.2	34.9	0	0	0	114.8	T607 S609 L712	T607-P714 WeakPolarHBondContact CG2-O 3.45Å; S609-P714 WeakPolarHBondContact OG-CA 3.34Å; S609-P714 WeakPolarHBondContact OG-CD 3.27Å; S609-P714 VanDerWaalsContact OG-N 3.1Å; L712-P714 VanDerWaalsContact C-N 3.34Å
715	F	94.1	Very high	87	Confident	1 Å²	1	42.7 Å²	42.7	0%	0.004	24%	0.239	C	C	.	.	G	3₁₀ helix	trans	-112.5	-1.9	-174.1	-44.2	-66	0	0	0	112.4	Y612 Q622 L625 T629 I676 L712 A713	Y612-F715 HydrophobicContact CG-CE1 4.44Å; Y612-F715 HydrophobicContact CG-CZ 4.11Å; Q622-F715 HydrophobicContact CB-CZ 4.26Å; L625-F715 HydrophobicContact CB-CD1 3.87Å; L625-F715 HydrophobicContact CB-CD2 4.04Å; L625-F715 HydrophobicContact CB-CE1 3.79Å; L625-F715 HydrophobicContact CB-CE2 3.95Å; L625-F715 HydrophobicContact CB-CG 4Å; L625-F715 HydrophobicContact CB-CZ 3.82Å; L625-F715 HydrophobicContact CD1-CD2 4.04Å; L625-F715 HydrophobicContact CD1-CE2 3.94Å; T629-F715 HydrophobicContact CG2-CB 4.04Å; I676-F715 HydrophobicContact CD1-CB 4.42Å; I676-F715 PolarHBondContact N-O 3.33Å; L712-F715 HydrophobicContact CD1-CD2 4.23Å; L712-F715 PolarHBondContact O-N 3.1Å; A713-F715 PolarHBondContact O-N 3.39Å; A713-F715 VanDerWaalsContact O-N 3.12Å
716	C	93.4	Very high	85.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	145.3	178.7	-68.4	0	0	0	0	111.8	T607 L608 I676 V679 L712 A713 C720	T607-C716 CarbonylContact C-O 3.55Å; T607-C716 WeakPolarHBondContact CA-O 3.07Å; L608-C716 HydrophobicContact CB-CB 4.41Å; L608-C716 HydrophobicContact CD1-CB 3.45Å; L608-C716 VanDerWaalsContact CD1-CB 3.45Å; L608-C716 HydrophobicContact CG-CB 3.74Å; L608-C716 PolarHBondContact N-O 3.41Å; I676-C716 CarbonylContact O-C 3.59Å; I676-C716 WeakPolarHBondContact O-CA 3.46Å; V679-C716 VanDerWaalsContact CG1-SG 3.56Å; L712-C716 PolarHBondContact O-N 3.05Å; L712-C716 PolarHBondContact O-SG 2.89Å; A713-C716 PolarHBondContact O-N 3.32Å; C716-C720 HydrophobicContact CB-CB 4.05Å
717	S	90.8	Very high	84.2	Confident	10 Å²	10	44.6 Å²	44.6	7%	0.07	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	152.2	175.1	68	0	0	0	0	112	Q606 L608 I676 T719 C720	Q606-S717 CarbonylContact O-C 3.6Å; L608-S717 VanDerWaalsContact CD2-O 3.31Å; L608-S717 WeakPolarHBondContact CD2-O 3.37Å; L608-S717 WeakPolarHBondContact CG-O 3.46Å; I676-S717 PolarHBondContact O-N 3.34Å; S717-T719 PolarHBondContact O-N 3.11Å; S717-T719 PolarHBondContact OG-OG1 2.84Å; S717-C720 WeakPolarHBondContact O-CB 3.43Å; S717-C720 PolarHBondContact O-N 2.86Å
718	A	85.3	Confident	83.6	Confident	30 Å²	30	50.5 Å²	50.5	25%	0.248	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	-17.1	176.8	0	0	0	0	0	114.2	Q606 M725	Q606-A718 HydrophobicContact CB-CB 3.87Å; Q606-A718 HydrophobicContact CG-CB 3.86Å; Q606-A718 WeakPolarHBondContact O-CB 3.31Å; Q606-A718 PolarHBondContact O-N 2.78Å; A718-M725 HydrophobicContact CB-CE 4.27Å; A718-M725 HydrophobicContact CB-SD 3.76Å
719	T	82.3	Confident	83.5	Confident	102 Å²	102	48.2 Å²	48.2	63%	0.626	28%	0.275	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-103.3	17	176.5	52.1	0	0	0	0	113.5	S717 K721	S717-T719 PolarHBondContact O-N 3.11Å; S717-T719 PolarHBondContact OG-OG1 2.84Å; T719-K721 PolarHBondContact O-N 2.88Å
720	C	83.3	Confident	83.4	Confident	6 Å²	6	46.7 Å²	46.7	4%	0.041	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	126.7	-174.2	-175.4	0	0	0	0	112.3	L608 S677 C716 S717	L608-C720 HydrophobicContact CD1-CB 4.07Å; L608-C720 HydrophobicContact CD2-CB 4.27Å; L608-C720 HydrophobicContact CG-CB 4.26Å; S677-C720 VanDerWaalsContact C-SG 3.55Å; S677-C720 CarbonylContact O-C 3.59Å; S677-C720 WeakPolarHBondContact O-CA 3.32Å; C716-C720 HydrophobicContact CB-CB 4.05Å; S717-C720 WeakPolarHBondContact O-CB 3.43Å; S717-C720 PolarHBondContact O-N 2.86Å
721	K	76.5	Confident	83.3	Confident	100 Å²	100	46.7 Å²	46.7	44%	0.435	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	144.4	174.3	-62.1	168.5	-173.5	154.5	0	110.1	E358 S677 A678 T719 A723	E358-K721 IonicContact OE1-NZ 3.38Å; E358-K721 PolarHBondContact OE1-NZ 2.85Å; E358-K721 IonicContact OE2-NZ 3.73Å; E358-K721 PolarHBondContact OE2-NZ 3.34Å; S677-K721 PolarHBondContact O-N 2.85Å; A678-K721 HydrophobicContact CB-CB 4.03Å; A678-K721 HydrophobicContact CB-CD 4.07Å; T719-K721 PolarHBondContact O-N 2.88Å; K721-A723 VanDerWaalsContact C-N 3.3Å; K721-A723 PolarHBondContact O-N 3.19Å
722	N	68.3	Low	83.4	Confident	115 Å²	115	45.3 Å²	45.3	62%	0.615	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.3	21	178.1	-48.2	-31.3	0	0	0	115.4	R813	N722-R813 VanDerWaalsContact O-CZ 3.27Å; N722-R813 PolarHBondContact O-NH1 2.83Å; N722-R813 PolarHBondContact O-NH2 2.77Å
723	A	71.2	Confident	83.5	Confident	24 Å²	24	45.5 Å²	45.5	20%	0.198	27%	0.265	C	S	.	.			trans	-144.5	153.8	170.2	0	0	0	0	0	110.4	L608 K721 V729	L608-A723 HydrophobicContact CD1-CB 3.6Å; K721-A723 VanDerWaalsContact C-N 3.3Å; K721-A723 PolarHBondContact O-N 3.19Å; A723-V729 HydrophobicContact CB-CG2 3.77Å
724	S	68.6	Low	83.7	Confident	68 Å²	68	45.4 Å²	45.4	48%	0.476	27%	0.265	S	S	.	.			trans	-102.8	155.6	174.7	-23.6	0	0	0	0	111.1	G726 D727	S724-G726 PolarHBondContact O-N 3.17Å; S724-D727 WeakPolarHBondContact CB-OD2 3.45Å; S724-D727 PolarHBondContact N-OD2 3.42Å; S724-D727 WeakPolarHBondContact O-CB 3.31Å; S724-D727 PolarHBondContact O-N 3.26Å; S724-D727 VanDerWaalsContact O-N 3.11Å; S724-D727 PolarHBondContact OG-OD2 3.24Å
725	M	61.2	Low	83.9	Confident	103 Å²	103	44.5 Å²	44.5	51%	0.507	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	123	176.1	-167.3	73.8	-170.1	0	0	110.8	Q606 T607 L608 A718	Q606-M725 HydrophobicContact CG-CE 4.24Å; T607-M725 WeakPolarHBondContact O-CE 3.16Å; L608-M725 HydrophobicContact CD2-SD 4.43Å; A718-M725 HydrophobicContact CB-CE 4.27Å; A718-M725 HydrophobicContact CB-SD 3.76Å
726	G	60.8	Low	84.1	Confident	60 Å²	60	44.5 Å²	44.5	62%	0.619	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.8	-5.4	-176.6	0	0	0	0	0	116.1	L608 S724	L608-G726 PolarHBondContact O-N 3.03Å; S724-G726 PolarHBondContact O-N 3.17Å
727	D	72.6	Confident	84.4	Confident	81 Å²	81	44.5 Å²	44.5	43%	0.433	26%	0.258	S	S	.	.			trans	-73.5	149.2	170.5	-73.4	-22	0	0	0	111	A713 S724	A713-D727 WeakPolarHBondContact CB-O 3.3Å; S724-D727 WeakPolarHBondContact CB-OD2 3.45Å; S724-D727 PolarHBondContact N-OD2 3.42Å; S724-D727 WeakPolarHBondContact O-CB 3.31Å; S724-D727 PolarHBondContact O-N 3.26Å; S724-D727 VanDerWaalsContact O-N 3.11Å; S724-D727 PolarHBondContact OG-OD2 3.24Å
728	K	84.5	Confident	84.7	Confident	154 Å²	154	45.6 Å²	45.6	67%	0.67	26%	0.262	S	S	*	.			trans	-78	138.4	165.1	-63	-166.9	175.6	-173.4	0	110	D711 L730	D711-K728 WeakPolarHBondContact OD2-CB 3.47Å; D711-K728 WeakPolarHBondContact OD2-CD 3.44Å; D711-K728 VanDerWaalsContact OD2-CG 3.26Å; D711-K728 WeakPolarHBondContact OD2-CG 3.34Å; K728-L730 HydrophobicContact CB-CD1 4.5Å; K728-L730 HydrophobicContact CB-CD2 4.03Å; K728-L730 HydrophobicContact CB-CG 3.92Å; K728-L730 HydrophobicContact CD-CD2 4.24Å
729	V	91.8	Very high	85.2	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.012	25%	0.253	C	S	.	.			trans	-108.4	80.7	177.9	-172	0	0	0	0	108.1	L608 V679 D711 L712 A713 A723 Y731	L608-V729 HydrophobicContact CD1-CG2 3.84Å; V679-V729 HydrophobicContact CG1-CG1 4.31Å; V679-V729 HydrophobicContact CG2-CG1 4.15Å; D711-V729 PolarHBondContact OD1-N 2.86Å; L712-V729 HydrophobicContact CB-CB 4.15Å; L712-V729 HydrophobicContact CB-CG1 4.19Å; L712-V729 PolarHBondContact N-O 3.38Å; A713-V729 HydrophobicContact CB-CB 4.37Å; A713-V729 HydrophobicContact CB-CG2 4.02Å; A723-V729 HydrophobicContact CB-CG2 3.77Å; V729-Y731 HydrophobicContact CG1-CD2 4.45Å; V729-Y731 HydrophobicContact CG1-CE2 3.81Å
730	L	94.1	Very high	85.7	Confident	62 Å²	62	42.3 Å²	42.3	33%	0.325	24%	0.241	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	136.4	-169.1	-63.6	-179	0	0	0	113.5	M709 L710 D711 K728 V814	M709-L730 HydrophobicContact CE-CB 3.84Å; M709-L730 HydrophobicContact CE-CD1 4.35Å; M709-L730 HydrophobicContact CE-CG 4.47Å; L710-L730 CarbonylContact O-C 3.48Å; L710-L730 WeakPolarHBondContact O-CA 3.44Å; D711-L730 HydrophobicContact CB-CD2 3.95Å; K728-L730 HydrophobicContact CB-CD1 4.5Å; K728-L730 HydrophobicContact CB-CD2 4.03Å; K728-L730 HydrophobicContact CB-CG 3.92Å; K728-L730 HydrophobicContact CD-CD2 4.24Å; L730-V814 HydrophobicContact CB-CB 4.29Å; L730-V814 PolarHBondContact O-N 3.28Å
731	Y	95.9	Very high	86	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	126.6	179.9	-84.1	-85	0	0	0	111	V679 P680 L683 M709 L710 L712 V729 E812 R813	V679-Y731 WeakPolarHBondContact CB-OH 3.27Å; P680-Y731 PolarHBondContact O-OH 3.48Å; L683-Y731 HydrophobicContact CB-CD1 3.92Å; L683-Y731 HydrophobicContact CB-CE1 3.71Å; M709-Y731 CarbonylContact C-O 3.46Å; M709-Y731 WeakPolarHBondContact CA-O 3.37Å; L710-Y731 PolarHBondContact N-O 3.34Å; L710-Y731 PolarHBondContact O-N 3.08Å; L712-Y731 HydrophobicContact CB-CD2 4.06Å; L712-Y731 HydrophobicContact CB-CE2 4.06Å; L712-Y731 HydrophobicContact CD2-CD2 4.28Å; L712-Y731 HydrophobicContact CD2-CE2 3.66Å; V729-Y731 HydrophobicContact CG1-CD2 4.45Å; V729-Y731 HydrophobicContact CG1-CE2 3.81Å; Y731-E812 WeakPolarHBondContact CA-O 3.43Å; Y731-R813 HydrophobicContact CD1-CB 4.08Å; Y731-R813 HydrophobicContact CE1-CB 3.59Å; Y731-R813 HydrophobicContact CE1-CG 4.35Å
732	G	96.1	Very high	86.5	Confident	13 Å²	13	42.1 Å²	42.1	13%	0.134	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	124.7	176	0	0	0	0	0	112	L708 Y734 Y811 E812	L708-G732 WeakPolarHBondContact O-CA 3.33Å; G732-Y734 PolarHBondContact O-N 2.89Å; G732-Y811 WeakPolarHBondContact O-CA 3.37Å; G732-E812 PolarHBondContact N-O 3.37Å; G732-E812 PolarHBondContact O-N 3.33Å
733	L	97.4	Very high	87.1	Confident	4 Å²	4	39.8 Å²	39.8	2%	0.021	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	127.3	173.5	-173.8	74	0	0	0	110	F706 L708 I736 W785 L802 L809 Y811	F706-L733 HydrophobicContact CD2-CD2 3.69Å; F706-L733 HydrophobicContact CE2-CD2 3.97Å; L708-L733 PolarHBondContact O-N 3.18Å; L733-I736 HydrophobicContact CD2-CD1 4.27Å; L733-I736 HydrophobicContact CD2-CG1 4.37Å; L733-W785 HydrophobicContact CD2-CH2 3.93Å; L733-W785 HydrophobicContact CD2-CZ2 4.17Å; L733-W785 HydrophobicContact CG-CH2 4.04Å; L733-W785 HydrophobicContact CG-CZ2 4.48Å; L733-L802 HydrophobicContact CD2-CD2 4.22Å; L733-L809 HydrophobicContact CD1-CB 4.23Å; L733-L809 HydrophobicContact CD1-CD2 3.88Å; L733-Y811 HydrophobicContact CB-CD1 3.98Å; L733-Y811 HydrophobicContact CB-CE1 3.65Å; L733-Y811 HydrophobicContact CD1-CD1 4.24Å; L733-Y811 HydrophobicContact CD1-CD2 4.01Å; L733-Y811 HydrophobicContact CD1-CE1 3.92Å; L733-Y811 HydrophobicContact CD1-CE2 3.67Å; L733-Y811 HydrophobicContact CD1-CG 4.28Å; L733-Y811 HydrophobicContact CG-CE1 4.36Å
734	Y	96.6	Very high	87.6	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	-11.2	176.3	73.5	-86.2	0	0	0	114.5	Q211 T212 V682 G732 V752 K753 F810 E812	Q211-Y734 HydrophobicContact CB-CD2 4.23Å; Q211-Y734 HydrophobicContact CB-CE2 4.47Å; Q211-Y734 HydrophobicContact CG-CD2 4.05Å; T212-Y734 WeakPolarHBondContact OG1-CE2 3.48Å; T212-Y734 PolarHBondContact OG1-OH 2.9Å; V682-Y734 HydrophobicContact CG1-CE1 4.29Å; V682-Y734 VanDerWaalsContact CG1-OH 3.27Å; V682-Y734 WeakPolarHBondContact CG1-OH 3.35Å; G732-Y734 PolarHBondContact O-N 2.89Å; Y734-V752 WeakPolarHBondContact O-CA 3.3Å; Y734-K753 PolarHBondContact O-N 3.06Å; Y734-F810 HydrophobicContact CD1-CB 4.46Å; Y734-F810 VanDerWaalsContact CD1-O 3.29Å; Y734-F810 WeakPolarHBondContact CD1-O 3.42Å; Y734-F810 HydrophobicContact CE1-CB 3.9Å; Y734-F810 HydrophobicContact CE2-CB 4.17Å; Y734-F810 PolarHBondContact N-O 3Å; Y734-E812 HydrophobicContact CD1-CB 3.7Å; Y734-E812 HydrophobicContact CE1-CB 3.68Å
735	G	97.7	Very high	88.4	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	145.8	-176.1	0	0	0	0	0	113.5	N208 Y751 F810	N208-G735 VanDerWaalsContact OD1-C 3.22Å; N208-G735 WeakPolarHBondContact OD1-CA 3.35Å; G735-Y751 CarbonylContact C-O 3.45Å; G735-Y751 WeakPolarHBondContact CA-O 3.36Å; G735-F810 PolarHBondContact N-O 3.25Å; G735-F810 PolarHBondContact O-N 3.06Å
736	I	98.6	Very high	89.9	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	138.5	178.5	-46.6	176.7	0	0	0	107.5	N208 F706 L733 A750 Y751 W785 A801 A806 L808 L809	N208-I736 PolarHBondContact ND2-O 2.88Å; N208-I736 VanDerWaalsContact ND2-O 3.08Å; N208-I736 PolarHBondContact OD1-N 3.45Å; F706-I736 HydrophobicContact CE2-CD1 3.57Å; F706-I736 HydrophobicContact CE2-CG1 4.45Å; F706-I736 HydrophobicContact CZ-CD1 3.91Å; L733-I736 HydrophobicContact CD2-CD1 4.27Å; L733-I736 HydrophobicContact CD2-CG1 4.37Å; I736-A750 CarbonylContact O-C 3.52Å; I736-A750 VanDerWaalsContact O-CA 3.24Å; I736-A750 WeakPolarHBondContact O-CA 3.4Å; I736-Y751 HydrophobicContact CB-CD2 4.28Å; I736-Y751 HydrophobicContact CG2-CD2 4.43Å; I736-Y751 PolarHBondContact N-O 3.31Å; I736-Y751 PolarHBondContact O-N 2.97Å; I736-W785 HydrophobicContact CD1-CH2 4.18Å; I736-W785 HydrophobicContact CD1-CZ3 4.15Å; I736-W785 HydrophobicContact CG1-CH2 4.28Å; I736-W785 HydrophobicContact CG1-CZ3 4.19Å; I736-A801 HydrophobicContact CD1-CB 4.2Å; I736-A801 VanDerWaalsContact CD1-O 3.25Å; I736-A801 WeakPolarHBondContact CD1-O 3.21Å; I736-A806 HydrophobicContact CG2-CB 3.63Å; I736-L808 WeakPolarHBondContact CA-O 3.48Å; I736-L809 HydrophobicContact CB-CD2 4.5Å; I736-L809 HydrophobicContact CG1-CD2 4.08Å; I736-L809 HydrophobicContact CG2-CD2 4.09Å
737	V	98.6	Very high	91.6	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	124.9	159	174.7	0	0	0	0	107.6	A204 N208 Y748 T749 Y807 L808 F810	A204-V737 HydrophobicContact CB-CG1 4Å; A204-V737 HydrophobicContact CB-CG2 4.22Å; N208-V737 VanDerWaalsContact ND2-CG2 3.34Å; N208-V737 WeakPolarHBondContact ND2-CG2 3.48Å; V737-Y748 HydrophobicContact CG1-CD1 3.63Å; V737-Y748 HydrophobicContact CG1-CE1 4.29Å; V737-T749 CarbonylContact C-O 3.45Å; V737-T749 WeakPolarHBondContact CA-O 3.48Å; V737-Y807 PolarHBondContact O-N 3.13Å; V737-L808 HydrophobicContact CB-CB 3.97Å; V737-L808 HydrophobicContact CB-CG 4.32Å; V737-L808 HydrophobicContact CG2-CB 4.19Å; V737-L808 HydrophobicContact CG2-CD1 4.27Å; V737-L808 PolarHBondContact N-O 3.5Å; V737-L808 PolarHBondContact O-N 2.92Å; V737-F810 HydrophobicContact CG2-CE2 4.14Å
738	E	97.6	Very high	92.8	Very high	33 Å²	33	45 Å²	45	15%	0.154	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	134.3	174	170.7	166.6	-120	0	0	109.5	Y748 T749 Y751 H787 A804 Q805	E738-Y748 WeakPolarHBondContact O-CA 3.11Å; E738-T749 PolarHBondContact N-O 3.31Å; E738-T749 PolarHBondContact O-N 2.84Å; E738-Y751 HydrophobicContact CB-CD2 4.45Å; E738-Y751 HydrophobicContact CB-CE2 3.87Å; E738-Y751 WeakPolarHBondContact OE2-CE2 3.33Å; E738-Y751 PolarHBondContact OE2-OH 3.02Å; E738-H787 IonicContact OE2-NE2 2.7Å; E738-A804 HydrophobicContact CB-CB 4.45Å; E738-A804 WeakPolarHBondContact OE1-CA 3.42Å; E738-Q805 HydrophobicContact CG-CB 4.42Å; E738-Q805 PolarHBondContact OE1-N 3.39Å
739	H	95.9	Very high	93.4	Very high	9 Å²	9	38 Å²	38	4%	0.042	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	110.7	174.8	-176.1	-116.5	0	0	0	111.9	F690 K699 S742 Y748 Y807	F690-H739 AromaticContact CE1-ND1 3.82Å; F690-H739 AromaticContact CZ-CE1 3.77Å; F690-H739 AromaticContact CZ-ND1 3.42Å; F690-H739 WeakPolarHBondContact CZ-ND1 3.26Å; K699-H739 PolarHBondContact NZ-O 2.72Å; H739-S742 PolarHBondContact CE1-O 2.88Å; H739-Y748 HydrophobicContact CB-CD1 3.87Å; H739-Y748 HydrophobicContact CB-CE1 3.64Å; H739-Y748 AromaticContact CD2-CD1 3.7Å; H739-Y748 AromaticContact CD2-CD2 3.79Å; H739-Y748 AromaticContact CD2-CE1 3.52Å; H739-Y748 AromaticContact CD2-CE2 3.62Å; H739-Y748 AromaticContact CD2-CG 3.85Å; H739-Y748 AromaticContact CD2-CZ 3.49Å; H739-Y748 VanDerWaalsContact CD2-CZ 3.49Å; H739-Y748 AromaticContact CG-CE1 3.72Å; H739-Y748 AromaticContact CG-CZ 3.96Å; H739-Y748 AromaticContact NE2-CE2 4Å; H739-Y807 HydrophobicContact CB-CG 4.39Å
740	S	92.8	Very high	93.7	Very high	55 Å²	55	37.9 Å²	37.9	39%	0.385	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	148.9	172.2	68.3	0	0	0	0	110.7	G746 H747	S740-G746 CarbonylContact O-C 2.96Å; S740-G746 WeakPolarHBondContact O-CA 3.2Å; S740-H747 PolarHBondContact N-O 3.19Å; S740-H747 PolarHBondContact O-N 3.18Å; S740-H747 PolarHBondContact OG-O 3.03Å
741	G	90.4	Very high	93.9	Very high	46 Å²	46	35.4 Å²	35.4	47%	0.474	19%	0.188	S	C	.	.	E	Extended strand (participates in β ladder)	trans	96.9	-155.8	-177	0	0	0	0	0	115	K699	K699-G741 WeakPolarHBondContact CD-O 3.45Å; K699-G741 PolarHBondContact NZ-O 2.91Å
742	S	86.8	Confident	93.9	Very high	55 Å²	55	35.5 Å²	35.5	39%	0.385	19%	0.189	S	C	.	.			trans	-111.3	-168.8	-161.8	75.5	0	0	0	0	113.7	H739 R744 E745	H739-S742 PolarHBondContact CE1-O 2.88Å; S742-R744 VanDerWaalsContact C-N 3.32Å; S742-R744 PolarHBondContact OG-N 3.39Å; S742-R744 VanDerWaalsContact OG-N 3.11Å; S742-E745 PolarHBondContact N-O 3.07Å; S742-E745 PolarHBondContact OG-N 2.97Å; S742-E745 VanDerWaalsContact OG-N 3.09Å; S742-E745 PolarHBondContact OG-O 2.94Å
743	M	80.6	Confident	93.8	Very high	67 Å²	67	36.5 Å²	36.5	33%	0.33	19%	0.189	S	C	.	.	S	Bend	trans	-72.9	-18.8	169.6	-68.9	-73.2	-71	0	0	113.8	F690 L697	F690-M743 HydrophobicContact CB-CE 3.97Å; F690-M743 HydrophobicContact CB-SD 3.59Å; F690-M743 VanDerWaalsContact CB-SD 3.59Å; F690-M743 HydrophobicContact CD1-SD 3.35Å; F690-M743 WeakPolarHBondContact CD1-SD 3.34Å; F690-M743 HydrophobicContact CE1-SD 4.27Å; F690-M743 HydrophobicContact CG-SD 3.79Å; L697-M743 HydrophobicContact CB-CE 3.79Å; L697-M743 HydrophobicContact CB-CG 4.18Å; L697-M743 HydrophobicContact CD1-CE 4.39Å; L697-M743 HydrophobicContact CD2-CE 4.07Å; L697-M743 HydrophobicContact CG-CE 4.3Å
744	R	80.5	Confident	93.3	Very high	223 Å²	223	36.5 Å²	36.5	84%	0.842	19%	0.19	S	C	*	.	S	Bend	trans	-115	-26.6	-168.6	-66.9	-175.2	177	-80.5	1.6	114.2	S742	S742-R744 VanDerWaalsContact C-N 3.32Å; S742-R744 PolarHBondContact OG-N 3.39Å; S742-R744 VanDerWaalsContact OG-N 3.11Å
745	E	86.6	Confident	92.7	Very high	139 Å²	139	39 Å²	39	65%	0.65	20%	0.199	S	C	*	.	S	Bend	trans	-150.5	135.9	179.9	-179.7	-179.3	-163.6	0	0	108.2	S742	S742-E745 PolarHBondContact N-O 3.07Å; S742-E745 PolarHBondContact OG-N 2.97Å; S742-E745 VanDerWaalsContact OG-N 3.09Å; S742-E745 PolarHBondContact OG-O 2.94Å
746	G	91.8	Very high	91.3	Very high	15 Å²	15	41.6 Å²	41.6	16%	0.155	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.7	-178.5	176.8	0	0	0	0	0	113.4	S740	S740-G746 CarbonylContact O-C 2.96Å; S740-G746 WeakPolarHBondContact O-CA 3.2Å
747	H	96.1	Very high	89.5	Confident	53 Å²	53	44.6 Å²	44.6	25%	0.245	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	131.2	-179.3	-179.7	58.8	0	0	0	111.1	C200 S740 S789 D790	C200-H747 WeakPolarHBondContact CB-CE1 3.46Å; C200-H747 VanDerWaalsContact CB-ND1 3.3Å; C200-H747 WeakPolarHBondContact CB-ND1 3.5Å; C200-H747 PolarHBondContact SG-ND1 2.81Å; S740-H747 PolarHBondContact N-O 3.19Å; S740-H747 PolarHBondContact O-N 3.18Å; S740-H747 PolarHBondContact OG-O 3.03Å; H747-S789 PolarHBondContact NE2-OG 2.63Å; H747-D790 IonicContact CE1-OD2 3.36Å; H747-D790 PolarHBondContact CE1-OD2 3.02Å
748	Y	98	Very high	87.3	Confident	15 Å²	15	49 Å²	49	6%	0.059	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.4	-179.3	-73.5	-82.1	0	0	0	111	F201 D294 S295 V737 E738 H739 Y807	F201-Y748 HydrophobicContact CB-CD2 3.5Å; F201-Y748 HydrophobicContact CB-CE2 3.7Å; F201-Y748 HydrophobicContact CB-CG 4.23Å; D294-Y748 PolarHBondContact OD2-OH 3.33Å; S295-Y748 WeakPolarHBondContact OG-CE1 3.11Å; V737-Y748 HydrophobicContact CG1-CD1 3.63Å; V737-Y748 HydrophobicContact CG1-CE1 4.29Å; E738-Y748 WeakPolarHBondContact O-CA 3.11Å; H739-Y748 HydrophobicContact CB-CD1 3.87Å; H739-Y748 HydrophobicContact CB-CE1 3.64Å; H739-Y748 AromaticContact CD2-CD1 3.7Å; H739-Y748 AromaticContact CD2-CD2 3.79Å; H739-Y748 AromaticContact CD2-CE1 3.52Å; H739-Y748 AromaticContact CD2-CE2 3.62Å; H739-Y748 AromaticContact CD2-CG 3.85Å; H739-Y748 AromaticContact CD2-CZ 3.49Å; H739-Y748 VanDerWaalsContact CD2-CZ 3.49Å; H739-Y748 AromaticContact CG-CE1 3.72Å; H739-Y748 AromaticContact CG-CZ 3.96Å; H739-Y748 AromaticContact NE2-CE2 4Å; Y748-Y807 AromaticContact CE1-CD1 3.8Å; Y748-Y807 HydrophobicContact CE1-CD1 3.8Å; Y748-Y807 HydrophobicContact CE1-CE1 4.23Å; Y748-Y807 HydrophobicContact CE1-CG 4.49Å
749	T	98.3	Very high	84.6	Confident	7 Å²	7	59.3 Å²	59.3	4%	0.043	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	163.2	172.1	71.3	0	0	0	0	110.4	V737 E738 H787 V788	V737-T749 CarbonylContact C-O 3.45Å; V737-T749 WeakPolarHBondContact CA-O 3.48Å; E738-T749 PolarHBondContact N-O 3.31Å; E738-T749 PolarHBondContact O-N 2.84Å; T749-H787 WeakPolarHBondContact CB-NE2 3.07Å; T749-H787 WeakPolarHBondContact CG2-NE2 3.32Å; T749-H787 PolarHBondContact OG1-NE2 3.4Å; T749-V788 WeakPolarHBondContact CB-O 3.34Å
750	A	98.4	Very high	82.1	Confident	0 Å²	0	66.2 Å²	66.2	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	150.1	178.3	0	0	0	0	0	111.9	A204 Q207 I736 H787 V788	A204-A750 HydrophobicContact CB-CB 4.35Å; Q207-A750 HydrophobicContact CB-CB 3.71Å; Q207-A750 HydrophobicContact CG-CB 4.15Å; I736-A750 CarbonylContact O-C 3.52Å; I736-A750 VanDerWaalsContact O-CA 3.24Å; I736-A750 WeakPolarHBondContact O-CA 3.4Å; A750-H787 CarbonylContact O-C 3.38Å; A750-H787 WeakPolarHBondContact O-CA 3.45Å; A750-H787 PolarHBondContact O-CD2 3.2Å; A750-H787 VanDerWaalsContact O-CD2 3.28Å; A750-V788 PolarHBondContact N-O 3.36Å; A750-V788 PolarHBondContact O-N 3.46Å
751	Y	98.1	Very high	79.4	Confident	10 Å²	10	69.4 Å²	69.4	4%	0.039	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	125.3	160.4	-57.6	-101.9	0	0	0	107.7	G735 I736 E738 V786 H787 V796 R800 A801 A804	G735-Y751 CarbonylContact C-O 3.45Å; G735-Y751 WeakPolarHBondContact CA-O 3.36Å; I736-Y751 HydrophobicContact CB-CD2 4.28Å; I736-Y751 HydrophobicContact CG2-CD2 4.43Å; I736-Y751 PolarHBondContact N-O 3.31Å; I736-Y751 PolarHBondContact O-N 2.97Å; E738-Y751 HydrophobicContact CB-CD2 4.45Å; E738-Y751 HydrophobicContact CB-CE2 3.87Å; E738-Y751 WeakPolarHBondContact OE2-CE2 3.33Å; E738-Y751 PolarHBondContact OE2-OH 3.02Å; Y751-V786 CarbonylContact C-O 3.54Å; Y751-V786 WeakPolarHBondContact CA-O 3.4Å; Y751-H787 HydrophobicContact CD1-CB 3.85Å; Y751-H787 AromaticContact CD1-CD2 3.75Å; Y751-H787 HydrophobicContact CE1-CB 3.79Å; Y751-H787 AromaticContact CE1-CD2 3.35Å; Y751-H787 WeakPolarHBondContact CE1-CD2 3.47Å; Y751-H787 AromaticContact CE1-CG 3.73Å; Y751-H787 AromaticContact CE2-CD2 3.69Å; Y751-H787 AromaticContact CE2-NE2 3.93Å; Y751-H787 AromaticContact CZ-CD2 3.31Å; Y751-H787 AromaticContact CZ-NE2 3.86Å; Y751-V796 HydrophobicContact CD1-CG2 4.1Å; Y751-V796 HydrophobicContact CE1-CG2 4.48Å; Y751-R800 HydrophobicContact CE1-CG 4.32Å; Y751-A801 HydrophobicContact CD1-CB 3.95Å; Y751-A801 HydrophobicContact CG-CB 4.22Å; Y751-A804 HydrophobicContact CD2-CB 4.13Å; Y751-A804 HydrophobicContact CE2-CB 3.67Å
752	V	96.1	Very high	76.6	Confident	1 Å²	1	72.1 Å²	72.1	1%	0.006	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.6	-179.7	-66.3	0	0	0	0	110.6	V190 Q207 Q211 Y734 V786	V190-V752 HydrophobicContact CG1-CG2 4.11Å; V190-V752 HydrophobicContact CG2-CG2 3.91Å; Q207-V752 HydrophobicContact CB-CG1 4.12Å; Q211-V752 HydrophobicContact CB-CB 4.33Å; Q211-V752 HydrophobicContact CB-CG1 4.34Å; Q211-V752 HydrophobicContact CG-CB 4.26Å; Y734-V752 WeakPolarHBondContact O-CA 3.3Å; V752-V786 HydrophobicContact CG2-CB 4.16Å; V752-V786 PolarHBondContact N-O 2.6Å; V752-V786 PolarHBondContact O-N 3.25Å
753	K	93.8	Very high	74	Confident	34 Å²	34	78.1 Å²	78.1	15%	0.148	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	107.8	175.8	-164	170.5	-173.2	161.2	0	108.8	Q211 Y734 R755 G783 W785 E798	Q211-K753 PolarHBondContact NE2-O 3.5Å; Y734-K753 PolarHBondContact O-N 3.06Å; K753-R755 HydrophobicContact CB-CG 4.5Å; K753-R755 HydrophobicContact CG-CG 4.21Å; K753-R755 WeakPolarHBondContact O-CG 3.37Å; K753-R755 PolarHBondContact O-N 2.93Å; K753-G783 WeakPolarHBondContact CE-O 3.12Å; K753-W785 HydrophobicContact CB-CD2 3.88Å; K753-W785 HydrophobicContact CB-CE3 3.95Å; K753-W785 HydrophobicContact CB-CH2 3.96Å; K753-W785 HydrophobicContact CB-CZ2 3.87Å; K753-W785 HydrophobicContact CB-CZ3 3.98Å; K753-W785 HydrophobicContact CD-CD2 4.48Å; K753-W785 HydrophobicContact CD-CZ2 3.77Å; K753-W785 HydrophobicContact CG-CD2 4.12Å; K753-W785 HydrophobicContact CG-CG 4.43Å; K753-W785 HydrophobicContact CG-CZ2 4.17Å; K753-E798 IonicContact NZ-OE2 3Å; K753-E798 PolarHBondContact NZ-OE2 3.23Å
754	V	86.9	Confident	71.6	Confident	4 Å²	4	82.9 Å²	82.9	2%	0.024	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	116.7	175.2	-173.3	0	0	0	0	108.6	L187 V190 G783 Q784 V786	L187-V754 HydrophobicContact CD1-CG1 4.46Å; L187-V754 HydrophobicContact CD2-CB 4.26Å; L187-V754 HydrophobicContact CD2-CG1 3.64Å; L187-V754 HydrophobicContact CG-CG1 3.67Å; V190-V754 HydrophobicContact CG2-CG2 3.52Å; V754-G783 CarbonylContact O-C 3.56Å; V754-G783 WeakPolarHBondContact O-CA 3.24Å; V754-Q784 WeakPolarHBondContact CB-O 3.32Å; V754-Q784 PolarHBondContact N-O 3.26Å; V754-Q784 PolarHBondContact O-N 3.37Å; V754-Q784 VanDerWaalsContact O-N 3.1Å; V754-V786 HydrophobicContact CG2-CG2 3.76Å
755	R	84.1	Confident	69.2	Low	52 Å²	52	78.4 Å²	78.4	20%	0.196	40%	0.4	C	S	.	.			trans	-121.6	156.8	-173.4	-67.2	174.9	-58.3	144	7.6	109.4	Q211 Y213 K753 E812	Q211-R755 PolarHBondContact O-NH2 2.9Å; Y213-R755 HydrophobicContact CE2-CB 4.16Å; Y213-R755 WeakPolarHBondContact CE2-O 3.45Å; Y213-R755 PolarHBondContact OH-O 2.82Å; K753-R755 HydrophobicContact CB-CG 4.5Å; K753-R755 HydrophobicContact CG-CG 4.21Å; K753-R755 WeakPolarHBondContact O-CG 3.37Å; K753-R755 PolarHBondContact O-N 2.93Å; R755-E812 IonicContact CZ-OE2 3.35Å; R755-E812 IonicContact NH1-OE2 2.77Å; R755-E812 PolarHBondContact NH1-OE2 3.08Å; R755-E812 IonicContact NH2-OE1 3.23Å; R755-E812 IonicContact NH2-OE2 3.64Å; R755-E812 PolarHBondContact NH2-OE2 3.16Å
756	T	67.9	Low	66.4	Low	56 Å²	56	77.7 Å²	77.7	34%	0.344	41%	0.405	S	S	.	.			trans	-77.5	128.4	164	48.2	0	0	0	0	109.5	S758	T756-S758 PolarHBondContact O-N 3.11Å
757	P	59.5	Low	63.6	Low	62 Å²	62	86.8 Å²	86.8	40%	0.403	44%	0.44	S	S	.	.			trans	-54.7	128.4	173.7	-26.3	33.6	0	0	0	111.8	Y213	Y213-P757 HydrophobicContact CD2-CB 3.97Å; Y213-P757 HydrophobicContact CD2-CG 3.83Å; Y213-P757 HydrophobicContact CE2-CB 4.26Å; Y213-P757 HydrophobicContact CE2-CG 3.68Å; Y213-P757 HydrophobicContact CG-CG 4.38Å
758	S	52.3	Low	60.6	Low	93 Å²	93	94.3 Å²	94.3	65%	0.65	47%	0.472	S	S	*	.			trans	-91.9	115.6	178.9	-174.1	0	0	0	0	109.5	T756 K760	T756-S758 PolarHBondContact O-N 3.11Å; S758-K760 PolarHBondContact O-N 2.83Å
759	R	42.7	Very low	57.3	Low	250 Å²	250	103.3 Å²	103.3	94%	0.943	51%	0.511	S	S	*	.			trans	-72.4	22.5	-176.1	-86.2	-173.5	167.6	-173.9	-4.2	114.8	L761	R759-L761 PolarHBondContact O-N 3.44Å
760	K	41.6	Very low	54	Low	153 Å²	153	108.5 Å²	108.5	67%	0.665	55%	0.548	S	S	*	.			trans	-98	43.3	-170.2	-69.6	-169.8	175.5	-176.7	0	114.7	S758	S758-K760 PolarHBondContact O-N 2.83Å
761	L	38	Very low	50.7	Low	122 Å²	122	115 Å²	115	64%	0.639	59%	0.588	S	S	*	*	S	Bend	trans	-128.5	38.3	168.9	-153.3	73.7	0	0	0	113.2	T214 R759 L815	T214-L761 HydrophobicContact CG2-CD2 4.09Å; R759-L761 PolarHBondContact O-N 3.44Å; L761-L815 HydrophobicContact CD1-CD1 3.69Å
762	S	31.4	Very low	47.7	Very low	104 Å²	104	120.6 Å²	120.6	73%	0.727	63%	0.625	S	S	*	*			trans	-150	108.3	162.6	-174.9	0	0	0	0	110
763	E	30.6	Very low	44.6	Very low	181 Å²	181	124.1 Å²	124.1	85%	0.846	66%	0.662	S	S	*	*			trans	177.6	152.5	133.7	-100.3	175.9	-156.8	0	0	111
764	H	30.1	Very low	41.6	Very low	167 Å²	167	130.7 Å²	130.7	77%	0.773	70%	0.697	S	S	*	*			trans	-70.8	147.4	174.2	-88.1	-92.1	0	0	0	111.5	T766	H764-T766 VanDerWaalsContact C-N 3.34Å; H764-T766 PolarHBondContact O-N 3.07Å
765	P	31.3	Very low	38.8	Very low	129 Å²	129	139.5 Å²	139.5	84%	0.838	74%	0.736	S	S	*	*			trans	-72.1	82.1	-179.5	30.4	-36.3	0	0	0	112.3
766	T	27.4	Very low	36.5	Very low	124 Å²	124	146 Å²	146	76%	0.761	77%	0.768	S	S	*	*			trans	-86.2	124.9	170.1	58.8	0	0	0	0	110.7	H764 K768	H764-T766 VanDerWaalsContact C-N 3.34Å; H764-T766 PolarHBondContact O-N 3.07Å; T766-K768 PolarHBondContact O-N 3.01Å
767	K	33.9	Very low	34.6	Very low	205 Å²	205	147.8 Å²	147.8	89%	0.891	79%	0.788	S	S	*	*			trans	-60.9	133.4	-173.4	-61.6	174	-179.3	175.3	0	112.1
768	K	31.3	Very low	33.4	Very low	212 Å²	212	152.9 Å²	152.9	92%	0.922	81%	0.812	S	S	*	*			trans	-145	161	151.3	-109.6	155.4	-169.7	172.1	0	111.7	T766	T766-K768 PolarHBondContact O-N 3.01Å
769	K	30.3	Very low	32.6	Very low	203 Å²	203	153.4 Å²	153.4	88%	0.883	82%	0.816	S	S	*	*			trans	-87.7	154.5	-159.9	-64.6	175.5	177	178.6	0	112.4
770	S	27.6	Very low	32.5	Very low	116 Å²	116	150.7 Å²	150.7	81%	0.811	81%	0.814	S	S	*	*			trans	-69.4	142.2	171.6	43.1	0	0	0	0	112.6
771	V	29.1	Very low	32.6	Very low	138 Å²	138	147.3 Å²	147.3	84%	0.836	81%	0.81	S	S	*	*			trans	-136	119.7	155	179.9	0	0	0	0	105.8
772	P	35.9	Very low	33.7	Very low	127 Å²	127	146.3 Å²	146.3	83%	0.825	82%	0.819	S	S	*	*			trans	-84.4	140.1	-177	32.4	-33.1	0	0	0	111.8
773	G	31.3	Very low	35.6	Very low	75 Å²	75	142.1 Å²	142.1	77%	0.773	79%	0.792	S	S	*	*			trans	117.8	78.3	160.7	0	0	0	0	0	116.6
774	L	29.7	Very low	38.3	Very low	171 Å²	171	137.7 Å²	137.7	90%	0.895	77%	0.771	S	S	*	*			trans	-145.6	141.6	139	-151	66.1	0	0	0	111.3
775	K	28.6	Very low	41.4	Very low	190 Å²	190	129.9 Å²	129.9	83%	0.826	74%	0.735	S	S	*	*			trans	-35.8	149.7	-172.1	-60.1	174.5	177.7	-176.9	0	117.3
776	E	36.2	Very low	44.5	Very low	189 Å²	189	124.1 Å²	124.1	88%	0.883	70%	0.697	S	S	*	*			trans	-50.6	134.3	166.4	-66.9	153.3	137.1	0	0	111.1
777	A	27.8	Very low	47.8	Very low	92 Å²	92	119.5 Å²	119.5	76%	0.76	67%	0.667	S	S	*	*			trans	-108.1	79.5	-178.5	0	0	0	0	0	110.1	S779	A777-S779 PolarHBondContact O-N 2.79Å
778	D	33.9	Very low	50.9	Low	169 Å²	169	109.9 Å²	109.9	90%	0.904	63%	0.626	S	S	*	*			trans	-65.1	78.1	173.1	-93.6	-30.4	0	0	0	111.7
779	S	35.8	Very low	54	Low	105 Å²	105	101 Å²	101	73%	0.734	59%	0.59	S	S	*	*			trans	-169.4	69.1	155	65.8	0	0	0	0	112	A777 S781	A777-S779 PolarHBondContact O-N 2.79Å; S779-S781 PolarHBondContact O-N 2.99Å
780	E	39.7	Very low	57.1	Low	192 Å²	192	92.4 Å²	92.4	90%	0.897	55%	0.554	S	S	*	*			trans	-62.7	127.1	154.4	-73.1	-156	141.7	0	0	108.2	A782	E780-A782 PolarHBondContact O-N 3.34Å
781	S	45.1	Very low	60.3	Low	83 Å²	83	90.6 Å²	90.6	58%	0.58	54%	0.538	S	S	*	.			trans	-67.4	103	-176.5	57.5	0	0	0	0	110.1	S779 G783	S779-S781 PolarHBondContact O-N 2.99Å; S781-G783 PolarHBondContact O-N 3.12Å
782	A	59.9	Low	63.4	Low	101 Å²	101	89.9 Å²	89.9	84%	0.835	52%	0.521	S	S	*	.			trans	-53.2	102.6	-175.3	0	0	0	0	0	111.9	E780 Q784	E780-A782 PolarHBondContact O-N 3.34Å; A782-Q784 PolarHBondContact O-N 2.84Å
783	G	71.1	Confident	66.2	Low	15 Å²	15	86.5 Å²	86.5	16%	0.155	50%	0.498	C	S	.	.	P	Polyproline II helix	trans	-62.7	128.7	-177.3	0	0	0	0	0	111.6	K753 V754 S781 W785	K753-G783 WeakPolarHBondContact CE-O 3.12Å; V754-G783 CarbonylContact O-C 3.56Å; V754-G783 WeakPolarHBondContact O-CA 3.24Å; S781-G783 PolarHBondContact O-N 3.12Å; G783-W785 PolarHBondContact O-N 2.62Å
784	Q	88.8	Confident	69.2	Low	88 Å²	88	86.1 Å²	86.1	41%	0.411	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	123.9	-172.6	-172.4	171.8	32	0	0	110.7	L187 V754 A782 V795	L187-Q784 HydrophobicContact CD2-CB 4.43Å; V754-Q784 WeakPolarHBondContact CB-O 3.32Å; V754-Q784 PolarHBondContact N-O 3.26Å; V754-Q784 PolarHBondContact O-N 3.37Å; V754-Q784 VanDerWaalsContact O-N 3.1Å; A782-Q784 PolarHBondContact O-N 2.84Å; Q784-V795 HydrophobicContact CG-CG1 3.99Å; Q784-V795 HydrophobicContact CG-CG2 4.4Å; Q784-V795 VanDerWaalsContact NE2-CG1 3.3Å
785	W	95	Very high	72.3	Confident	4 Å²	4	82 Å²	82	2%	0.015	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	138.3	175.4	-76.3	95.4	0	0	0	111.9	L708 L733 I736 K753 G783 V796 E798 A801	L708-W785 HydrophobicContact CD2-CZ2 4.02Å; L733-W785 HydrophobicContact CD2-CH2 3.93Å; L733-W785 HydrophobicContact CD2-CZ2 4.17Å; L733-W785 HydrophobicContact CG-CH2 4.04Å; L733-W785 HydrophobicContact CG-CZ2 4.48Å; I736-W785 HydrophobicContact CD1-CH2 4.18Å; I736-W785 HydrophobicContact CD1-CZ3 4.15Å; I736-W785 HydrophobicContact CG1-CH2 4.28Å; I736-W785 HydrophobicContact CG1-CZ3 4.19Å; K753-W785 HydrophobicContact CB-CD2 3.88Å; K753-W785 HydrophobicContact CB-CE3 3.95Å; K753-W785 HydrophobicContact CB-CH2 3.96Å; K753-W785 HydrophobicContact CB-CZ2 3.87Å; K753-W785 HydrophobicContact CB-CZ3 3.98Å; K753-W785 HydrophobicContact CD-CD2 4.48Å; K753-W785 HydrophobicContact CD-CZ2 3.77Å; K753-W785 HydrophobicContact CG-CD2 4.12Å; K753-W785 HydrophobicContact CG-CG 4.43Å; K753-W785 HydrophobicContact CG-CZ2 4.17Å; G783-W785 PolarHBondContact O-N 2.62Å; W785-V796 HydrophobicContact CB-CG2 3.91Å; W785-V796 PolarHBondContact O-N 2.75Å; W785-E798 PolarHBondContact NE1-OE2 3.47Å; W785-A801 HydrophobicContact CB-CB 4.4Å; W785-A801 HydrophobicContact CD2-CB 3.67Å; W785-A801 HydrophobicContact CE3-CB 3.68Å; W785-A801 HydrophobicContact CG-CB 4.03Å; W785-A801 HydrophobicContact CZ3-CB 4.16Å
786	V	95.8	Very high	75.5	Confident	8 Å²	8	73.4 Å²	73.4	5%	0.048	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	122.3	178.5	-178.9	0	0	0	0	108.7	V190 Y751 V752 V754 V788 V793 Q794 V795	V190-V786 HydrophobicContact CB-CG1 4.15Å; V190-V786 HydrophobicContact CG1-CG1 4.23Å; V190-V786 HydrophobicContact CG2-CB 4.31Å; V190-V786 HydrophobicContact CG2-CG1 4.39Å; V190-V786 HydrophobicContact CG2-CG2 4.24Å; Y751-V786 CarbonylContact C-O 3.54Å; Y751-V786 WeakPolarHBondContact CA-O 3.4Å; V752-V786 HydrophobicContact CG2-CB 4.16Å; V752-V786 PolarHBondContact N-O 2.6Å; V752-V786 PolarHBondContact O-N 3.25Å; V754-V786 HydrophobicContact CG2-CG2 3.76Å; V786-V788 HydrophobicContact CG1-CG2 3.99Å; V786-V793 HydrophobicContact CG1-CG1 3.4Å; V786-V793 VanDerWaalsContact CG1-CG1 3.4Å; V786-Q794 CarbonylContact C-O 3.54Å; V786-Q794 WeakPolarHBondContact CA-O 3.38Å; V786-V795 HydrophobicContact CG2-CG2 4.39Å
787	H	97.6	Very high	78.3	Confident	27 Å²	27	68.2 Å²	68.2	13%	0.125	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.9	167	-179.6	-124.8	0	0	0	109.3	E738 T749 A750 Y751 Q794 V796 R800	E738-H787 IonicContact OE2-NE2 2.7Å; T749-H787 WeakPolarHBondContact CB-NE2 3.07Å; T749-H787 WeakPolarHBondContact CG2-NE2 3.32Å; T749-H787 PolarHBondContact OG1-NE2 3.4Å; A750-H787 CarbonylContact O-C 3.38Å; A750-H787 WeakPolarHBondContact O-CA 3.45Å; A750-H787 PolarHBondContact O-CD2 3.2Å; A750-H787 VanDerWaalsContact O-CD2 3.28Å; Y751-H787 HydrophobicContact CD1-CB 3.85Å; Y751-H787 AromaticContact CD1-CD2 3.75Å; Y751-H787 HydrophobicContact CE1-CB 3.79Å; Y751-H787 AromaticContact CE1-CD2 3.35Å; Y751-H787 WeakPolarHBondContact CE1-CD2 3.47Å; Y751-H787 AromaticContact CE1-CG 3.73Å; Y751-H787 AromaticContact CE2-CD2 3.69Å; Y751-H787 AromaticContact CE2-NE2 3.93Å; Y751-H787 AromaticContact CZ-CD2 3.31Å; Y751-H787 AromaticContact CZ-NE2 3.86Å; H787-Q794 PolarHBondContact N-O 3.34Å; H787-Q794 PolarHBondContact O-N 3.45Å; H787-V796 HydrophobicContact CB-CG1 3.69Å; H787-V796 HydrophobicContact CB-CG2 4.21Å; H787-R800 PolarHBondContact ND1-NH2 2.95Å; H787-R800 VanDerWaalsContact ND1-NH2 3.19Å
788	V	97.4	Very high	81.5	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.018	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	125.5	177.3	-169.1	0	0	0	0	110.6	V190 Q207 T749 A750 V786 D790 Y792 V793	V190-V788 HydrophobicContact CG1-CG2 3.68Å; Q207-V788 HydrophobicContact CG-CB 4.1Å; Q207-V788 HydrophobicContact CG-CG1 4.07Å; Q207-V788 HydrophobicContact CG-CG2 4.4Å; T749-V788 WeakPolarHBondContact CB-O 3.34Å; A750-V788 PolarHBondContact N-O 3.36Å; A750-V788 PolarHBondContact O-N 3.46Å; V786-V788 HydrophobicContact CG1-CG2 3.99Å; V788-D790 WeakPolarHBondContact CG1-O 3.41Å; V788-Y792 CarbonylContact C-O 3.6Å; V788-Y792 WeakPolarHBondContact CA-O 3.12Å; V788-V793 HydrophobicContact CG1-CG2 4.14Å; V788-V793 HydrophobicContact CG2-CG1 4.44Å; V788-V793 HydrophobicContact CG2-CG2 4.44Å
789	S	97.1	Very high	84.4	Confident	26 Å²	26	63.2 Å²	63.2	18%	0.182	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	94	173.9	173.6	0	0	0	0	108.1	H747 T791 Y792	H747-S789 PolarHBondContact NE2-OG 2.63Å; S789-T791 PolarHBondContact O-N 3.39Å; S789-T791 VanDerWaalsContact O-N 3.12Å; S789-Y792 PolarHBondContact N-O 3.29Å; S789-Y792 WeakPolarHBondContact O-CB 3.36Å; S789-Y792 PolarHBondContact O-N 2.94Å
790	D	96.1	Very high	87.2	Confident	21 Å²	21	62.2 Å²	62.2	11%	0.112	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	50.3	-113	-171.2	-61.1	-35.8	0	0	0	111.8	G192 I193 N195 C200 N203 H747 V788 Y792	G192-D790 CarbonylContact C-O 3.59Å; G192-D790 WeakPolarHBondContact CA-O 3.4Å; I193-D790 PolarHBondContact N-O 2.77Å; I193-D790 CarbonylContact O-C 3.59Å; I193-D790 VanDerWaalsContact O-CA 3.24Å; I193-D790 WeakPolarHBondContact O-CA 3.26Å; I193-D790 WeakPolarHBondContact O-CB 2.77Å; N195-D790 HydrophobicContact CB-CB 4.06Å; N195-D790 WeakPolarHBondContact CB-OD2 3.15Å; N195-D790 PolarHBondContact ND2-OD2 3.46Å; C200-D790 WeakPolarHBondContact CA-OD1 3.35Å; N203-D790 WeakPolarHBondContact CB-OD1 3.34Å; N203-D790 PolarHBondContact ND2-OD1 3.47Å; H747-D790 IonicContact CE1-OD2 3.36Å; H747-D790 PolarHBondContact CE1-OD2 3.02Å; V788-D790 WeakPolarHBondContact CG1-O 3.41Å; D790-Y792 VanDerWaalsContact C-N 3.33Å
791	T	94.8	Very high	89.9	Confident	79 Å²	79	53 Å²	53	49%	0.485	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	-19.9	-179.4	57.4	0	0	0	0	113.4	I193 P270 S789	I193-T791 PolarHBondContact O-N 2.95Å; P270-T791 HydrophobicContact CB-CG2 3.77Å; P270-T791 HydrophobicContact CG-CG2 3.84Å; S789-T791 PolarHBondContact O-N 3.39Å; S789-T791 VanDerWaalsContact O-N 3.12Å
792	Y	94.3	Very high	92.4	Very high	123 Å²	123	51.4 Å²	51.4	48%	0.482	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	121.9	-178	-177.1	-99.5	0	0	0	111.1	V788 S789 D790 Q794	V788-Y792 CarbonylContact C-O 3.6Å; V788-Y792 WeakPolarHBondContact CA-O 3.12Å; S789-Y792 PolarHBondContact N-O 3.29Å; S789-Y792 WeakPolarHBondContact O-CB 3.36Å; S789-Y792 PolarHBondContact O-N 2.94Å; D790-Y792 VanDerWaalsContact C-N 3.33Å; Y792-Q794 HydrophobicContact CD1-CB 4.43Å; Y792-Q794 HydrophobicContact CE1-CB 3.6Å; Y792-Q794 HydrophobicContact CE1-CG 4.4Å; Y792-Q794 VanDerWaalsContact OH-CD 3.27Å; Y792-Q794 PolarHBondContact OH-NE2 2.95Å
793	V	94.3	Very high	94.1	Very high	56 Å²	56	50.1 Å²	50.1	34%	0.339	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	126.7	178.8	-177.6	0	0	0	0	108.9	V190 V786 V788	V190-V793 HydrophobicContact CB-CG1 4.4Å; V190-V793 HydrophobicContact CG1-CG1 4.42Å; V786-V793 HydrophobicContact CG1-CG1 3.4Å; V786-V793 VanDerWaalsContact CG1-CG1 3.4Å; V788-V793 HydrophobicContact CG1-CG2 4.14Å; V788-V793 HydrophobicContact CG2-CG1 4.44Å; V788-V793 HydrophobicContact CG2-CG2 4.44Å
794	Q	94.1	Very high	95.2	Very high	66 Å²	66	49.5 Å²	49.5	31%	0.308	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	127	-179.7	-171.9	-178.2	38.2	0	0	111.4	V786 H787 Y792 V796	V786-Q794 CarbonylContact C-O 3.54Å; V786-Q794 WeakPolarHBondContact CA-O 3.38Å; H787-Q794 PolarHBondContact N-O 3.34Å; H787-Q794 PolarHBondContact O-N 3.45Å; Y792-Q794 HydrophobicContact CD1-CB 4.43Å; Y792-Q794 HydrophobicContact CE1-CB 3.6Å; Y792-Q794 HydrophobicContact CE1-CG 4.4Å; Y792-Q794 VanDerWaalsContact OH-CD 3.27Å; Y792-Q794 PolarHBondContact OH-NE2 2.95Å; Q794-V796 HydrophobicContact CG-CG1 4.36Å; Q794-V796 PolarHBondContact O-N 2.63Å
795	V	94.8	Very high	95.5	Very high	85 Å²	85	48.2 Å²	48.2	52%	0.515	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	130.6	165.7	168.8	0	0	0	0	109.4	Q784 V786	Q784-V795 HydrophobicContact CG-CG1 3.99Å; Q784-V795 HydrophobicContact CG-CG2 4.4Å; Q784-V795 VanDerWaalsContact NE2-CG1 3.3Å; V786-V795 HydrophobicContact CG2-CG2 4.39Å
796	V	95.2	Very high	95.6	Very high	9 Å²	9	48 Å²	48	6%	0.055	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	152.5	-179	-64.7	0	0	0	0	111.5	Y751 W785 H787 Q794 R800	Y751-V796 HydrophobicContact CD1-CG2 4.1Å; Y751-V796 HydrophobicContact CE1-CG2 4.48Å; W785-V796 HydrophobicContact CB-CG2 3.91Å; W785-V796 PolarHBondContact O-N 2.75Å; H787-V796 HydrophobicContact CB-CG1 3.69Å; H787-V796 HydrophobicContact CB-CG2 4.21Å; Q794-V796 HydrophobicContact CG-CG1 4.36Å; Q794-V796 PolarHBondContact O-N 2.63Å; V796-R800 HydrophobicContact CB-CB 4.37Å
797	P	94.8	Very high	95.7	Very high	81 Å²	81	47.8 Å²	47.8	53%	0.526	26%	0.26	S	S	.	.			trans	-67.3	150.3	170.1	29.8	-35.2	0	0	0	110.6	S799 R800 A801	P797-S799 PolarHBondContact O-N 2.94Å; P797-R800 HydrophobicContact CG-CB 4.04Å; P797-R800 WeakPolarHBondContact O-CB 3.46Å; P797-R800 PolarHBondContact O-N 3.49Å; P797-A801 PolarHBondContact O-N 3.43Å
798	E	95.4	Very high	95.8	Very high	69 Å²	69	46.5 Å²	46.5	32%	0.322	25%	0.254	S	S	.	.	H	α-helix	trans	-55.7	-36.7	179.5	-177.6	154	69.9	0	0	112.7	L708 K753 W785 R800 A801 L802	L708-E798 HydrophobicContact CD1-CG 4.08Å; L708-E798 WeakPolarHBondContact CD1-OE1 3.44Å; L708-E798 HydrophobicContact CD2-CG 3.96Å; L708-E798 VanDerWaalsContact CD2-OE2 3.23Å; L708-E798 WeakPolarHBondContact CD2-OE2 3.38Å; K753-E798 IonicContact NZ-OE2 3Å; K753-E798 PolarHBondContact NZ-OE2 3.23Å; W785-E798 PolarHBondContact NE1-OE2 3.47Å; E798-R800 VanDerWaalsContact C-N 3.26Å; E798-R800 PolarHBondContact O-N 2.69Å; E798-A801 PolarHBondContact O-N 2.9Å; E798-A801 VanDerWaalsContact O-N 3.14Å; E798-L802 HydrophobicContact CG-CD1 4.08Å; E798-L802 HydrophobicContact CG-CG 4.29Å; E798-L802 WeakPolarHBondContact O-CG 3.46Å; E798-L802 PolarHBondContact O-N 2.95Å
799	S	95	Very high	95.9	Very high	86 Å²	86	46.3 Å²	46.3	60%	0.601	25%	0.254	S	S	*	.	H	α-helix	trans	-59.6	-30.9	174.6	53.6	0	0	0	0	114	P797 S803	P797-S799 PolarHBondContact O-N 2.94Å; S799-S803 WeakPolarHBondContact O-CB 3.37Å; S799-S803 PolarHBondContact O-N 3.23Å; S799-S803 PolarHBondContact O-OG 3.24Å
800	R	95.8	Very high	95.9	Very high	84 Å²	84	45.1 Å²	45.1	32%	0.317	25%	0.245	S	C	.	.	H	α-helix	trans	-72.9	-41.9	174.7	179	172.2	165.3	-159.2	-11.7	111.1	Y751 H787 V796 P797 E798 S803	Y751-R800 HydrophobicContact CE1-CG 4.32Å; H787-R800 PolarHBondContact ND1-NH2 2.95Å; H787-R800 VanDerWaalsContact ND1-NH2 3.19Å; V796-R800 HydrophobicContact CB-CB 4.37Å; P797-R800 HydrophobicContact CG-CB 4.04Å; P797-R800 WeakPolarHBondContact O-CB 3.46Å; P797-R800 PolarHBondContact O-N 3.49Å; E798-R800 VanDerWaalsContact C-N 3.26Å; E798-R800 PolarHBondContact O-N 2.69Å; R800-S803 WeakPolarHBondContact CA-OG 3.33Å; R800-S803 PolarHBondContact O-N 2.81Å; R800-S803 PolarHBondContact O-OG 3.42Å
801	A	96	Very high	96	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63	-43.7	175.1	0	0	0	0	0	111.5	F706 I736 Y751 W785 P797 E798 S803 A804	F706-A801 WeakPolarHBondContact CZ-O 3.26Å; I736-A801 HydrophobicContact CD1-CB 4.2Å; I736-A801 VanDerWaalsContact CD1-O 3.25Å; I736-A801 WeakPolarHBondContact CD1-O 3.21Å; Y751-A801 HydrophobicContact CD1-CB 3.95Å; Y751-A801 HydrophobicContact CG-CB 4.22Å; W785-A801 HydrophobicContact CB-CB 4.4Å; W785-A801 HydrophobicContact CD2-CB 3.67Å; W785-A801 HydrophobicContact CE3-CB 3.68Å; W785-A801 HydrophobicContact CG-CB 4.03Å; W785-A801 HydrophobicContact CZ3-CB 4.16Å; P797-A801 PolarHBondContact O-N 3.43Å; E798-A801 PolarHBondContact O-N 2.9Å; E798-A801 VanDerWaalsContact O-N 3.14Å; A801-S803 VanDerWaalsContact C-N 3.3Å; A801-S803 PolarHBondContact O-N 3.24Å; A801-A804 VanDerWaalsContact O-CB 3.28Å; A801-A804 WeakPolarHBondContact O-CB 3.45Å; A801-A804 PolarHBondContact O-N 2.81Å
802	L	96.4	Very high	96	Very high	49 Å²	49	41.7 Å²	41.7	26%	0.257	22%	0.223	S	C	.	.	H	α-helix	trans	-66	-27.3	175.7	-67.7	179.7	0	0	0	113.6	H703 F706 L708 L733 E798 A804	H703-L802 PolarHBondContact CE1-O 2.92Å; F706-L802 HydrophobicContact CD2-CD2 3.91Å; F706-L802 HydrophobicContact CE2-CD2 3.8Å; F706-L802 VanDerWaalsContact CZ-O 3.3Å; F706-L802 WeakPolarHBondContact CZ-O 3.3Å; L708-L802 HydrophobicContact CD1-CD1 4.24Å; L708-L802 HydrophobicContact CD2-CD1 4.23Å; L708-L802 HydrophobicContact CD2-CD2 3.77Å; L708-L802 HydrophobicContact CD2-CG 4.26Å; L708-L802 HydrophobicContact CG-CD1 4.07Å; L708-L802 HydrophobicContact CG-CD2 4.11Å; L733-L802 HydrophobicContact CD2-CD2 4.22Å; E798-L802 HydrophobicContact CG-CD1 4.08Å; E798-L802 HydrophobicContact CG-CG 4.29Å; E798-L802 WeakPolarHBondContact O-CG 3.46Å; E798-L802 PolarHBondContact O-N 2.95Å; L802-A804 VanDerWaalsContact C-N 3.29Å; L802-A804 PolarHBondContact O-N 3.44Å
803	S	95.8	Very high	95.9	Very high	73 Å²	73	38.9 Å²	38.9	51%	0.51	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-6.4	176.8	69.7	0	0	0	0	115.2	H703 S799 R800 A801	H703-S803 PolarHBondContact ND1-O 3.23Å; S799-S803 WeakPolarHBondContact O-CB 3.37Å; S799-S803 PolarHBondContact O-N 3.23Å; S799-S803 PolarHBondContact O-OG 3.24Å; R800-S803 WeakPolarHBondContact CA-OG 3.33Å; R800-S803 PolarHBondContact O-N 2.81Å; R800-S803 PolarHBondContact O-OG 3.42Å; A801-S803 VanDerWaalsContact C-N 3.3Å; A801-S803 PolarHBondContact O-N 3.24Å
804	A	95.8	Very high	95.6	Very high	2 Å²	2	39.7 Å²	39.7	2%	0.017	22%	0.216	C	C	.	.	S	Bend	trans	-63.4	152.2	-171.9	0	0	0	0	0	113.6	H703 F706 E738 Y751 A801 L802 A806	H703-A804 PolarHBondContact CE1-O 3.14Å; H703-A804 PolarHBondContact ND1-O 3.39Å; F706-A804 HydrophobicContact CZ-CB 4.49Å; E738-A804 HydrophobicContact CB-CB 4.45Å; E738-A804 WeakPolarHBondContact OE1-CA 3.42Å; Y751-A804 HydrophobicContact CD2-CB 4.13Å; Y751-A804 HydrophobicContact CE2-CB 3.67Å; A801-A804 VanDerWaalsContact O-CB 3.28Å; A801-A804 WeakPolarHBondContact O-CB 3.45Å; A801-A804 PolarHBondContact O-N 2.81Å; L802-A804 VanDerWaalsContact C-N 3.29Å; L802-A804 PolarHBondContact O-N 3.44Å; A804-A806 PolarHBondContact O-N 3.35Å
805	Q	94.8	Very high	94.4	Very high	61 Å²	61	43.7 Å²	43.7	29%	0.285	24%	0.239	S	C	.	.			trans	-77.6	62	166.8	-65.2	-170.7	2.9	0	0	110.4	N701 E738 Y807	N701-Q805 PolarHBondContact OD1-OE1 3.24Å; E738-Q805 HydrophobicContact CG-CB 4.42Å; E738-Q805 PolarHBondContact OE1-N 3.39Å; Q805-Y807 PolarHBondContact O-N 3.45Å
806	A	97.3	Very high	94.3	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-51.4	129.8	-177.1	0	0	0	0	0	111.7	L687 R689 F706 I736 A804 L809	L687-A806 HydrophobicContact CD1-CB 4.45Å; R689-A806 VanDerWaalsContact CZ-O 3.24Å; R689-A806 PolarHBondContact NE-O 3.42Å; R689-A806 PolarHBondContact NH2-O 3.2Å; F706-A806 HydrophobicContact CD1-CB 3.98Å; F706-A806 HydrophobicContact CE1-CB 3.45Å; F706-A806 VanDerWaalsContact CE1-CB 3.45Å; F706-A806 HydrophobicContact CZ-CB 3.96Å; I736-A806 HydrophobicContact CG2-CB 3.63Å; A804-A806 PolarHBondContact O-N 3.35Å; A806-L809 HydrophobicContact CB-CD2 3.66Å; A806-L809 HydrophobicContact CB-CG 4.02Å
807	Y	98.1	Very high	94.3	Very high	3 Å²	3	43.4 Å²	43.4	1%	0.012	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	-48.4	177	177.6	-110.8	0	0	0	110.1	D294 S295 Q296 H686 L687 R689 F690 V737 H739 Y748 Q805	D294-Y807 PolarHBondContact OD1-OH 2.97Å; D294-Y807 PolarHBondContact OD2-OH 2.98Å; S295-Y807 VanDerWaalsContact OG-CD1 3.3Å; S295-Y807 WeakPolarHBondContact OG-CD1 3.48Å; S295-Y807 VanDerWaalsContact OG-CE1 3.27Å; S295-Y807 WeakPolarHBondContact OG-CE1 3.37Å; Q296-Y807 HydrophobicContact CB-CE1 4.32Å; H686-Y807 AromaticContact CD2-CE2 3.41Å; H686-Y807 VanDerWaalsContact CD2-CE2 3.41Å; H686-Y807 WeakPolarHBondContact CD2-CE2 3.32Å; H686-Y807 AromaticContact CD2-CZ 3.52Å; H686-Y807 PolarHBondContact CD2-OH 3.34Å; H686-Y807 AromaticContact NE2-CE2 3.21Å; H686-Y807 WeakPolarHBondContact NE2-CE2 3.38Å; H686-Y807 AromaticContact NE2-CZ 3.41Å; H686-Y807 PolarHBondContact NE2-OH 3Å; L687-Y807 PolarHBondContact N-O 2.89Å; R689-Y807 HydrophobicContact CB-CD2 4.38Å; R689-Y807 HydrophobicContact CG-CD2 4.46Å; F690-Y807 AromaticContact CD2-CE2 3.96Å; F690-Y807 HydrophobicContact CD2-CE2 3.96Å; F690-Y807 HydrophobicContact CE2-CD2 4.33Å; F690-Y807 AromaticContact CE2-CE2 3.67Å; F690-Y807 HydrophobicContact CE2-CE2 3.67Å; F690-Y807 AromaticContact CE2-CZ 3.96Å; F690-Y807 HydrophobicContact CZ-CE2 4.5Å; V737-Y807 PolarHBondContact O-N 3.13Å; H739-Y807 HydrophobicContact CB-CG 4.39Å; Y748-Y807 AromaticContact CE1-CD1 3.8Å; Y748-Y807 HydrophobicContact CE1-CD1 3.8Å; Y748-Y807 HydrophobicContact CE1-CE1 4.23Å; Y748-Y807 HydrophobicContact CE1-CG 4.49Å; Q805-Y807 PolarHBondContact O-N 3.45Å
808	L	98.6	Very high	94.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	143.7	164.7	-53.2	179.3	0	0	0	109.9	V205 Q296 L299 L685 H686 I736 V737 F810	V205-L808 HydrophobicContact CG2-CD1 4.37Å; Q296-L808 HydrophobicContact CB-CD2 4.15Å; Q296-L808 HydrophobicContact CG-CD2 4.3Å; L299-L808 HydrophobicContact CD2-CD1 4.16Å; L685-L808 CarbonylContact O-C 3.59Å; L685-L808 WeakPolarHBondContact O-CA 3.38Å; H686-L808 HydrophobicContact CB-CD2 3.65Å; I736-L808 WeakPolarHBondContact CA-O 3.48Å; V737-L808 HydrophobicContact CB-CB 3.97Å; V737-L808 HydrophobicContact CB-CG 4.32Å; V737-L808 HydrophobicContact CG2-CB 4.19Å; V737-L808 HydrophobicContact CG2-CD1 4.27Å; V737-L808 PolarHBondContact N-O 3.5Å; V737-L808 PolarHBondContact O-N 2.92Å; L808-F810 HydrophobicContact CB-CE2 3.94Å; L808-F810 HydrophobicContact CD1-CE2 4.33Å
809	L	98.8	Very high	94.2	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	132.9	172.6	-66.6	164.8	0	0	0	109.4	V621 I684 L685 L687 F706 L733 I736 A806 Y811	V621-L809 HydrophobicContact CG2-CD1 3.67Å; I684-L809 WeakPolarHBondContact CA-O 3.33Å; L685-L809 HydrophobicContact CB-CB 4.36Å; L685-L809 PolarHBondContact N-O 2.66Å; L685-L809 PolarHBondContact O-N 3.46Å; L687-L809 HydrophobicContact CD1-CD1 4.28Å; F706-L809 HydrophobicContact CB-CD1 3.77Å; F706-L809 HydrophobicContact CB-CD2 4.35Å; F706-L809 HydrophobicContact CD1-CD1 4.13Å; F706-L809 HydrophobicContact CD1-CD2 4.03Å; F706-L809 HydrophobicContact CD2-CD2 3.81Å; F706-L809 HydrophobicContact CE1-CD2 4.31Å; F706-L809 HydrophobicContact CE2-CD2 4.05Å; F706-L809 HydrophobicContact CG-CD1 3.98Å; F706-L809 HydrophobicContact CG-CD2 3.8Å; F706-L809 HydrophobicContact CZ-CD2 4.31Å; L733-L809 HydrophobicContact CD1-CB 4.23Å; L733-L809 HydrophobicContact CD1-CD2 3.88Å; I736-L809 HydrophobicContact CB-CD2 4.5Å; I736-L809 HydrophobicContact CG1-CD2 4.08Å; I736-L809 HydrophobicContact CG2-CD2 4.09Å; A806-L809 HydrophobicContact CB-CD2 3.66Å; A806-L809 HydrophobicContact CB-CG 4.02Å; L809-Y811 HydrophobicContact CB-CD2 4.17Å; L809-Y811 HydrophobicContact CB-CE2 3.8Å; L809-Y811 HydrophobicContact CD1-CE2 4.3Å
810	F	98.5	Very high	94.1	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	118.7	-179.8	-69.3	-106.2	0	0	0	109.9	N208 L209 L299 I684 Y734 G735 V737 L808	N208-F810 HydrophobicContact CB-CD1 4.18Å; N208-F810 HydrophobicContact CB-CD2 3.7Å; N208-F810 HydrophobicContact CB-CE1 4.13Å; N208-F810 HydrophobicContact CB-CE2 3.67Å; N208-F810 HydrophobicContact CB-CG 3.98Å; N208-F810 HydrophobicContact CB-CZ 3.89Å; L209-F810 HydrophobicContact CD2-CE1 4.21Å; L299-F810 HydrophobicContact CD2-CZ 4.25Å; I684-F810 HydrophobicContact CD1-CD1 3.99Å; I684-F810 HydrophobicContact CD1-CE1 3.59Å; I684-F810 HydrophobicContact CD1-CZ 4.34Å; I684-F810 HydrophobicContact CG1-CD1 3.98Å; I684-F810 HydrophobicContact CG1-CE1 4.06Å; I684-F810 HydrophobicContact CG2-CZ 4.5Å; Y734-F810 HydrophobicContact CD1-CB 4.46Å; Y734-F810 VanDerWaalsContact CD1-O 3.29Å; Y734-F810 WeakPolarHBondContact CD1-O 3.42Å; Y734-F810 HydrophobicContact CE1-CB 3.9Å; Y734-F810 HydrophobicContact CE2-CB 4.17Å; Y734-F810 PolarHBondContact N-O 3Å; G735-F810 PolarHBondContact N-O 3.25Å; G735-F810 PolarHBondContact O-N 3.06Å; V737-F810 HydrophobicContact CG2-CE2 4.14Å; L808-F810 HydrophobicContact CB-CE2 3.94Å; L808-F810 HydrophobicContact CD1-CE2 4.33Å
811	Y	97.4	Very high	94	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	129.6	-175.8	-80.7	-86.4	0	0	0	110.1	V682 L683 L685 P707 L710 G732 L733 L809	V682-Y811 CarbonylContact C-O 3.55Å; V682-Y811 VanDerWaalsContact CA-O 3.32Å; V682-Y811 WeakPolarHBondContact CA-O 3.46Å; L683-Y811 PolarHBondContact N-O 3.3Å; L683-Y811 PolarHBondContact O-N 3.25Å; L685-Y811 HydrophobicContact CD1-CD2 4.24Å; L685-Y811 HydrophobicContact CD1-CE2 4Å; P707-Y811 WeakPolarHBondContact O-CE1 3.36Å; P707-Y811 PolarHBondContact O-OH 3.13Å; L710-Y811 HydrophobicContact CB-CD1 4.08Å; L710-Y811 HydrophobicContact CB-CE1 3.63Å; L710-Y811 HydrophobicContact CD2-CE1 4.34Å; L710-Y811 HydrophobicContact CD2-CE2 4.32Å; G732-Y811 WeakPolarHBondContact O-CA 3.37Å; L733-Y811 HydrophobicContact CB-CD1 3.98Å; L733-Y811 HydrophobicContact CB-CE1 3.65Å; L733-Y811 HydrophobicContact CD1-CD1 4.24Å; L733-Y811 HydrophobicContact CD1-CD2 4.01Å; L733-Y811 HydrophobicContact CD1-CE1 3.92Å; L733-Y811 HydrophobicContact CD1-CE2 3.67Å; L733-Y811 HydrophobicContact CD1-CG 4.28Å; L733-Y811 HydrophobicContact CG-CE1 4.36Å; L809-Y811 HydrophobicContact CB-CD2 4.17Å; L809-Y811 HydrophobicContact CB-CE2 3.8Å; L809-Y811 HydrophobicContact CD1-CE2 4.3Å
812	E	95.1	Very high	93.9	Very high	28 Å²	28	36 Å²	36	13%	0.131	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	136.3	176.3	-165.2	171.7	-120.1	0	0	109.4	V682 Y731 G732 Y734 R755	V682-E812 HydrophobicContact CG2-CG 4.36Å; Y731-E812 WeakPolarHBondContact CA-O 3.43Å; G732-E812 PolarHBondContact N-O 3.37Å; G732-E812 PolarHBondContact O-N 3.33Å; Y734-E812 HydrophobicContact CD1-CB 3.7Å; Y734-E812 HydrophobicContact CE1-CB 3.68Å; R755-E812 IonicContact CZ-OE2 3.35Å; R755-E812 IonicContact NH1-OE2 2.77Å; R755-E812 PolarHBondContact NH1-OE2 3.08Å; R755-E812 IonicContact NH2-OE1 3.23Å; R755-E812 IonicContact NH2-OE2 3.64Å; R755-E812 PolarHBondContact NH2-OE2 3.16Å
813	R	92.6	Very high	93.7	Very high	64 Å²	64	35 Å²	35	24%	0.242	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	135.4	-178.1	-177.8	173.6	170.4	164	0.6	111	A681 N722 Y731 L815	A681-R813 WeakPolarHBondContact O-CB 3.46Å; A681-R813 PolarHBondContact O-N 2.91Å; N722-R813 VanDerWaalsContact O-CZ 3.27Å; N722-R813 PolarHBondContact O-NH1 2.83Å; N722-R813 PolarHBondContact O-NH2 2.77Å; Y731-R813 HydrophobicContact CD1-CB 4.08Å; Y731-R813 HydrophobicContact CE1-CB 3.59Å; Y731-R813 HydrophobicContact CE1-CG 4.35Å; R813-L815 HydrophobicContact CG-CD2 4.09Å
814	V	88.3	Confident	93.5	Very high	74 Å²	74	31.8 Å²	31.8	45%	0.448	16%	0.16	S	C	.	.			trans	-88.1	137.8	169.8	-176.9	0	0	0	0	109.7	M709 L730	M709-V814 HydrophobicContact CE-CG2 3.88Å; M709-V814 HydrophobicContact SD-CG2 4.46Å; L730-V814 HydrophobicContact CB-CB 4.29Å; L730-V814 PolarHBondContact O-N 3.28Å
815	L	67.4	Low	93.3	Very high	150 Å²	150	34.5 Å²	34.5	79%	0.785	17%	0.173	S	C	*	.			trans	-127	0	-174.8	-60.4	177	0	0	0	111.5	L761 R813	L761-L815 HydrophobicContact CD1-CD1 3.69Å; R813-L815 HydrophobicContact CG-CD2 4.09Å

Retrieved 815 of 815 residues in 1016 ms (Link to these results)

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