A0A077ZER2_TRITR Loading...

Chloride channel protein 2

AlphaFold DB , UniProt , Accession A0A077ZER2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 852 aa.

						>A0A077ZER2_TRITR|A0A077ZER2
MPEKQQPKALPSCAADRNVKHDTVNRVLSLNKKAADVCAGTTAKHLTKLLVDNIRSIFSQDWLILIALGVSVAVLSFSMDLLIGKLTEVRNWLYRLAAGVHLAAGIFTWIALVSGMTLASVVVSHYISPPAIGSGIPEIKTILRGVVLKEYLSFMTLVSKTLGLTISLSSGLPIGKEGPMVHIGSIVASVICKSFGYIAQLNENRNRQAEMIAAGCAVGVACTFGAPIGGVLFSIEVTSVHFALRNYWRGFFSAVFSAIVYGFLVMLLHSRETVSAYCPTAFSFDTPLKAKQLIFYAALGRYTLPLIVSVLVAIVTLPNYGGKVTHSLLTSNALLEQLFSNFTWGSTNSSDYDARIVETWTPVALSFYSTLFFLTAICITLPIPSGLFTPVLLAGAALGRLLGECLAQWLPTVNDDIVVIPGSYAVVGAAAFTGAVTQTVSTAMIIFELTGQIVHMVPVLLGVALANLIATYLYPSVYDIGIHCKKLPYLPNLLPTSSAVHRILVRDFMIADVKYLTLSSTYKDIRVLLDTFKRVRTFPLVNNEVSKILIGEISRAELIKLLSSKLLIVERKEKRKKWRRKRLSSKNVIPKKNRQKSHSVTKETIYELTKAAVQVAMLNESLPKRASSAPKRSGRKNKSEIQLFHYYLFNRIVSANLRLNPKVLLKQHFQMEMEAERSPTQLQQQQESEIQQLNDVPDYKSIALDSAPFQLVECSSLFKAHAVFSLLNLQRAYVTSRGRLIGLVTLQKLREAVEHVRLYSGPESGHISSSDTTWVCDYNDSYTVFTNTEALPKAPESSDKQSSACRFSFTGKHPRTAPVRRSTSALDAEHPKETKIELQHTVSYSPSMEDKL
					

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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	34.3	Very low	36.7	Very low	194 Å²	194	161.4 Å²	161.4	96%	0.956	85%	0.849	S	S	*	*				0	174.2	0	-71.1	178	172.4	0	0	109.7	E3	M1-E3 HydrophobicContact CB-CB 4.12Å; M1-E3 HydrophobicContact CB-CG 4.49Å; M1-E3 PolarHBondContact O-N 3.33Å
2	P	40.8	Very low	36.5	Very low	138 Å²	138	156.9 Å²	156.9	90%	0.896	84%	0.841	S	S	*	*			trans	-68.5	101.5	139	31.2	-29.3	0	0	0	107.4
3	E	36.5	Very low	36.3	Very low	152 Å²	152	154 Å²	154	71%	0.71	84%	0.838	S	S	*	*			trans	-104.1	111	-165.7	-155.6	145.6	171	0	0	112.5	M1	M1-E3 HydrophobicContact CB-CB 4.12Å; M1-E3 HydrophobicContact CB-CG 4.49Å; M1-E3 PolarHBondContact O-N 3.33Å
4	K	36.8	Very low	36.2	Very low	197 Å²	197	150.4 Å²	150.4	86%	0.857	84%	0.839	S	S	*	*			trans	-76.5	115	161.1	-72.3	177.3	175.4	178.6	0	108.2
5	Q	38	Very low	36.3	Very low	186 Å²	186	146.7 Å²	146.7	87%	0.869	84%	0.836	S	S	*	*			trans	-161.1	162	132.4	-109.6	162.7	14.8	0	0	112.6
6	Q	34.9	Very low	36.4	Very low	186 Å²	186	146.3 Å²	146.3	87%	0.869	83%	0.831	S	S	*	*			trans	-89.9	168.1	-150.6	-84.8	165.9	-44.9	0	0	115
7	P	38.4	Very low	36.4	Very low	121 Å²	121	150.1 Å²	150.1	79%	0.786	83%	0.829	S	S	*	*			trans	-90.7	166.6	-165.2	36.4	-37.3	0	0	0	115
8	K	37	Very low	36.9	Very low	215 Å²	215	150.9 Å²	150.9	94%	0.935	83%	0.831	S	S	*	*			trans	-109.1	152.5	152.7	-71	-176.8	175.8	-178.9	0	108.9
9	A	36.3	Very low	37.4	Very low	91 Å²	91	149 Å²	149	75%	0.752	82%	0.824	S	S	*	*			trans	-111.5	174	-160.5	0	0	0	0	0	115.5
10	L	33.8	Very low	37.8	Very low	166 Å²	166	150.3 Å²	150.3	87%	0.869	82%	0.821	S	S	*	*			trans	89.5	149.9	164.7	-58.3	161.7	0	0	0	117.7
11	P	36.8	Very low	38.3	Very low	129 Å²	129	150.9 Å²	150.9	84%	0.838	82%	0.818	S	S	*	*			cis	-116.2	-156.8	-9.8	37.7	-21.2	0	0	0	113.2
12	S	34.2	Very low	39.2	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	80%	0.8	S	S	*	*			trans	-127.7	-175.1	-162	59.8	0	0	0	0	116.2
13	C	34	Very low	39.8	Very low	119 Å²	119	144.2 Å²	144.2	80%	0.804	78%	0.781	S	S	*	*			trans	83.9	126.3	-177.1	-52.9	0	0	0	0	115.1
14	A	35.6	Very low	40.7	Very low	103 Å²	103	140.9 Å²	140.9	85%	0.851	77%	0.772	S	S	*	*			cis	82.2	132.4	40	0	0	0	0	0	113.5
15	A	37	Very low	41.7	Very low	96 Å²	96	136.4 Å²	136.4	79%	0.793	76%	0.757	S	S	*	*			cis	-127.9	-165	0.2	0	0	0	0	0	110.9
16	D	37.9	Very low	42.6	Very low	140 Å²	140	135.5 Å²	135.5	75%	0.749	75%	0.746	S	S	*	*			cis	-162.8	-179.2	48.7	-166.9	11.4	0	0	0	112.7
17	R	36.1	Very low	43.8	Very low	211 Å²	211	130.4 Å²	130.4	80%	0.796	73%	0.727	S	S	*	*			trans	-106.8	-9.9	-142.9	-61	-177.9	-178	-166.9	1.3	119.8	V19	R17-V19 VanDerWaalsContact C-N 3.31Å; R17-V19 PolarHBondContact O-N 3.4Å
18	N	46.2	Very low	44.7	Very low	164 Å²	164	130 Å²	130	88%	0.877	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	12.6	-161.2	-80.9	-17.3	0	0	0	119
19	V	47	Very low	46.1	Very low	115 Å²	115	122.7 Å²	122.7	70%	0.697	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	-12	-170.2	-176.6	0	0	0	0	114.6	R17 H21	R17-V19 VanDerWaalsContact C-N 3.31Å; R17-V19 PolarHBondContact O-N 3.4Å; V19-H21 PolarHBondContact O-N 3.37Å
20	K	43.8	Very low	47.3	Very low	174 Å²	174	123.7 Å²	123.7	76%	0.757	69%	0.685	S	S	*	*	H	α-helix	trans	-73.2	-28.3	-162.6	-72.1	-170	174.6	-176	0	117.2
21	H	49.1	Very low	48.3	Very low	163 Å²	163	121 Å²	121	76%	0.755	67%	0.672	S	S	*	*	H	α-helix	trans	-73.8	-43.8	-170.6	-112.2	-78.8	0	0	0	114.1	V19 T23 V24	V19-H21 PolarHBondContact O-N 3.37Å; H21-T23 VanDerWaalsContact C-N 3.26Å; H21-T23 PolarHBondContact O-N 3.07Å; H21-V24 PolarHBondContact O-N 3.1Å
22	D	52.3	Low	49.5	Very low	110 Å²	110	122.6 Å²	122.6	59%	0.588	67%	0.666	S	S	*	*	H	α-helix	trans	-63.5	-30.3	-177.5	-108	22.2	0	0	0	113.3	R26	D22-R26 WeakPolarHBondContact O-CG 3.44Å
23	T	53.4	Low	50.9	Low	82 Å²	82	124.3 Å²	124.3	50%	0.503	66%	0.66	S	S	.	*	H	α-helix	trans	-67.6	-39.9	-178.7	-47.8	0	0	0	0	111.9	H21 R26 V27	H21-T23 VanDerWaalsContact C-N 3.26Å; H21-T23 PolarHBondContact O-N 3.07Å; T23-R26 PolarHBondContact O-N 3.35Å; T23-V27 PolarHBondContact O-N 3.15Å
24	V	56.4	Low	51.9	Low	83 Å²	83	121.3 Å²	121.3	50%	0.503	64%	0.644	S	S	.	*	H	α-helix	trans	-66.1	-45.7	-176.7	179.9	0	0	0	0	111.4	H21 R26 V27 L28	H21-V24 PolarHBondContact O-N 3.1Å; V24-R26 VanDerWaalsContact C-N 3.28Å; V24-R26 PolarHBondContact O-N 3.08Å; V24-V27 PolarHBondContact O-N 2.93Å; V24-V27 VanDerWaalsContact O-N 3.17Å; V24-L28 HydrophobicContact CG1-CD1 4.36Å; V24-L28 PolarHBondContact O-N 3.13Å
25	N	57.6	Low	52.7	Low	103 Å²	103	119.3 Å²	119.3	55%	0.551	63%	0.627	S	S	*	*	H	α-helix	trans	-62.4	-34.7	179.9	-75.1	-19.3	0	0	0	112.6	S29	N25-S29 PolarHBondContact O-N 3Å
26	R	57.4	Low	53.6	Low	167 Å²	167	120.1 Å²	120.1	63%	0.63	62%	0.618	S	S	*	*	H	α-helix	trans	-64.4	-45.2	174	-69.4	-177.5	-170.1	-164.1	5.4	112	D22 T23 V24 L28 S29 L30	D22-R26 WeakPolarHBondContact O-CG 3.44Å; T23-R26 PolarHBondContact O-N 3.35Å; V24-R26 VanDerWaalsContact C-N 3.28Å; V24-R26 PolarHBondContact O-N 3.08Å; R26-L28 PolarHBondContact O-N 3.03Å; R26-S29 PolarHBondContact O-N 3.48Å; R26-S29 PolarHBondContact O-OG 2.98Å; R26-L30 WeakPolarHBondContact O-CG 3.35Å; R26-L30 PolarHBondContact O-N 3.35Å; R26-L30 VanDerWaalsContact O-N 3.15Å
27	V	59.9	Low	54.7	Low	78 Å²	78	118 Å²	118	47%	0.473	61%	0.61	S	S	.	*	H	α-helix	trans	-59.6	-45.7	178.7	175.4	0	0	0	0	111.6	T23 V24 S29 L30 N31	T23-V27 PolarHBondContact O-N 3.15Å; V24-V27 PolarHBondContact O-N 2.93Å; V24-V27 VanDerWaalsContact O-N 3.17Å; V27-S29 VanDerWaalsContact C-N 3.33Å; V27-S29 PolarHBondContact O-N 3.36Å; V27-L30 PolarHBondContact O-N 3.25Å; V27-L30 VanDerWaalsContact O-N 3.14Å; V27-N31 PolarHBondContact O-N 3.38Å; V27-N31 VanDerWaalsContact O-N 3.16Å
28	L	57.6	Low	55.5	Low	113 Å²	113	112.2 Å²	112.2	59%	0.592	60%	0.601	S	S	*	*	H	α-helix	trans	-59.4	-41.7	176.8	-76.2	165.5	0	0	0	112.5	V24 R26 L30 N31 K32	V24-L28 HydrophobicContact CG1-CD1 4.36Å; V24-L28 PolarHBondContact O-N 3.13Å; R26-L28 PolarHBondContact O-N 3.03Å; L28-L30 VanDerWaalsContact C-N 3.29Å; L28-L30 PolarHBondContact O-N 3.21Å; L28-N31 PolarHBondContact O-N 3.06Å; L28-K32 PolarHBondContact O-N 3.36Å
29	S	65.8	Low	55.8	Low	62 Å²	62	107.3 Å²	107.3	43%	0.434	58%	0.583	S	S	.	*	H	α-helix	trans	-66.9	-26.1	177.3	77	0	0	0	0	114.5	N25 R26 V27	N25-S29 PolarHBondContact O-N 3Å; R26-S29 PolarHBondContact O-N 3.48Å; R26-S29 PolarHBondContact O-OG 2.98Å; V27-S29 VanDerWaalsContact C-N 3.33Å; V27-S29 PolarHBondContact O-N 3.36Å
30	L	61.3	Low	56.2	Low	111 Å²	111	103.4 Å²	103.4	58%	0.581	57%	0.566	S	S	*	*	H	α-helix	trans	-77.5	-44.6	177.9	-73.5	165.8	0	0	0	110.8	R26 V27 L28 K32 K33 A34	R26-L30 WeakPolarHBondContact O-CG 3.35Å; R26-L30 PolarHBondContact O-N 3.35Å; R26-L30 VanDerWaalsContact O-N 3.15Å; V27-L30 PolarHBondContact O-N 3.25Å; V27-L30 VanDerWaalsContact O-N 3.14Å; L28-L30 VanDerWaalsContact C-N 3.29Å; L28-L30 PolarHBondContact O-N 3.21Å; L30-K32 VanDerWaalsContact C-N 3.31Å; L30-K32 PolarHBondContact O-N 3.12Å; L30-K33 PolarHBondContact O-N 3.18Å; L30-A34 PolarHBondContact O-N 3.01Å; L30-A34 VanDerWaalsContact O-N 3.09Å
31	N	56	Low	57	Low	111 Å²	111	98.4 Å²	98.4	59%	0.594	55%	0.55	S	S	*	*	H	α-helix	trans	-59.3	-40.7	178.4	-77.2	-1.4	0	0	0	112.3	V27 L28 K33 A34 A35	V27-N31 PolarHBondContact O-N 3.38Å; V27-N31 VanDerWaalsContact O-N 3.16Å; L28-N31 PolarHBondContact O-N 3.06Å; N31-K33 PolarHBondContact O-N 3.01Å; N31-A34 WeakPolarHBondContact O-CB 3.37Å; N31-A34 PolarHBondContact O-N 3.12Å; N31-A35 PolarHBondContact O-N 3.2Å
32	K	61.9	Low	57.4	Low	161 Å²	161	95.2 Å²	95.2	70%	0.7	54%	0.542	S	S	*	.	H	α-helix	trans	-64	-40.3	178.9	-158.5	169.6	-173.8	175.9	0	112.4	L28 L30 A34 A35 D36	L28-K32 PolarHBondContact O-N 3.36Å; L30-K32 VanDerWaalsContact C-N 3.31Å; L30-K32 PolarHBondContact O-N 3.12Å; K32-A34 VanDerWaalsContact C-N 3.34Å; K32-A34 PolarHBondContact O-N 3.41Å; K32-A35 PolarHBondContact O-N 3.07Å; K32-D36 PolarHBondContact O-N 2.85Å
33	K	62.1	Low	57.8	Low	144 Å²	144	92.6 Å²	92.6	63%	0.626	54%	0.536	S	S	*	.	H	α-helix	trans	-67.2	-31.3	175.1	-71.9	179.2	177.9	178.2	0	113.3	L30 N31 V37	L30-K33 PolarHBondContact O-N 3.18Å; N31-K33 PolarHBondContact O-N 3.01Å; K33-V37 WeakPolarHBondContact O-CG2 3.44Å; K33-V37 PolarHBondContact O-N 3.46Å
34	A	55.6	Low	58.3	Low	57 Å²	57	94.5 Å²	94.5	47%	0.471	54%	0.537	S	S	.	.	H	α-helix	trans	-65.9	-39	176	0	0	0	0	0	111.9	L30 N31 K32 V37 C38	L30-A34 PolarHBondContact O-N 3.01Å; L30-A34 VanDerWaalsContact O-N 3.09Å; N31-A34 WeakPolarHBondContact O-CB 3.37Å; N31-A34 PolarHBondContact O-N 3.12Å; K32-A34 VanDerWaalsContact C-N 3.34Å; K32-A34 PolarHBondContact O-N 3.41Å; A34-V37 PolarHBondContact O-N 2.95Å; A34-C38 PolarHBondContact O-N 3.24Å; A34-C38 VanDerWaalsContact O-N 3.11Å
35	A	53.3	Low	58.8	Low	60 Å²	60	96.1 Å²	96.1	50%	0.496	54%	0.539	S	S	.	.	H	α-helix	trans	-61.9	-46.9	177.5	0	0	0	0	0	112.6	N31 K32 V37 C38 A39	N31-A35 PolarHBondContact O-N 3.2Å; K32-A35 PolarHBondContact O-N 3.07Å; A35-V37 VanDerWaalsContact C-N 3.28Å; A35-V37 PolarHBondContact O-N 2.93Å; A35-C38 WeakPolarHBondContact O-CB 3.33Å; A35-C38 PolarHBondContact O-N 2.91Å; A35-C38 VanDerWaalsContact O-N 3.16Å; A35-A39 PolarHBondContact O-N 3.06Å
36	D	55.5	Low	59.2	Low	113 Å²	113	96.5 Å²	96.5	60%	0.604	54%	0.54	S	S	*	.	H	α-helix	trans	-60.2	-38	178.3	-64	-31.6	0	0	0	112	K32 A39 G40	K32-D36 PolarHBondContact O-N 2.85Å; D36-A39 PolarHBondContact O-N 3.1Å; D36-G40 PolarHBondContact O-N 2.77Å
37	V	61	Low	59.6	Low	97 Å²	97	92.5 Å²	92.5	59%	0.588	54%	0.535	S	S	*	.	H	α-helix	trans	-67.5	-38.9	176.9	171.7	0	0	0	0	111.7	K33 A34 A35 T41	K33-V37 WeakPolarHBondContact O-CG2 3.44Å; K33-V37 PolarHBondContact O-N 3.46Å; A34-V37 PolarHBondContact O-N 2.95Å; A35-V37 VanDerWaalsContact C-N 3.28Å; A35-V37 PolarHBondContact O-N 2.93Å; V37-T41 WeakPolarHBondContact O-CB 3.5Å; V37-T41 PolarHBondContact O-N 3.25Å; V37-T41 PolarHBondContact O-OG1 2.93Å
38	C	52.3	Low	60.2	Low	88 Å²	88	95 Å²	95	60%	0.595	54%	0.539	S	S	*	.	H	α-helix	trans	-62	-49	173.1	-84.4	0	0	0	0	111.8	A34 A35 G40 T41 T42	A34-C38 PolarHBondContact O-N 3.24Å; A34-C38 VanDerWaalsContact O-N 3.11Å; A35-C38 WeakPolarHBondContact O-CB 3.33Å; A35-C38 PolarHBondContact O-N 2.91Å; A35-C38 VanDerWaalsContact O-N 3.16Å; C38-G40 VanDerWaalsContact C-N 3.35Å; C38-G40 PolarHBondContact O-N 3Å; C38-T41 WeakPolarHBondContact O-CB 3.33Å; C38-T41 PolarHBondContact O-N 3.48Å; C38-T42 PolarHBondContact O-N 2.81Å; C38-T42 PolarHBondContact O-OG1 3.2Å
39	A	51.5	Low	60.8	Low	61 Å²	61	94.3 Å²	94.3	50%	0.504	54%	0.536	S	S	.	.	H	α-helix	trans	-60.6	-41.4	179	0	0	0	0	0	112.6	A35 D36 T41 T42 A43	A35-A39 PolarHBondContact O-N 3.06Å; D36-A39 PolarHBondContact O-N 3.1Å; A39-T41 PolarHBondContact O-N 3.35Å; A39-T42 PolarHBondContact O-OG1 3.25Å; A39-T42 VanDerWaalsContact O-OG1 3.1Å; A39-A43 PolarHBondContact O-N 2.95Å
40	G	56.3	Low	60.9	Low	33 Å²	33	95.9 Å²	95.9	34%	0.34	54%	0.538	S	S	.	.	H	α-helix	trans	-67.2	-16.4	174	0	0	0	0	0	114.6	D36 C38 K44	D36-G40 PolarHBondContact O-N 2.77Å; C38-G40 VanDerWaalsContact C-N 3.35Å; C38-G40 PolarHBondContact O-N 3Å; G40-K44 WeakPolarHBondContact O-CD 3.39Å; G40-K44 WeakPolarHBondContact O-CG 3.45Å
41	T	60.9	Low	61.3	Low	70 Å²	70	94.5 Å²	94.5	43%	0.429	54%	0.535	S	S	.	.	H	α-helix	trans	-95.7	-35.9	-178.5	-57.9	0	0	0	0	112.3	V37 C38 A39 H45	V37-T41 WeakPolarHBondContact O-CB 3.5Å; V37-T41 PolarHBondContact O-N 3.25Å; V37-T41 PolarHBondContact O-OG1 2.93Å; C38-T41 WeakPolarHBondContact O-CB 3.33Å; C38-T41 PolarHBondContact O-N 3.48Å; A39-T41 PolarHBondContact O-N 3.35Å; T41-H45 PolarHBondContact O-N 2.9Å; T41-H45 VanDerWaalsContact O-N 3.08Å; T41-H45 PolarHBondContact O-ND1 3.27Å
42	T	57.1	Low	61.8	Low	96 Å²	96	92 Å²	92	59%	0.589	52%	0.521	S	S	*	.	H	α-helix	trans	-67.5	-43.5	172.4	52.9	0	0	0	0	111.4	C38 A39 K44 H45 L46	C38-T42 PolarHBondContact O-N 2.81Å; C38-T42 PolarHBondContact O-OG1 3.2Å; A39-T42 PolarHBondContact O-OG1 3.25Å; A39-T42 VanDerWaalsContact O-OG1 3.1Å; T42-K44 VanDerWaalsContact C-N 3.32Å; T42-K44 PolarHBondContact O-N 2.84Å; T42-H45 PolarHBondContact O-N 2.81Å; T42-H45 VanDerWaalsContact O-N 3.17Å; T42-L46 PolarHBondContact O-N 2.76Å
43	A	60.2	Low	62.1	Low	54 Å²	54	89 Å²	89	45%	0.446	51%	0.513	S	S	.	.	H	α-helix	trans	-57.3	-43.3	174.9	0	0	0	0	0	112.3	A39 L46 T47	A39-A43 PolarHBondContact O-N 2.95Å; A43-L46 PolarHBondContact O-N 3.25Å; A43-T47 PolarHBondContact O-N 3.37Å; A43-T47 PolarHBondContact O-OG1 2.88Å
44	K	65.1	Low	62.2	Low	122 Å²	122	85.9 Å²	85.9	53%	0.53	50%	0.502	S	S	.	.	H	α-helix	trans	-64.7	-41.9	175.9	-75.6	173.8	-175.7	169.4	0	112.4	G40 T42 T47 K48	G40-K44 WeakPolarHBondContact O-CD 3.39Å; G40-K44 WeakPolarHBondContact O-CG 3.45Å; T42-K44 VanDerWaalsContact C-N 3.32Å; T42-K44 PolarHBondContact O-N 2.84Å; K44-T47 WeakPolarHBondContact CA-OG1 3.27Å; K44-T47 PolarHBondContact O-N 2.88Å; K44-T47 PolarHBondContact O-OG1 3.24Å; K44-K48 WeakPolarHBondContact O-CB 3.45Å; K44-K48 PolarHBondContact O-N 2.8Å
45	H	65.8	Low	62.4	Low	118 Å²	118	87.1 Å²	87.1	55%	0.546	50%	0.495	S	S	.	.	H	α-helix	trans	-60.6	-44.3	173	-92.1	89.5	0	0	0	112.1	T41 T42 K48 L49	T41-H45 PolarHBondContact O-N 2.9Å; T41-H45 VanDerWaalsContact O-N 3.08Å; T41-H45 PolarHBondContact O-ND1 3.27Å; T42-H45 PolarHBondContact O-N 2.81Å; T42-H45 VanDerWaalsContact O-N 3.17Å; H45-K48 PolarHBondContact O-N 3.34Å; H45-L49 WeakPolarHBondContact O-CB 3.41Å; H45-L49 WeakPolarHBondContact O-CG 3.25Å; H45-L49 PolarHBondContact O-N 3.23Å
46	L	66.7	Low	63	Low	110 Å²	110	87.7 Å²	87.7	58%	0.576	50%	0.495	S	S	*	.	H	α-helix	trans	-62.5	-45.8	177.9	-168.9	69	0	0	0	111.5	T42 A43 K48 L49 L50	T42-L46 PolarHBondContact O-N 2.76Å; A43-L46 PolarHBondContact O-N 3.25Å; L46-K48 VanDerWaalsContact C-N 3.29Å; L46-K48 PolarHBondContact O-N 3.44Å; L46-L49 PolarHBondContact O-N 3.12Å; L46-L50 HydrophobicContact CG-CD1 4.27Å; L46-L50 WeakPolarHBondContact O-CB 3.22Å; L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.45Å; L46-L50 PolarHBondContact O-N 3.19Å
47	T	65.5	Low	63.2	Low	84 Å²	84	86.2 Å²	86.2	52%	0.515	49%	0.486	S	S	.	.	H	α-helix	trans	-61.7	-36.1	174.9	55.9	0	0	0	0	112.7	A43 K44 V51	A43-T47 PolarHBondContact O-N 3.37Å; A43-T47 PolarHBondContact O-OG1 2.88Å; K44-T47 WeakPolarHBondContact CA-OG1 3.27Å; K44-T47 PolarHBondContact O-N 2.88Å; K44-T47 PolarHBondContact O-OG1 3.24Å; T47-V51 WeakPolarHBondContact O-CB 3.48Å; T47-V51 VanDerWaalsContact O-CG2 3.28Å; T47-V51 WeakPolarHBondContact O-CG2 3.21Å; T47-V51 PolarHBondContact O-N 3.47Å
48	K	72.5	Confident	63	Low	130 Å²	130	84.8 Å²	84.8	57%	0.565	47%	0.472	S	S	*	.	H	α-helix	trans	-69.8	-46.2	177.2	-169.4	-170.7	173.3	-157.8	0	111.4	K44 H45 L46 L50 V51 D52	K44-K48 WeakPolarHBondContact O-CB 3.45Å; K44-K48 PolarHBondContact O-N 2.8Å; H45-K48 PolarHBondContact O-N 3.34Å; L46-K48 VanDerWaalsContact C-N 3.29Å; L46-K48 PolarHBondContact O-N 3.44Å; K48-L50 VanDerWaalsContact C-N 3.32Å; K48-L50 PolarHBondContact O-N 2.84Å; K48-V51 PolarHBondContact O-N 3.18Å; K48-D52 WeakPolarHBondContact CE-OD2 3.34Å; K48-D52 WeakPolarHBondContact CG-OD2 3.43Å; K48-D52 WeakPolarHBondContact O-CB 3.5Å; K48-D52 PolarHBondContact O-N 3.11Å
49	L	70.9	Confident	63.3	Low	99 Å²	99	83.6 Å²	83.6	52%	0.518	47%	0.465	S	S	.	.	H	α-helix	trans	-61.4	-39.7	176.4	-72.7	169	0	0	0	111.7	H45 L46 N53	H45-L49 WeakPolarHBondContact O-CB 3.41Å; H45-L49 WeakPolarHBondContact O-CG 3.25Å; H45-L49 PolarHBondContact O-N 3.23Å; L46-L49 PolarHBondContact O-N 3.12Å; L49-N53 VanDerWaalsContact O-CB 3.22Å; L49-N53 WeakPolarHBondContact O-CB 3.39Å; L49-N53 VanDerWaalsContact O-CG 3.24Å; L49-N53 PolarHBondContact O-N 3.33Å
50	L	68.2	Low	64.2	Low	94 Å²	94	85.5 Å²	85.5	49%	0.492	46%	0.463	S	S	.	.	H	α-helix	trans	-63	-46.9	172.4	-72.8	170.8	0	0	0	111.5	L46 K48 N53 I54	L46-L50 HydrophobicContact CG-CD1 4.27Å; L46-L50 WeakPolarHBondContact O-CB 3.22Å; L46-L50 VanDerWaalsContact O-CG 3.32Å; L46-L50 WeakPolarHBondContact O-CG 3.45Å; L46-L50 PolarHBondContact O-N 3.19Å; K48-L50 VanDerWaalsContact C-N 3.32Å; K48-L50 PolarHBondContact O-N 2.84Å; L50-N53 PolarHBondContact O-N 3.31Å; L50-I54 VanDerWaalsContact O-CB 3.23Å; L50-I54 WeakPolarHBondContact O-CB 3.26Å; L50-I54 WeakPolarHBondContact O-CD1 3.48Å; L50-I54 WeakPolarHBondContact O-CG1 3.49Å; L50-I54 PolarHBondContact O-N 3.22Å
51	V	68.4	Low	65.3	Low	83 Å²	83	85.6 Å²	85.6	50%	0.503	46%	0.456	S	S	.	.	H	α-helix	trans	-64.4	-40.8	177.9	166.7	0	0	0	0	112.4	T47 K48 I54 R55	T47-V51 WeakPolarHBondContact O-CB 3.48Å; T47-V51 VanDerWaalsContact O-CG2 3.28Å; T47-V51 WeakPolarHBondContact O-CG2 3.21Å; T47-V51 PolarHBondContact O-N 3.47Å; K48-V51 PolarHBondContact O-N 3.18Å; V51-I54 PolarHBondContact O-N 3.47Å; V51-R55 VanDerWaalsContact O-CB 3.23Å; V51-R55 WeakPolarHBondContact O-CB 3.48Å; V51-R55 PolarHBondContact O-N 3.02Å
52	D	67.4	Low	66.5	Low	57 Å²	57	88.2 Å²	88.2	31%	0.305	46%	0.458	S	S	.	.	H	α-helix	trans	-75.1	-32.2	179.7	-73	-31	0	0	0	111.9	K48 R55 S56	K48-D52 WeakPolarHBondContact CE-OD2 3.34Å; K48-D52 WeakPolarHBondContact CG-OD2 3.43Å; K48-D52 WeakPolarHBondContact O-CB 3.5Å; K48-D52 PolarHBondContact O-N 3.11Å; D52-R55 PolarHBondContact O-N 3.04Å; D52-R55 IonicContact OD1-NH1 2.9Å; D52-R55 PolarHBondContact OD1-NH1 3.39Å; D52-S56 WeakPolarHBondContact O-CB 3.46Å; D52-S56 PolarHBondContact O-N 2.91Å
53	N	67.8	Low	67.9	Low	100 Å²	100	86.7 Å²	86.7	54%	0.535	45%	0.446	S	S	.	.	H	α-helix	trans	-67.2	-45.1	168.2	-77.1	-7.2	0	0	0	111.8	L49 L50 R55 S56 I57	L49-N53 VanDerWaalsContact O-CB 3.22Å; L49-N53 WeakPolarHBondContact O-CB 3.39Å; L49-N53 VanDerWaalsContact O-CG 3.24Å; L49-N53 PolarHBondContact O-N 3.33Å; L50-N53 PolarHBondContact O-N 3.31Å; N53-R55 VanDerWaalsContact C-N 3.3Å; N53-R55 PolarHBondContact O-N 3.29Å; N53-S56 WeakPolarHBondContact O-CB 3.4Å; N53-S56 PolarHBondContact O-N 3.03Å; N53-S56 VanDerWaalsContact O-N 3.12Å; N53-I57 WeakPolarHBondContact O-CB 3.46Å; N53-I57 VanDerWaalsContact O-CG1 3.28Å; N53-I57 WeakPolarHBondContact O-CG1 3.41Å; N53-I57 PolarHBondContact O-N 2.89Å
54	I	63.2	Low	69.2	Low	78 Å²	78	84.3 Å²	84.3	40%	0.4	43%	0.426	S	S	.	.	H	α-helix	trans	-61.2	-39.7	174.9	-73.3	166.1	0	0	0	110.6	L50 V51 F58	L50-I54 VanDerWaalsContact O-CB 3.23Å; L50-I54 WeakPolarHBondContact O-CB 3.26Å; L50-I54 WeakPolarHBondContact O-CD1 3.48Å; L50-I54 WeakPolarHBondContact O-CG1 3.49Å; L50-I54 PolarHBondContact O-N 3.22Å; V51-I54 PolarHBondContact O-N 3.47Å; I54-F58 HydrophobicContact CG2-CD2 3.53Å; I54-F58 HydrophobicContact CG2-CE2 3.54Å; I54-F58 WeakPolarHBondContact O-CB 3.41Å; I54-F58 WeakPolarHBondContact O-CD2 3.31Å; I54-F58 WeakPolarHBondContact O-CG 3.21Å; I54-F58 PolarHBondContact O-N 3.45Å
55	R	61.3	Low	70.5	Confident	83 Å²	83	78.5 Å²	78.5	31%	0.313	40%	0.401	S	S	.	.	H	α-helix	trans	-64.1	-41	172	171.5	179.6	-85.2	140.1	-7.5	111.9	V51 D52 N53 S59 A199	V51-R55 VanDerWaalsContact O-CB 3.23Å; V51-R55 WeakPolarHBondContact O-CB 3.48Å; V51-R55 PolarHBondContact O-N 3.02Å; D52-R55 PolarHBondContact O-N 3.04Å; D52-R55 IonicContact OD1-NH1 2.9Å; D52-R55 PolarHBondContact OD1-NH1 3.39Å; N53-R55 VanDerWaalsContact C-N 3.3Å; N53-R55 PolarHBondContact O-N 3.29Å; R55-S59 WeakPolarHBondContact O-CB 3.3Å; R55-S59 PolarHBondContact O-N 3.06Å; R55-A199 PolarHBondContact NE-O 2.89Å; R55-A199 VanDerWaalsContact NE-O 3.16Å; R55-A199 PolarHBondContact NH2-O 3.17Å
56	S	64.9	Low	71.8	Confident	71 Å²	71	75.2 Å²	75.2	50%	0.497	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-49.7	176.5	-174.5	0	0	0	0	111.1	D52 N53 S59	D52-S56 WeakPolarHBondContact O-CB 3.46Å; D52-S56 PolarHBondContact O-N 2.91Å; N53-S56 WeakPolarHBondContact O-CB 3.4Å; N53-S56 PolarHBondContact O-N 3.03Å; N53-S56 VanDerWaalsContact O-N 3.12Å; S56-S59 WeakPolarHBondContact O-CB 3.47Å; S56-S59 PolarHBondContact O-N 3.29Å
57	I	59.6	Low	73	Confident	83 Å²	83	71.6 Å²	71.6	43%	0.426	37%	0.373	S	S	.	.	H	α-helix	trans	-56.6	-55.7	175	-68.6	166.1	0	0	0	110.3	N53 S59 Q60 L63	N53-I57 WeakPolarHBondContact O-CB 3.46Å; N53-I57 VanDerWaalsContact O-CG1 3.28Å; N53-I57 WeakPolarHBondContact O-CG1 3.41Å; N53-I57 PolarHBondContact O-N 2.89Å; I57-S59 PolarHBondContact O-N 2.94Å; I57-Q60 WeakPolarHBondContact O-CB 3.14Å; I57-Q60 PolarHBondContact O-N 2.92Å; I57-L63 HydrophobicContact CG2-CD1 3.42Å; I57-L63 VanDerWaalsContact CG2-CD1 3.42Å
58	F	57.2	Low	74.4	Confident	67 Å²	67	67.7 Å²	67.7	29%	0.294	35%	0.348	S	S	.	.	H	α-helix	trans	-73.7	-4.7	179.5	-66.3	-36.2	0	0	0	115	I54 Q60 F195 I198	I54-F58 HydrophobicContact CG2-CD2 3.53Å; I54-F58 HydrophobicContact CG2-CE2 3.54Å; I54-F58 WeakPolarHBondContact O-CB 3.41Å; I54-F58 WeakPolarHBondContact O-CD2 3.31Å; I54-F58 WeakPolarHBondContact O-CG 3.21Å; I54-F58 PolarHBondContact O-N 3.45Å; F58-Q60 VanDerWaalsContact C-N 3.32Å; F58-F195 HydrophobicContact CB-CD1 4.09Å; F58-F195 HydrophobicContact CB-CE1 4.35Å; F58-F195 HydrophobicContact CD1-CD1 4.06Å; F58-F195 AromaticContact CD1-CE1 3.46Å; F58-F195 HydrophobicContact CD1-CE1 3.46Å; F58-F195 VanDerWaalsContact CD1-CE1 3.46Å; F58-F195 HydrophobicContact CD1-CZ 4.29Å; F58-F195 AromaticContact CE1-CE1 3.91Å; F58-F195 HydrophobicContact CE1-CE1 3.91Å; F58-F195 HydrophobicContact CE1-CZ 4.3Å; F58-F195 HydrophobicContact CG-CD1 4.18Å; F58-F195 HydrophobicContact CG-CE1 4.04Å; F58-I198 HydrophobicContact CD2-CG2 4.12Å; F58-I198 HydrophobicContact CE2-CG2 4.39Å
59	S	59.4	Low	75.5	Confident	62 Å²	62	61.5 Å²	61.5	43%	0.434	32%	0.321	S	S	.	.	H	α-helix	trans	-79.6	-16.2	167.4	-167.9	0	0	0	0	112.2	R55 S56 I57 D61	R55-S59 WeakPolarHBondContact O-CB 3.3Å; R55-S59 PolarHBondContact O-N 3.06Å; S56-S59 WeakPolarHBondContact O-CB 3.47Å; S56-S59 PolarHBondContact O-N 3.29Å; I57-S59 PolarHBondContact O-N 2.94Å; S59-D61 PolarHBondContact O-N 3.2Å
60	Q	70.3	Confident	76.7	Confident	102 Å²	102	59.4 Å²	59.4	48%	0.477	31%	0.313	S	S	.	.			trans	-76.5	111.7	176.2	-59.4	-173.3	-2.4	0	0	110.7	I57 F58 W62 L63	I57-Q60 WeakPolarHBondContact O-CB 3.14Å; I57-Q60 PolarHBondContact O-N 2.92Å; F58-Q60 VanDerWaalsContact C-N 3.32Å; Q60-W62 PolarHBondContact O-N 2.79Å; Q60-W62 VanDerWaalsContact O-N 3.1Å; Q60-L63 PolarHBondContact O-N 2.83Å
61	D	78.1	Confident	77.9	Confident	34 Å²	34	56.5 Å²	56.5	18%	0.182	30%	0.3	C	S	.	.	H	α-helix	trans	-53.7	-31.3	176.3	-72.9	-37.7	0	0	0	112.6	S59 L63 I64 L65 R207 R249	S59-D61 PolarHBondContact O-N 3.2Å; D61-L63 PolarHBondContact O-N 2.61Å; D61-I64 WeakPolarHBondContact O-CB 3.47Å; D61-I64 PolarHBondContact O-N 2.94Å; D61-I64 VanDerWaalsContact O-N 3.14Å; D61-L65 WeakPolarHBondContact O-CG 3.08Å; D61-L65 PolarHBondContact O-N 3.15Å; D61-R207 IonicContact OD1-CZ 2.66Å; D61-R207 IonicContact OD1-NE 3.21Å; D61-R207 PolarHBondContact OD1-NE 3.31Å; D61-R207 IonicContact OD1-NH2 3.87Å; D61-R207 PolarHBondContact OD1-NH2 2.85Å; D61-R249 IonicContact OD2-CZ 3.35Å; D61-R249 IonicContact OD2-NE 2.83Å; D61-R249 IonicContact OD2-NH2 2.69Å; D61-R249 PolarHBondContact OD2-NH2 3.41Å
62	W	86.7	Confident	79.2	Confident	125 Å²	125	52.6 Å²	52.6	47%	0.473	28%	0.277	S	S	.	.	H	α-helix	trans	-60.2	-38.8	-179.2	-58.7	116.4	0	0	0	113.7	Q60 I64 L65 I66 F252	Q60-W62 PolarHBondContact O-N 2.79Å; Q60-W62 VanDerWaalsContact O-N 3.1Å; W62-I64 VanDerWaalsContact C-N 3.34Å; W62-L65 HydrophobicContact CE3-CD1 4.01Å; W62-L65 HydrophobicContact CZ3-CD1 4.38Å; W62-L65 PolarHBondContact O-N 2.81Å; W62-I66 WeakPolarHBondContact O-CG1 3Å; W62-I66 PolarHBondContact O-N 3.05Å; W62-F252 HydrophobicContact CB-CE1 4.34Å; W62-F252 AromaticContact CE3-CD1 3.62Å; W62-F252 HydrophobicContact CE3-CD1 3.62Å; W62-F252 HydrophobicContact CE3-CD2 4.37Å; W62-F252 AromaticContact CE3-CE1 3.71Å; W62-F252 HydrophobicContact CE3-CE1 3.71Å; W62-F252 HydrophobicContact CE3-CE2 4.45Å; W62-F252 AromaticContact CE3-CG 3.95Å; W62-F252 HydrophobicContact CE3-CG 3.95Å; W62-F252 HydrophobicContact CE3-CZ 4.13Å; W62-F252 HydrophobicContact CZ3-CB 4.04Å; W62-F252 AromaticContact CZ3-CD1 3.98Å; W62-F252 HydrophobicContact CZ3-CD1 3.98Å; W62-F252 HydrophobicContact CZ3-CD2 4.27Å; W62-F252 HydrophobicContact CZ3-CE1 4.45Å; W62-F252 AromaticContact CZ3-CG 3.86Å; W62-F252 HydrophobicContact CZ3-CG 3.86Å
63	L	86.6	Confident	80.5	Confident	65 Å²	65	49.9 Å²	49.9	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-71.9	-30.9	176.6	-70.4	174.6	0	0	0	112	I57 Q60 D61 L65 I66 A67	I57-L63 HydrophobicContact CG2-CD1 3.42Å; I57-L63 VanDerWaalsContact CG2-CD1 3.42Å; Q60-L63 PolarHBondContact O-N 2.83Å; D61-L63 PolarHBondContact O-N 2.61Å; L63-L65 VanDerWaalsContact C-N 3.31Å; L63-I66 HydrophobicContact CD2-CD1 4.39Å; L63-I66 PolarHBondContact O-N 3.29Å; L63-A67 WeakPolarHBondContact O-CB 3.34Å; L63-A67 PolarHBondContact O-N 3.45Å
64	I	87.9	Confident	81.8	Confident	4 Å²	4	48.1 Å²	48.1	2%	0.021	26%	0.255	C	S	.	.	H	α-helix	trans	-65.9	-38.5	172.6	-53.2	-175.2	0	0	0	110.1	D61 W62 A67 L68 I191 F195 M211	D61-I64 WeakPolarHBondContact O-CB 3.47Å; D61-I64 PolarHBondContact O-N 2.94Å; D61-I64 VanDerWaalsContact O-N 3.14Å; W62-I64 VanDerWaalsContact C-N 3.34Å; I64-A67 PolarHBondContact O-N 2.98Å; I64-L68 WeakPolarHBondContact O-CB 3.49Å; I64-L68 PolarHBondContact O-N 3.03Å; I64-I191 HydrophobicContact CG2-CG2 3.66Å; I64-F195 HydrophobicContact CD1-CB 4.36Å; I64-F195 HydrophobicContact CD1-CD1 3.87Å; I64-F195 HydrophobicContact CD1-CG 4.32Å; I64-F195 HydrophobicContact CG1-CD1 3.68Å; I64-F195 HydrophobicContact CG1-CE1 3.83Å; I64-F195 HydrophobicContact CG1-CG 4.38Å; I64-M211 HydrophobicContact CB-CE 4.1Å; I64-M211 HydrophobicContact CG2-CE 3.66Å; I64-M211 HydrophobicContact CG2-SD 3.94Å
65	L	92.3	Very high	83.2	Confident	0 Å²	0	47.1 Å²	47.1	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-71.1	-38.8	176.7	-66.5	163.6	0	0	0	112.5	D61 W62 L63 L68 G69 M211 A214 R249 F252 S253	D61-L65 WeakPolarHBondContact O-CG 3.08Å; D61-L65 PolarHBondContact O-N 3.15Å; W62-L65 HydrophobicContact CE3-CD1 4.01Å; W62-L65 HydrophobicContact CZ3-CD1 4.38Å; W62-L65 PolarHBondContact O-N 2.81Å; L63-L65 VanDerWaalsContact C-N 3.31Å; L65-L68 HydrophobicContact CD2-CD2 4.37Å; L65-L68 WeakPolarHBondContact O-CB 3.35Å; L65-L68 PolarHBondContact O-N 3.4Å; L65-G69 PolarHBondContact O-N 2.98Å; L65-M211 HydrophobicContact CD2-CE 3.96Å; L65-M211 HydrophobicContact CD2-SD 3.84Å; L65-M211 HydrophobicContact CG-CE 4.18Å; L65-A214 HydrophobicContact CD2-CB 3.69Å; L65-R249 HydrophobicContact CD1-CB 3.64Å; L65-R249 HydrophobicContact CD1-CG 3.62Å; L65-R249 HydrophobicContact CD2-CB 4.19Å; L65-F252 HydrophobicContact CB-CD1 4.21Å; L65-S253 PolarHBondContact O-OG 3.18Å
66	I	92.9	Very high	84.7	Confident	48 Å²	48	43.2 Å²	43.2	25%	0.246	24%	0.235	C	C	.	.	H	α-helix	trans	-62.1	-46.8	171.7	-68.3	165.7	0	0	0	110.2	W62 L63 L68 G69 V70 F252 F256	W62-I66 WeakPolarHBondContact O-CG1 3Å; W62-I66 PolarHBondContact O-N 3.05Å; L63-I66 HydrophobicContact CD2-CD1 4.39Å; L63-I66 PolarHBondContact O-N 3.29Å; I66-L68 VanDerWaalsContact C-N 3.28Å; I66-L68 PolarHBondContact O-N 3.11Å; I66-G69 PolarHBondContact O-N 3.33Å; I66-V70 HydrophobicContact CG2-CG2 4.09Å; I66-V70 WeakPolarHBondContact O-CB 3.27Å; I66-V70 WeakPolarHBondContact O-CG2 3.45Å; I66-V70 PolarHBondContact O-N 2.78Å; I66-F252 HydrophobicContact CD1-CE1 4.17Å; I66-F252 HydrophobicContact CD1-CZ 4.17Å; I66-F252 HydrophobicContact CG1-CE1 3.81Å; I66-F252 HydrophobicContact CG1-CZ 4.24Å; I66-F256 HydrophobicContact CD1-CE1 4.42Å; I66-F256 HydrophobicContact CD1-CE2 4.23Å; I66-F256 HydrophobicContact CD1-CZ 4.07Å; I66-F256 HydrophobicContact CG1-CD1 4.3Å; I66-F256 HydrophobicContact CG1-CD2 3.99Å; I66-F256 HydrophobicContact CG1-CE1 4.27Å; I66-F256 HydrophobicContact CG1-CE2 3.97Å; I66-F256 HydrophobicContact CG1-CG 4.17Å; I66-F256 HydrophobicContact CG1-CZ 4.11Å; I66-F256 HydrophobicContact CG2-CD1 4.32Å
67	A	92.5	Very high	86	Confident	35 Å²	35	40.5 Å²	40.5	29%	0.289	22%	0.215	S	C	.	.	H	α-helix	trans	-60.6	-36.2	176.7	0	0	0	0	0	112.8	L63 I64 S71	L63-A67 WeakPolarHBondContact O-CB 3.34Å; L63-A67 PolarHBondContact O-N 3.45Å; I64-A67 PolarHBondContact O-N 2.98Å; A67-S71 VanDerWaalsContact O-CB 3.26Å; A67-S71 WeakPolarHBondContact O-CB 3.26Å; A67-S71 PolarHBondContact O-N 3.01Å; A67-S71 PolarHBondContact O-OG 3.44Å
68	L	94.8	Very high	87.5	Confident	1 Å²	1	39.6 Å²	39.6	1%	0.005	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-51.2	173.8	175.8	59.7	0	0	0	112	I64 L65 I66 S71 V72 V187 A188 I191 M211 A214 V218	I64-L68 WeakPolarHBondContact O-CB 3.49Å; I64-L68 PolarHBondContact O-N 3.03Å; L65-L68 HydrophobicContact CD2-CD2 4.37Å; L65-L68 WeakPolarHBondContact O-CB 3.35Å; L65-L68 PolarHBondContact O-N 3.4Å; I66-L68 VanDerWaalsContact C-N 3.28Å; I66-L68 PolarHBondContact O-N 3.11Å; L68-S71 PolarHBondContact O-N 2.94Å; L68-S71 PolarHBondContact O-OG 3.06Å; L68-V72 HydrophobicContact CD1-CG2 4.01Å; L68-V72 WeakPolarHBondContact O-CG2 3.36Å; L68-V72 PolarHBondContact O-N 3.24Å; L68-V187 HydrophobicContact CD1-CB 4.32Å; L68-V187 HydrophobicContact CD1-CG1 3.86Å; L68-A188 HydrophobicContact CD1-CB 3.85Å; L68-A188 HydrophobicContact CD2-CB 4.06Å; L68-I191 HydrophobicContact CB-CD1 4.32Å; L68-I191 HydrophobicContact CD1-CD1 4.45Å; L68-M211 HydrophobicContact CD2-SD 3.96Å; L68-A214 HydrophobicContact CD2-CB 4.22Å; L68-V218 HydrophobicContact CD2-CG2 4.36Å; L68-V218 HydrophobicContact CG-CG2 4.32Å
69	G	95.1	Very high	89.1	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.2	-49.2	177.5	0	0	0	0	0	112.5	L65 I66 S71 A73 S253 S257	L65-G69 PolarHBondContact O-N 2.98Å; I66-G69 PolarHBondContact O-N 3.33Å; G69-S71 PolarHBondContact O-N 3.47Å; G69-A73 VanDerWaalsContact O-CB 3.3Å; G69-A73 WeakPolarHBondContact O-CB 3.48Å; G69-A73 PolarHBondContact O-N 3.37Å; G69-S253 PolarHBondContact N-OG 3.26Å; G69-S257 PolarHBondContact O-OG 3.03Å
70	V	95.2	Very high	90.6	Very high	55 Å²	55	35.3 Å²	35.3	33%	0.333	19%	0.191	S	C	.	.	H	α-helix	trans	-59	-46.4	177.8	174.5	0	0	0	0	111.6	I66 A73 V74 V260	I66-V70 HydrophobicContact CG2-CG2 4.09Å; I66-V70 WeakPolarHBondContact O-CB 3.27Å; I66-V70 WeakPolarHBondContact O-CG2 3.45Å; I66-V70 PolarHBondContact O-N 2.78Å; V70-A73 PolarHBondContact O-N 3.46Å; V70-V74 WeakPolarHBondContact O-CG2 3.11Å; V70-V74 PolarHBondContact O-N 3.4Å; V70-V260 HydrophobicContact CG2-CG2 3.96Å
71	S	95.1	Very high	91.5	Very high	33 Å²	33	33.4 Å²	33.4	23%	0.231	18%	0.183	C	C	.	.	H	α-helix	trans	-71.9	-36.4	-175.9	56.2	0	0	0	0	113.4	A67 L68 G69 L75 V187	A67-S71 VanDerWaalsContact O-CB 3.26Å; A67-S71 WeakPolarHBondContact O-CB 3.26Å; A67-S71 PolarHBondContact O-N 3.01Å; A67-S71 PolarHBondContact O-OG 3.44Å; L68-S71 PolarHBondContact O-N 2.94Å; L68-S71 PolarHBondContact O-OG 3.06Å; G69-S71 PolarHBondContact O-N 3.47Å; S71-L75 WeakPolarHBondContact O-CB 3.13Å; S71-L75 WeakPolarHBondContact O-CD1 3.39Å; S71-L75 VanDerWaalsContact O-CG 3.23Å; S71-L75 WeakPolarHBondContact O-CG 3.23Å; S71-L75 PolarHBondContact O-N 2.98Å; S71-V187 VanDerWaalsContact OG-CG1 3.31Å; S71-V187 WeakPolarHBondContact OG-CG1 3.45Å
72	V	95.4	Very high	92.1	Very high	2 Å²	2	35.7 Å²	35.7	1%	0.012	20%	0.195	C	C	.	.	H	α-helix	trans	-69.7	-39.3	173.4	178.3	0	0	0	0	111.1	L68 L75 S76 V187 V218 C222	L68-V72 HydrophobicContact CD1-CG2 4.01Å; L68-V72 WeakPolarHBondContact O-CG2 3.36Å; L68-V72 PolarHBondContact O-N 3.24Å; V72-L75 PolarHBondContact O-N 3.38Å; V72-S76 WeakPolarHBondContact O-CB 3.5Å; V72-S76 PolarHBondContact O-N 3.5Å; V72-V187 HydrophobicContact CG2-CB 4.22Å; V72-V187 HydrophobicContact CG2-CG1 4.09Å; V72-V218 HydrophobicContact CB-CG1 3.63Å; V72-V218 HydrophobicContact CG1-CG1 3.86Å; V72-V218 HydrophobicContact CG2-CG1 3.87Å; V72-C222 HydrophobicContact CG1-CB 4.1Å
73	A	94	Very high	92.2	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-58.4	-51.4	174.1	0	0	0	0	0	112.6	G69 V70 L75 S76 F77 C222 S257 V260	G69-A73 VanDerWaalsContact O-CB 3.3Å; G69-A73 WeakPolarHBondContact O-CB 3.48Å; G69-A73 PolarHBondContact O-N 3.37Å; V70-A73 PolarHBondContact O-N 3.46Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 3.47Å; A73-S76 PolarHBondContact O-N 3.33Å; A73-F77 VanDerWaalsContact O-CB 3.26Å; A73-F77 WeakPolarHBondContact O-CB 3.33Å; A73-F77 PolarHBondContact O-N 3.08Å; A73-C222 VanDerWaalsContact CA-SG 3.56Å; A73-S257 WeakPolarHBondContact CB-O 3.06Å; A73-V260 HydrophobicContact CB-CB 3.84Å; A73-V260 HydrophobicContact CB-CG1 3.64Å
74	V	94.4	Very high	92.2	Very high	63 Å²	63	29.7 Å²	29.7	38%	0.382	18%	0.181	S	C	.	.	H	α-helix	trans	-60.4	-40.4	177	171.8	0	0	0	0	111.3	V70 S78 L264	V70-V74 WeakPolarHBondContact O-CG2 3.11Å; V70-V74 PolarHBondContact O-N 3.4Å; V74-S78 VanDerWaalsContact O-CB 3.29Å; V74-S78 WeakPolarHBondContact O-CB 3.35Å; V74-S78 PolarHBondContact O-N 3.49Å; V74-S78 PolarHBondContact O-OG 2.87Å; V74-L264 HydrophobicContact CG2-CD1 3.97Å
75	L	94	Very high	92.3	Very high	56 Å²	56	35.4 Å²	35.4	29%	0.293	21%	0.206	S	C	.	.	H	α-helix	trans	-67.1	-46.8	177.8	-76.3	169.1	0	0	0	112.5	S71 V72 A73 S78 M79 V187	S71-L75 WeakPolarHBondContact O-CB 3.13Å; S71-L75 WeakPolarHBondContact O-CD1 3.39Å; S71-L75 VanDerWaalsContact O-CG 3.23Å; S71-L75 WeakPolarHBondContact O-CG 3.23Å; S71-L75 PolarHBondContact O-N 2.98Å; V72-L75 PolarHBondContact O-N 3.38Å; A73-L75 VanDerWaalsContact C-N 3.31Å; A73-L75 PolarHBondContact O-N 3.47Å; L75-S78 PolarHBondContact O-N 3.4Å; L75-M79 HydrophobicContact CB-CE 4Å; L75-M79 VanDerWaalsContact O-CE 3.23Å; L75-M79 WeakPolarHBondContact O-CE 3.39Å; L75-M79 PolarHBondContact O-N 2.94Å; L75-V187 HydrophobicContact CD1-CG2 3.76Å
76	S	92.7	Very high	92.2	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-59.4	-49.2	177.9	-173.4	0	0	0	0	110.8	V72 A73 S78 M79 D80 C222	V72-S76 WeakPolarHBondContact O-CB 3.5Å; V72-S76 PolarHBondContact O-N 3.5Å; A73-S76 PolarHBondContact O-N 3.33Å; S76-S78 PolarHBondContact O-N 3.49Å; S76-M79 PolarHBondContact O-N 2.79Å; S76-M79 VanDerWaalsContact O-N 3.16Å; S76-D80 PolarHBondContact O-N 2.9Å; S76-C222 VanDerWaalsContact CB-SG 3.5Å
77	F	91.9	Very high	91.9	Very high	15 Å²	15	36.7 Å²	36.7	7%	0.066	21%	0.214	C	C	.	.	H	α-helix	trans	-61.1	-44.3	178.5	-174.4	-111	0	0	0	112.2	A73 M79 D80 L81 Y261 L264 V265 L268	A73-F77 VanDerWaalsContact O-CB 3.26Å; A73-F77 WeakPolarHBondContact O-CB 3.33Å; A73-F77 PolarHBondContact O-N 3.08Å; F77-M79 VanDerWaalsContact C-N 3.28Å; F77-M79 PolarHBondContact O-N 3.22Å; F77-D80 PolarHBondContact O-N 3.43Å; F77-L81 HydrophobicContact CD1-CD1 3.87Å; F77-L81 HydrophobicContact CD1-CG 4.49Å; F77-L81 HydrophobicContact CE1-CD1 3.59Å; F77-L81 HydrophobicContact CE1-CG 4.28Å; F77-L81 HydrophobicContact CZ-CD1 4.04Å; F77-L81 HydrophobicContact CZ-CD2 4.3Å; F77-L81 HydrophobicContact CZ-CG 4.31Å; F77-L81 WeakPolarHBondContact O-CG 3.37Å; F77-L81 PolarHBondContact O-N 2.93Å; F77-Y261 HydrophobicContact CB-CD2 4.16Å; F77-Y261 HydrophobicContact CB-CE2 3.8Å; F77-Y261 HydrophobicContact CD2-CE1 4.38Å; F77-Y261 HydrophobicContact CD2-CE2 4.24Å; F77-Y261 AromaticContact CD2-CZ 3.98Å; F77-L264 HydrophobicContact CB-CD1 4.08Å; F77-L264 HydrophobicContact CD1-CB 3.73Å; F77-L264 HydrophobicContact CD1-CD1 3.98Å; F77-L264 HydrophobicContact CD1-CD2 4.27Å; F77-L264 HydrophobicContact CD1-CG 4.21Å; F77-L264 HydrophobicContact CD2-CB 4Å; F77-L264 HydrophobicContact CE1-CB 3.69Å; F77-L264 HydrophobicContact CE1-CD2 4.26Å; F77-L264 HydrophobicContact CE1-CG 4.42Å; F77-L264 HydrophobicContact CE2-CB 3.99Å; F77-L264 HydrophobicContact CG-CB 3.86Å; F77-L264 HydrophobicContact CG-CD1 4.1Å; F77-L264 HydrophobicContact CZ-CB 3.83Å; F77-L264 WeakPolarHBondContact CZ-O 3.38Å; F77-V265 HydrophobicContact CD2-CG2 4.13Å; F77-V265 HydrophobicContact CE2-CB 4.39Å; F77-V265 HydrophobicContact CE2-CG2 3.78Å; F77-L268 HydrophobicContact CE1-CD1 3.62Å; F77-L268 HydrophobicContact CE1-CG 4.2Å; F77-L268 HydrophobicContact CZ-CB 4.2Å; F77-L268 HydrophobicContact CZ-CD1 3.64Å; F77-L268 HydrophobicContact CZ-CG 3.99Å
78	S	91.5	Very high	91.7	Very high	63 Å²	63	40 Å²	40	44%	0.441	22%	0.223	S	C	.	.	H	α-helix	trans	-62.1	-35.3	176.5	-55.9	0	0	0	0	112.6	V74 L75 S76 L82	V74-S78 VanDerWaalsContact O-CB 3.29Å; V74-S78 WeakPolarHBondContact O-CB 3.35Å; V74-S78 PolarHBondContact O-N 3.49Å; V74-S78 PolarHBondContact O-OG 2.87Å; L75-S78 PolarHBondContact O-N 3.4Å; S76-S78 PolarHBondContact O-N 3.49Å; S78-L82 WeakPolarHBondContact O-CB 3.4Å; S78-L82 PolarHBondContact O-N 2.97Å
79	M	91.5	Very high	91.6	Very high	11 Å²	11	43.9 Å²	43.9	5%	0.054	25%	0.247	C	C	.	.	H	α-helix	trans	-71.7	-45.2	175.1	-77.4	-179.5	-94.5	0	0	111.6	L75 S76 F77 L81 L82 I83 T161 M180 I183	L75-M79 HydrophobicContact CB-CE 4Å; L75-M79 VanDerWaalsContact O-CE 3.23Å; L75-M79 WeakPolarHBondContact O-CE 3.39Å; L75-M79 PolarHBondContact O-N 2.94Å; S76-M79 PolarHBondContact O-N 2.79Å; S76-M79 VanDerWaalsContact O-N 3.16Å; F77-M79 VanDerWaalsContact C-N 3.28Å; F77-M79 PolarHBondContact O-N 3.22Å; M79-L81 PolarHBondContact O-N 2.96Å; M79-L82 PolarHBondContact O-N 3.31Å; M79-L82 VanDerWaalsContact O-N 3.16Å; M79-I83 HydrophobicContact CB-CD1 4.46Å; M79-I83 WeakPolarHBondContact O-CB 3.46Å; M79-I83 WeakPolarHBondContact O-CD1 3.43Å; M79-I83 VanDerWaalsContact O-CG1 3.22Å; M79-I83 WeakPolarHBondContact O-CG1 3.47Å; M79-I83 PolarHBondContact O-N 2.88Å; M79-T161 HydrophobicContact CE-CG2 3.56Å; M79-T161 HydrophobicContact SD-CG2 3.8Å; M79-M180 HydrophobicContact CB-CE 4.3Å; M79-M180 HydrophobicContact CE-CE 3.59Å; M79-M180 HydrophobicContact CE-SD 3.93Å; M79-M180 HydrophobicContact SD-CE 3.78Å; M79-I183 HydrophobicContact CE-CD1 4.31Å
80	D	90.2	Very high	91.3	Very high	28 Å²	28	44.4 Å²	44.4	15%	0.15	25%	0.248	C	C	.	.	H	α-helix	trans	-63.4	-40.1	-179.5	-68.9	-16.4	0	0	0	112.5	S76 F77 L82 I83 G84 K176 Y261 Y277	S76-D80 PolarHBondContact O-N 2.9Å; F77-D80 PolarHBondContact O-N 3.43Å; D80-L82 VanDerWaalsContact C-N 3.34Å; D80-L82 PolarHBondContact O-N 3.23Å; D80-I83 PolarHBondContact O-N 3.04Å; D80-G84 PolarHBondContact O-N 3.34Å; D80-K176 IonicContact OD1-NZ 2.84Å; D80-K176 PolarHBondContact OD1-NZ 3.35Å; D80-K176 IonicContact OD2-NZ 3.88Å; D80-K176 PolarHBondContact OD2-NZ 3.16Å; D80-Y261 PolarHBondContact OD2-OH 2.86Å; D80-Y277 PolarHBondContact OD2-OH 3.2Å
81	L	88.9	Confident	90.9	Very high	62 Å²	62	42.9 Å²	42.9	33%	0.325	24%	0.239	S	C	.	.	H	α-helix	trans	-59	-44.6	172.6	-70.7	172.4	0	0	0	112.1	F77 M79 G84 K85 L268	F77-L81 HydrophobicContact CD1-CD1 3.87Å; F77-L81 HydrophobicContact CD1-CG 4.49Å; F77-L81 HydrophobicContact CE1-CD1 3.59Å; F77-L81 HydrophobicContact CE1-CG 4.28Å; F77-L81 HydrophobicContact CZ-CD1 4.04Å; F77-L81 HydrophobicContact CZ-CD2 4.3Å; F77-L81 HydrophobicContact CZ-CG 4.31Å; F77-L81 WeakPolarHBondContact O-CG 3.37Å; F77-L81 PolarHBondContact O-N 2.93Å; M79-L81 PolarHBondContact O-N 2.96Å; L81-G84 PolarHBondContact O-N 2.94Å; L81-K85 PolarHBondContact O-N 3.46Å; L81-L268 HydrophobicContact CD1-CD1 3.58Å; L81-L268 HydrophobicContact CD2-CD1 3.93Å; L81-L268 HydrophobicContact CG-CD1 4.4Å
82	L	90.5	Very high	90.7	Very high	83 Å²	83	48.8 Å²	48.8	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-71.3	-37.3	-178.9	-174.8	55.3	0	0	0	111.3	S78 M79 D80 L86 T165	S78-L82 WeakPolarHBondContact O-CB 3.4Å; S78-L82 PolarHBondContact O-N 2.97Å; M79-L82 PolarHBondContact O-N 3.31Å; M79-L82 VanDerWaalsContact O-N 3.16Å; D80-L82 VanDerWaalsContact C-N 3.34Å; D80-L82 PolarHBondContact O-N 3.23Å; L82-L86 HydrophobicContact CD1-CD1 4.05Å; L82-L86 HydrophobicContact CD1-CG 4.12Å; L82-L86 HydrophobicContact CG-CD1 3.97Å; L82-L86 HydrophobicContact CG-CG 4.48Å; L82-L86 VanDerWaalsContact O-CB 3.3Å; L82-L86 WeakPolarHBondContact O-CB 3.47Å; L82-L86 WeakPolarHBondContact O-CG 3.43Å; L82-L86 PolarHBondContact O-N 3.48Å; L82-T165 HydrophobicContact CB-CG2 3.95Å; L82-T165 HydrophobicContact CD2-CG2 3.65Å; L82-T165 HydrophobicContact CG-CG2 3.58Å
83	I	89.9	Confident	90.6	Very high	26 Å²	26	52.2 Å²	52.2	13%	0.133	27%	0.274	C	S	.	.	H	α-helix	trans	-63	-46.2	172.4	-67.8	159.4	0	0	0	110.6	M79 D80 L86 T87 T165 L168 S169	M79-I83 HydrophobicContact CB-CD1 4.46Å; M79-I83 WeakPolarHBondContact O-CB 3.46Å; M79-I83 WeakPolarHBondContact O-CD1 3.43Å; M79-I83 VanDerWaalsContact O-CG1 3.22Å; M79-I83 WeakPolarHBondContact O-CG1 3.47Å; M79-I83 PolarHBondContact O-N 2.88Å; D80-I83 PolarHBondContact O-N 3.04Å; I83-L86 PolarHBondContact O-N 3.27Å; I83-T87 VanDerWaalsContact O-CB 3.28Å; I83-T87 WeakPolarHBondContact O-CB 3.44Å; I83-T87 PolarHBondContact O-N 2.64Å; I83-T87 PolarHBondContact O-OG1 3.31Å; I83-T165 HydrophobicContact CG1-CG2 3.89Å; I83-L168 HydrophobicContact CD1-CB 3.97Å; I83-L168 HydrophobicContact CD1-CD1 3.62Å; I83-L168 HydrophobicContact CD1-CG 4.45Å; I83-L168 HydrophobicContact CG1-CB 4.16Å; I83-L168 HydrophobicContact CG2-CB 4.13Å; I83-S169 WeakPolarHBondContact CA-OG 3.29Å
84	G	85.6	Confident	90.4	Very high	37 Å²	37	52.7 Å²	52.7	38%	0.381	28%	0.276	S	S	.	.	H	α-helix	trans	-56.9	-52.7	176.1	0	0	0	0	0	111.8	D80 L81 T87 E88	D80-G84 PolarHBondContact O-N 3.34Å; L81-G84 PolarHBondContact O-N 2.94Å; G84-T87 PolarHBondContact O-N 2.88Å; G84-E88 WeakPolarHBondContact O-CB 3.45Å; G84-E88 PolarHBondContact O-N 2.92Å
85	K	89.4	Confident	90.1	Very high	125 Å²	125	57.6 Å²	57.6	54%	0.543	29%	0.287	S	S	.	.	H	α-helix	trans	-67	-37.1	-179	-73.5	-74.3	156.5	-160.5	0	113.4	L81 E88 V89	L81-K85 PolarHBondContact O-N 3.46Å; K85-E88 VanDerWaalsContact CD-OE2 3.32Å; K85-E88 WeakPolarHBondContact CD-OE2 3.33Å; K85-E88 VanDerWaalsContact CE-OE2 3.28Å; K85-E88 WeakPolarHBondContact CE-OE2 3.29Å; K85-E88 IonicContact NZ-OE1 2.69Å; K85-E88 PolarHBondContact NZ-OE1 3.28Å; K85-E88 IonicContact NZ-OE2 3.18Å; K85-E88 PolarHBondContact NZ-OE2 3.32Å; K85-V89 VanDerWaalsContact O-CG2 3.31Å; K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.41Å
86	L	90.2	Very high	90.1	Very high	59 Å²	59	59.2 Å²	59.2	31%	0.309	30%	0.296	S	S	.	.	H	α-helix	trans	-68.6	-37.3	174.2	-72	170.7	0	0	0	112	L82 I83 V89 R90 M116 T165 S169	L82-L86 HydrophobicContact CD1-CD1 4.05Å; L82-L86 HydrophobicContact CD1-CG 4.12Å; L82-L86 HydrophobicContact CG-CD1 3.97Å; L82-L86 HydrophobicContact CG-CG 4.48Å; L82-L86 VanDerWaalsContact O-CB 3.3Å; L82-L86 WeakPolarHBondContact O-CB 3.47Å; L82-L86 WeakPolarHBondContact O-CG 3.43Å; L82-L86 PolarHBondContact O-N 3.48Å; I83-L86 PolarHBondContact O-N 3.27Å; L86-V89 PolarHBondContact O-N 3.22Å; L86-R90 WeakPolarHBondContact O-CB 3.4Å; L86-R90 PolarHBondContact O-N 2.71Å; L86-M116 HydrophobicContact CB-CE 4.48Å; L86-T165 HydrophobicContact CD1-CG2 4.16Å; L86-S169 WeakPolarHBondContact CB-OG 3.44Å; L86-S169 WeakPolarHBondContact CD1-OG 3.49Å
87	T	87.3	Confident	90	Very high	16 Å²	16	59.9 Å²	59.9	10%	0.098	30%	0.301	C	S	.	.	H	α-helix	trans	-67.9	-39.7	175.7	-53.9	0	0	0	0	111.5	I83 G84 R90 N91 T330	I83-T87 VanDerWaalsContact O-CB 3.28Å; I83-T87 WeakPolarHBondContact O-CB 3.44Å; I83-T87 PolarHBondContact O-N 2.64Å; I83-T87 PolarHBondContact O-OG1 3.31Å; G84-T87 PolarHBondContact O-N 2.88Å; T87-R90 PolarHBondContact O-N 3.15Å; T87-N91 WeakPolarHBondContact O-CB 3.42Å; T87-N91 PolarHBondContact O-N 3.24Å; T87-N91 PolarHBondContact O-OD1 3.39Å; T87-T330 HydrophobicContact CG2-CG2 4.38Å
88	E	88.1	Confident	89.8	Confident	105 Å²	105	60.7 Å²	60.7	49%	0.491	31%	0.311	S	S	.	.	H	α-helix	trans	-60.5	-48.7	172.9	-175.5	-177.8	176.3	0	0	111.3	G84 K85 R90 N91 W92	G84-E88 WeakPolarHBondContact O-CB 3.45Å; G84-E88 PolarHBondContact O-N 2.92Å; K85-E88 VanDerWaalsContact CD-OE2 3.32Å; K85-E88 WeakPolarHBondContact CD-OE2 3.33Å; K85-E88 VanDerWaalsContact CE-OE2 3.28Å; K85-E88 WeakPolarHBondContact CE-OE2 3.29Å; K85-E88 IonicContact NZ-OE1 2.69Å; K85-E88 PolarHBondContact NZ-OE1 3.28Å; K85-E88 IonicContact NZ-OE2 3.18Å; K85-E88 PolarHBondContact NZ-OE2 3.32Å; E88-R90 PolarHBondContact O-N 2.6Å; E88-N91 PolarHBondContact O-N 3.28Å; E88-W92 VanDerWaalsContact O-CB 3.27Å; E88-W92 WeakPolarHBondContact O-CB 3.34Å; E88-W92 PolarHBondContact O-N 3.36Å
89	V	91.9	Very high	89.6	Confident	82 Å²	82	61 Å²	61	50%	0.497	32%	0.324	S	S	.	.	H	α-helix	trans	-62.1	-42	176.1	169.4	0	0	0	0	111.9	K85 L86 W92 L93	K85-V89 VanDerWaalsContact O-CG2 3.31Å; K85-V89 WeakPolarHBondContact O-CG2 3.5Å; K85-V89 PolarHBondContact O-N 3.41Å; L86-V89 PolarHBondContact O-N 3.22Å; V89-W92 PolarHBondContact O-N 3.31Å; V89-L93 WeakPolarHBondContact O-CB 3.22Å; V89-L93 PolarHBondContact O-N 3.4Å
90	R	90	Very high	89.5	Confident	10 Å²	10	65.6 Å²	65.6	4%	0.038	35%	0.352	C	S	.	.	H	α-helix	trans	-57.5	-49.7	174	-175.6	-161.1	72.5	147.3	4.9	111.1	L86 T87 E88 Y94 W109 L112 S170 S327	L86-R90 WeakPolarHBondContact O-CB 3.4Å; L86-R90 PolarHBondContact O-N 2.71Å; T87-R90 PolarHBondContact O-N 3.15Å; E88-R90 PolarHBondContact O-N 2.6Å; R90-Y94 PolarHBondContact O-N 2.66Å; R90-Y94 VanDerWaalsContact O-N 3.11Å; R90-W109 VanDerWaalsContact NH2-CH2 3.35Å; R90-L112 HydrophobicContact CG-CB 4.28Å; R90-L112 HydrophobicContact CG-CD1 4Å; R90-S170 PolarHBondContact NH1-O 3Å; R90-S327 PolarHBondContact NH2-O 2.91Å
91	N	87.2	Confident	89.4	Confident	24 Å²	24	70.4 Å²	70.4	13%	0.128	37%	0.374	C	S	.	.	H	α-helix	trans	-67.9	-37	-179.1	-72.3	2.8	0	0	0	112.1	T87 E88 R95 L328	T87-N91 WeakPolarHBondContact O-CB 3.42Å; T87-N91 PolarHBondContact O-N 3.24Å; T87-N91 PolarHBondContact O-OD1 3.39Å; E88-N91 PolarHBondContact O-N 3.28Å; N91-R95 WeakPolarHBondContact O-CG 3.4Å; N91-R95 PolarHBondContact O-N 3.37Å; N91-R95 VanDerWaalsContact O-N 3.12Å; N91-L328 PolarHBondContact ND2-O 2.86Å
92	W	91.1	Very high	89.2	Confident	157 Å²	157	71.5 Å²	71.5	60%	0.595	38%	0.38	S	S	*	.	H	α-helix	trans	-66.2	-48.1	176.2	175.3	82.9	0	0	0	111.9	E88 V89 Y94 R95 L96	E88-W92 VanDerWaalsContact O-CB 3.27Å; E88-W92 WeakPolarHBondContact O-CB 3.34Å; E88-W92 PolarHBondContact O-N 3.36Å; V89-W92 PolarHBondContact O-N 3.31Å; W92-Y94 VanDerWaalsContact C-N 3.33Å; W92-Y94 PolarHBondContact O-N 2.72Å; W92-R95 PolarHBondContact O-N 3.43Å; W92-R95 VanDerWaalsContact O-N 3.13Å; W92-L96 HydrophobicContact CD2-CD1 3.92Å; W92-L96 HydrophobicContact CE3-CD1 4.01Å; W92-L96 HydrophobicContact CH2-CD1 3.64Å; W92-L96 HydrophobicContact CZ2-CD1 3.52Å; W92-L96 HydrophobicContact CZ3-CD1 3.87Å; W92-L96 PolarHBondContact O-N 2.93Å
93	L	91.9	Very high	89.1	Confident	73 Å²	73	71.1 Å²	71.1	38%	0.382	39%	0.388	S	S	.	.	H	α-helix	trans	-65.8	-36.2	179.7	-169.8	62.9	0	0	0	112	V89 L96 A97 T108 L112	V89-L93 WeakPolarHBondContact O-CB 3.22Å; V89-L93 PolarHBondContact O-N 3.4Å; L93-L96 PolarHBondContact O-N 2.91Å; L93-A97 WeakPolarHBondContact O-CB 3.35Å; L93-A97 PolarHBondContact O-N 3.06Å; L93-T108 HydrophobicContact CD2-CG2 4.4Å; L93-T108 HydrophobicContact CG-CG2 4.03Å; L93-L112 HydrophobicContact CB-CD1 4.35Å; L93-L112 HydrophobicContact CD2-CD1 4.25Å; L93-L112 HydrophobicContact CD2-CD2 4.22Å
94	Y	89.6	Confident	89.1	Confident	10 Å²	10	71.6 Å²	71.6	4%	0.039	40%	0.396	C	S	.	.	H	α-helix	trans	-58.6	-48.6	169.4	171.5	-103	0	0	0	112.1	R90 W92 L96 A97 A98 G105 W109 P318 N319 L328	R90-Y94 PolarHBondContact O-N 2.66Å; R90-Y94 VanDerWaalsContact O-N 3.11Å; W92-Y94 VanDerWaalsContact C-N 3.33Å; W92-Y94 PolarHBondContact O-N 2.72Å; Y94-L96 PolarHBondContact O-N 3.32Å; Y94-A97 PolarHBondContact O-N 3.3Å; Y94-A98 HydrophobicContact CE1-CB 4.46Å; Y94-A98 HydrophobicContact CE2-CB 4.4Å; Y94-A98 VanDerWaalsContact O-CB 3.26Å; Y94-A98 WeakPolarHBondContact O-CB 3.32Å; Y94-A98 PolarHBondContact O-N 3.46Å; Y94-G105 VanDerWaalsContact CD2-O 3.31Å; Y94-G105 WeakPolarHBondContact CD2-O 3.37Å; Y94-G105 WeakPolarHBondContact CE2-O 3.26Å; Y94-W109 HydrophobicContact CD1-CE3 4.49Å; Y94-W109 HydrophobicContact CD2-CB 3.94Å; Y94-W109 HydrophobicContact CD2-CD2 4.49Å; Y94-W109 AromaticContact CD2-CE3 3.89Å; Y94-W109 HydrophobicContact CD2-CE3 3.89Å; Y94-W109 HydrophobicContact CE2-CB 4.22Å; Y94-W109 AromaticContact CG-CE3 3.88Å; Y94-W109 HydrophobicContact CG-CE3 3.88Å; Y94-W109 HydrophobicContact CG-CZ3 4.4Å; Y94-P318 HydrophobicContact CD1-CG 4.31Å; Y94-P318 HydrophobicContact CE1-CB 3.89Å; Y94-P318 HydrophobicContact CE1-CG 3.72Å; Y94-P318 HydrophobicContact CE2-CG 4.25Å; Y94-N319 PolarHBondContact OH-ND2 3.04Å; Y94-N319 PolarHBondContact OH-OD1 2.89Å; Y94-L328 HydrophobicContact CD1-CD2 4.27Å; Y94-L328 HydrophobicContact CE1-CD2 4.49Å
95	R	89.7	Confident	89.3	Confident	166 Å²	166	69.9 Å²	69.9	63%	0.626	38%	0.379	S	S	*	.	H	α-helix	trans	-61.9	-40.6	180	-74.2	175.9	-175.5	-148.8	2.2	112.3	N91 W92 G99	N91-R95 WeakPolarHBondContact O-CG 3.4Å; N91-R95 PolarHBondContact O-N 3.37Å; N91-R95 VanDerWaalsContact O-N 3.12Å; W92-R95 PolarHBondContact O-N 3.43Å; W92-R95 VanDerWaalsContact O-N 3.13Å; R95-G99 PolarHBondContact O-N 2.95Å
96	L	92.8	Very high	89.3	Confident	90 Å²	90	65.9 Å²	65.9	47%	0.471	36%	0.363	S	S	.	.	H	α-helix	trans	-61.8	-50.4	174.2	-72	179.2	0	0	0	111.9	W92 L93 Y94 A98 G99 V100	W92-L96 HydrophobicContact CD2-CD1 3.92Å; W92-L96 HydrophobicContact CE3-CD1 4.01Å; W92-L96 HydrophobicContact CH2-CD1 3.64Å; W92-L96 HydrophobicContact CZ2-CD1 3.52Å; W92-L96 HydrophobicContact CZ3-CD1 3.87Å; W92-L96 PolarHBondContact O-N 2.93Å; L93-L96 PolarHBondContact O-N 2.91Å; Y94-L96 PolarHBondContact O-N 3.32Å; L96-A98 PolarHBondContact O-N 3.12Å; L96-G99 PolarHBondContact O-N 3.14Å; L96-V100 PolarHBondContact O-N 3Å
97	A	90.5	Very high	89.3	Confident	15 Å²	15	70.3 Å²	70.3	12%	0.124	38%	0.38	C	S	.	.	H	α-helix	trans	-63.9	-43.3	-178.7	0	0	0	0	0	112.2	L93 Y94 G99 V100 H101 A104 T108	L93-A97 WeakPolarHBondContact O-CB 3.35Å; L93-A97 PolarHBondContact O-N 3.06Å; Y94-A97 PolarHBondContact O-N 3.3Å; A97-G99 VanDerWaalsContact C-N 3.3Å; A97-G99 PolarHBondContact O-N 3.43Å; A97-V100 PolarHBondContact O-N 2.87Å; A97-H101 PolarHBondContact O-N 2.87Å; A97-H101 VanDerWaalsContact O-N 3.12Å; A97-H101 VanDerWaalsContact O-O 3.07Å; A97-A104 HydrophobicContact CB-CB 4.41Å; A97-T108 HydrophobicContact CB-CG2 4.05Å; A97-T108 WeakPolarHBondContact CB-OG1 3.33Å
98	A	87.8	Confident	89.5	Confident	32 Å²	32	70.8 Å²	70.8	26%	0.264	38%	0.383	S	S	.	.	H	α-helix	trans	-65.1	-31.8	176.8	0	0	0	0	0	113	Y94 L96 V100	Y94-A98 HydrophobicContact CE1-CB 4.46Å; Y94-A98 HydrophobicContact CE2-CB 4.4Å; Y94-A98 VanDerWaalsContact O-CB 3.26Å; Y94-A98 WeakPolarHBondContact O-CB 3.32Å; Y94-A98 PolarHBondContact O-N 3.46Å; L96-A98 PolarHBondContact O-N 3.12Å; A98-V100 VanDerWaalsContact C-N 3.31Å; A98-V100 PolarHBondContact O-N 3.48Å
99	G	88	Confident	89.6	Confident	70 Å²	70	65.9 Å²	65.9	72%	0.722	36%	0.36	S	S	*	.	H	α-helix	trans	-70	-22.7	176	0	0	0	0	0	114.4	R95 L96 A97	R95-G99 PolarHBondContact O-N 2.95Å; L96-G99 PolarHBondContact O-N 3.14Å; A97-G99 VanDerWaalsContact C-N 3.3Å; A97-G99 PolarHBondContact O-N 3.43Å
100	V	88.9	Confident	89.6	Confident	107 Å²	107	63.7 Å²	63.7	65%	0.648	35%	0.345	S	S	*	.	H	α-helix	trans	-84.7	-59.7	171.2	-178.4	0	0	0	0	109.9	L96 A97 A98	L96-V100 PolarHBondContact O-N 3Å; A97-V100 PolarHBondContact O-N 2.87Å; A98-V100 VanDerWaalsContact C-N 3.31Å; A98-V100 PolarHBondContact O-N 3.48Å
101	H	87.6	Confident	89.7	Confident	130 Å²	130	65.2 Å²	65.2	60%	0.602	36%	0.36	S	S	*	.			trans	-146.6	137.2	179.3	-67.2	-33.3	0	0	0	111.3	A97 A103 A104 G105	A97-H101 PolarHBondContact O-N 2.87Å; A97-H101 VanDerWaalsContact O-N 3.12Å; A97-H101 VanDerWaalsContact O-O 3.07Å; H101-A103 VanDerWaalsContact C-N 3.28Å; H101-A103 PolarHBondContact O-N 3.09Å; H101-A104 HydrophobicContact CB-CB 4.13Å; H101-A104 WeakPolarHBondContact O-CB 3.32Å; H101-A104 PolarHBondContact O-N 3.24Å; H101-G105 PolarHBondContact O-N 2.94Å
102	L	86	Confident	89.9	Confident	85 Å²	85	65.9 Å²	65.9	45%	0.445	36%	0.363	S	S	.	.	H	α-helix	trans	-51.6	-44.8	175.4	174.4	60.1	0	0	0	112.6	A104 G105 I106 N319	L102-A104 VanDerWaalsContact C-N 3.33Å; L102-A104 PolarHBondContact O-N 2.79Å; L102-G105 PolarHBondContact O-N 3.41Å; L102-I106 HydrophobicContact CD1-CD1 4.05Å; L102-I106 HydrophobicContact CD1-CG1 4.3Å; L102-I106 HydrophobicContact CG-CD1 4.01Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 2.74Å; L102-N319 WeakPolarHBondContact CD1-ND2 3.43Å
103	A	88.5	Confident	89.8	Confident	74 Å²	74	58.5 Å²	58.5	61%	0.612	34%	0.335	S	S	*	.	H	α-helix	trans	-63.8	-35.9	178.3	0	0	0	0	0	113	H101 I106 F107	H101-A103 VanDerWaalsContact C-N 3.28Å; H101-A103 PolarHBondContact O-N 3.09Å; A103-I106 PolarHBondContact O-N 3.24Å; A103-F107 WeakPolarHBondContact O-CB 3.44Å; A103-F107 PolarHBondContact O-N 3.39Å
104	A	89.4	Confident	89.8	Confident	37 Å²	37	55.7 Å²	55.7	31%	0.306	32%	0.322	S	S	.	.	H	α-helix	trans	-67.3	-43.5	174.4	0	0	0	0	0	110.8	A97 H101 L102 I106 F107 T108	A97-A104 HydrophobicContact CB-CB 4.41Å; H101-A104 HydrophobicContact CB-CB 4.13Å; H101-A104 WeakPolarHBondContact O-CB 3.32Å; H101-A104 PolarHBondContact O-N 3.24Å; L102-A104 VanDerWaalsContact C-N 3.33Å; L102-A104 PolarHBondContact O-N 2.79Å; A104-I106 PolarHBondContact O-N 3.13Å; A104-F107 PolarHBondContact O-N 3.03Å; A104-T108 VanDerWaalsContact O-CB 3.31Å; A104-T108 WeakPolarHBondContact O-CB 3.26Å; A104-T108 PolarHBondContact O-N 3.28Å; A104-T108 PolarHBondContact O-OG1 3.04Å; A104-T108 VanDerWaalsContact O-OG1 3.08Å
105	G	88.8	Confident	89.9	Confident	1 Å²	1	57 Å²	57	1%	0.01	34%	0.338	C	S	.	.	H	α-helix	trans	-55.8	-47.5	172.7	0	0	0	0	0	113.4	Y94 H101 L102 T108 W109	Y94-G105 VanDerWaalsContact CD2-O 3.31Å; Y94-G105 WeakPolarHBondContact CD2-O 3.37Å; Y94-G105 WeakPolarHBondContact CE2-O 3.26Å; H101-G105 PolarHBondContact O-N 2.94Å; L102-G105 PolarHBondContact O-N 3.41Å; G105-T108 PolarHBondContact O-N 3.46Å; G105-W109 PolarHBondContact O-N 3.06Å
106	I	89.1	Confident	90	Very high	41 Å²	41	50.5 Å²	50.5	21%	0.21	32%	0.315	C	S	.	.	H	α-helix	trans	-60.7	-48.7	176.7	-66.3	167.8	0	0	0	110.9	L102 A103 A104 W109 I110 L317 Y320	L102-I106 HydrophobicContact CD1-CD1 4.05Å; L102-I106 HydrophobicContact CD1-CG1 4.3Å; L102-I106 HydrophobicContact CG-CD1 4.01Å; L102-I106 WeakPolarHBondContact O-CG1 3.28Å; L102-I106 PolarHBondContact O-N 2.74Å; A103-I106 PolarHBondContact O-N 3.24Å; A104-I106 PolarHBondContact O-N 3.13Å; I106-W109 PolarHBondContact O-N 3.46Å; I106-I110 HydrophobicContact CG2-CD1 4.02Å; I106-I110 WeakPolarHBondContact O-CG1 3.4Å; I106-I110 PolarHBondContact O-N 2.9Å; I106-I110 VanDerWaalsContact O-N 3.11Å; I106-L317 HydrophobicContact CB-CD2 4.22Å; I106-L317 HydrophobicContact CG1-CD2 4.21Å; I106-L317 HydrophobicContact CG2-CD1 4.04Å; I106-L317 HydrophobicContact CG2-CD2 3.91Å; I106-Y320 HydrophobicContact CD1-CE2 4.26Å
107	F	91.3	Very high	89.9	Confident	151 Å²	151	46.3 Å²	46.3	66%	0.662	29%	0.293	S	S	*	.	H	α-helix	trans	-61.5	-45.7	178.5	-179.7	-97.5	0	0	0	111.8	A103 A104 W109 I110 A111	A103-F107 WeakPolarHBondContact O-CB 3.44Å; A103-F107 PolarHBondContact O-N 3.39Å; A104-F107 PolarHBondContact O-N 3.03Å; F107-W109 PolarHBondContact O-N 2.94Å; F107-I110 PolarHBondContact O-N 3.21Å; F107-A111 HydrophobicContact CE1-CB 4.38Å; F107-A111 WeakPolarHBondContact O-CB 3.37Å; F107-A111 PolarHBondContact O-N 2.95Å
108	T	91.4	Very high	90	Very high	27 Å²	27	48.2 Å²	48.2	17%	0.166	30%	0.301	C	S	.	.	H	α-helix	trans	-60.7	-41.3	176.8	-68.4	0	0	0	0	112.1	L93 A97 A104 G105 L112	L93-T108 HydrophobicContact CD2-CG2 4.4Å; L93-T108 HydrophobicContact CG-CG2 4.03Å; A97-T108 HydrophobicContact CB-CG2 4.05Å; A97-T108 WeakPolarHBondContact CB-OG1 3.33Å; A104-T108 VanDerWaalsContact O-CB 3.31Å; A104-T108 WeakPolarHBondContact O-CB 3.26Å; A104-T108 PolarHBondContact O-N 3.28Å; A104-T108 PolarHBondContact O-OG1 3.04Å; A104-T108 VanDerWaalsContact O-OG1 3.08Å; G105-T108 PolarHBondContact O-N 3.46Å; T108-L112 HydrophobicContact CG2-CD1 3.69Å; T108-L112 HydrophobicContact CG2-CG 4.3Å; T108-L112 VanDerWaalsContact O-CB 3.28Å; T108-L112 WeakPolarHBondContact O-CB 3.44Å; T108-L112 WeakPolarHBondContact O-CD1 3.39Å; T108-L112 WeakPolarHBondContact O-CG 3.19Å; T108-L112 PolarHBondContact O-N 2.99Å
109	W	90.9	Very high	90.2	Very high	1 Å²	1	48.6 Å²	48.6	0%	0.004	30%	0.304	C	S	.	.	H	α-helix	trans	-61.2	-51.5	175.4	-172.4	-100.5	0	0	0	111.6	R90 Y94 G105 I106 F107 A111 L112 V113 A313 T316 L317 P318 L328	R90-W109 VanDerWaalsContact NH2-CH2 3.35Å; Y94-W109 HydrophobicContact CD1-CE3 4.49Å; Y94-W109 HydrophobicContact CD2-CB 3.94Å; Y94-W109 HydrophobicContact CD2-CD2 4.49Å; Y94-W109 AromaticContact CD2-CE3 3.89Å; Y94-W109 HydrophobicContact CD2-CE3 3.89Å; Y94-W109 HydrophobicContact CE2-CB 4.22Å; Y94-W109 AromaticContact CG-CE3 3.88Å; Y94-W109 HydrophobicContact CG-CE3 3.88Å; Y94-W109 HydrophobicContact CG-CZ3 4.4Å; G105-W109 PolarHBondContact O-N 3.06Å; I106-W109 PolarHBondContact O-N 3.46Å; F107-W109 PolarHBondContact O-N 2.94Å; W109-A111 PolarHBondContact O-N 3.06Å; W109-L112 PolarHBondContact O-N 3.14Å; W109-V113 WeakPolarHBondContact O-CG2 3.38Å; W109-V113 PolarHBondContact O-N 2.88Å; W109-A313 VanDerWaalsContact CD1-O 3.25Å; W109-A313 PolarHBondContact NE1-O 3.48Å; W109-T316 PolarHBondContact NE1-O 3.39Å; W109-T316 PolarHBondContact NE1-OG1 3.18Å; W109-L317 HydrophobicContact CB-CD2 4.04Å; W109-L317 HydrophobicContact CG-CD2 4.1Å; W109-P318 HydrophobicContact CD2-CG 4.19Å; W109-P318 HydrophobicContact CE3-CG 4.04Å; W109-P318 HydrophobicContact CH2-CG 3.97Å; W109-P318 HydrophobicContact CZ2-CG 4.15Å; W109-P318 HydrophobicContact CZ3-CG 3.93Å; W109-L328 HydrophobicContact CH2-CD2 4.23Å; W109-L328 HydrophobicContact CZ3-CD2 4.04Å
110	I	90.7	Very high	90.4	Very high	37 Å²	37	45.3 Å²	45.3	19%	0.19	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-43.3	-179	-63.6	171.1	0	0	0	111	I106 F107 S114 V310 A313 I314 L317	I106-I110 HydrophobicContact CG2-CD1 4.02Å; I106-I110 WeakPolarHBondContact O-CG1 3.4Å; I106-I110 PolarHBondContact O-N 2.9Å; I106-I110 VanDerWaalsContact O-N 3.11Å; F107-I110 PolarHBondContact O-N 3.21Å; I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.2Å; I110-S114 PolarHBondContact O-N 2.98Å; I110-S114 PolarHBondContact O-OG 3.25Å; I110-V310 HydrophobicContact CG2-CB 4.41Å; I110-V310 HydrophobicContact CG2-CG1 4.05Å; I110-V310 HydrophobicContact CG2-CG2 3.99Å; I110-A313 HydrophobicContact CB-CB 4.35Å; I110-A313 HydrophobicContact CG1-CB 4.02Å; I110-A313 HydrophobicContact CG2-CB 4.5Å; I110-I314 HydrophobicContact CD1-CG1 3.84Å; I110-I314 HydrophobicContact CG1-CG1 4.43Å; I110-L317 HydrophobicContact CG1-CD2 4.46Å
111	A	92.1	Very high	90.5	Very high	42 Å²	42	40.4 Å²	40.4	35%	0.347	24%	0.24	S	C	.	.	H	α-helix	trans	-65.9	-38.7	178.7	0	0	0	0	0	112.8	F107 W109 G115	F107-A111 HydrophobicContact CE1-CB 4.38Å; F107-A111 WeakPolarHBondContact O-CB 3.37Å; F107-A111 PolarHBondContact O-N 2.95Å; W109-A111 PolarHBondContact O-N 3.06Å; A111-G115 WeakPolarHBondContact O-CA 3.33Å; A111-G115 PolarHBondContact O-N 2.86Å
112	L	91.7	Very high	90.6	Very high	38 Å²	38	37 Å²	37	20%	0.199	23%	0.229	C	C	.	.	H	α-helix	trans	-67.1	-53.6	176	-77	168.9	0	0	0	111.6	R90 L93 T108 W109 S114 G115 M116	R90-L112 HydrophobicContact CG-CB 4.28Å; R90-L112 HydrophobicContact CG-CD1 4Å; L93-L112 HydrophobicContact CB-CD1 4.35Å; L93-L112 HydrophobicContact CD2-CD1 4.25Å; L93-L112 HydrophobicContact CD2-CD2 4.22Å; T108-L112 HydrophobicContact CG2-CD1 3.69Å; T108-L112 HydrophobicContact CG2-CG 4.3Å; T108-L112 VanDerWaalsContact O-CB 3.28Å; T108-L112 WeakPolarHBondContact O-CB 3.44Å; T108-L112 WeakPolarHBondContact O-CD1 3.39Å; T108-L112 WeakPolarHBondContact O-CG 3.19Å; T108-L112 PolarHBondContact O-N 2.99Å; W109-L112 PolarHBondContact O-N 3.14Å; L112-S114 PolarHBondContact O-N 3.24Å; L112-G115 PolarHBondContact O-N 3.45Å; L112-M116 WeakPolarHBondContact O-CB 3.46Å; L112-M116 WeakPolarHBondContact O-CG 3.19Å; L112-M116 PolarHBondContact O-N 2.69Å
113	V	90.2	Very high	90.9	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.012	22%	0.216	C	C	.	.	H	α-helix	trans	-60.2	-49	-178.3	176.6	0	0	0	0	110.2	W109 T117 L172 A313	W109-V113 WeakPolarHBondContact O-CG2 3.38Å; W109-V113 PolarHBondContact O-N 2.88Å; V113-T117 VanDerWaalsContact O-CG2 3.3Å; V113-T117 WeakPolarHBondContact O-CG2 3.28Å; V113-T117 PolarHBondContact O-N 3.43Å; V113-T117 PolarHBondContact O-OG1 2.86Å; V113-T117 VanDerWaalsContact O-OG1 3.11Å; V113-L172 HydrophobicContact CG1-CD2 4.42Å; V113-A313 HydrophobicContact CB-CB 3.83Å; V113-A313 HydrophobicContact CG1-CB 3.94Å; V113-A313 HydrophobicContact CG2-CB 4.22Å
114	S	90.5	Very high	91	Very high	14 Å²	14	30.9 Å²	30.9	10%	0.098	19%	0.187	C	C	.	.	H	α-helix	trans	-72.3	-32.1	-178.8	66.3	0	0	0	0	114.3	I110 L112 T117 L118 S309	I110-S114 VanDerWaalsContact O-CB 3.25Å; I110-S114 WeakPolarHBondContact O-CB 3.2Å; I110-S114 PolarHBondContact O-N 2.98Å; I110-S114 PolarHBondContact O-OG 3.25Å; L112-S114 PolarHBondContact O-N 3.24Å; S114-T117 WeakPolarHBondContact CA-OG1 3.45Å; S114-T117 PolarHBondContact O-OG1 2.89Å; S114-L118 VanDerWaalsContact O-CB 3.22Å; S114-L118 WeakPolarHBondContact O-CB 3.44Å; S114-L118 PolarHBondContact O-N 2.83Å; S114-L118 VanDerWaalsContact O-N 3.07Å; S114-S309 WeakPolarHBondContact CA-OG 3.39Å
115	G	92.3	Very high	90.9	Very high	37 Å²	37	31.1 Å²	31.1	38%	0.381	18%	0.182	S	C	.	.	H	α-helix	trans	-68.4	-41.7	173.9	0	0	0	0	0	112.5	A111 L112 A119	A111-G115 WeakPolarHBondContact O-CA 3.33Å; A111-G115 PolarHBondContact O-N 2.86Å; L112-G115 PolarHBondContact O-N 3.45Å; G115-A119 WeakPolarHBondContact O-CB 2.91Å; G115-A119 PolarHBondContact O-N 2.86Å
116	M	92.7	Very high	90.9	Very high	30 Å²	30	38.9 Å²	38.9	15%	0.148	21%	0.212	C	C	.	.	H	α-helix	trans	-70.3	-43.6	178.5	-67.5	171.6	80.2	0	0	111.7	L86 L112 L118 A119 S120 I166 S169	L86-M116 HydrophobicContact CB-CE 4.48Å; L112-M116 WeakPolarHBondContact O-CB 3.46Å; L112-M116 WeakPolarHBondContact O-CG 3.19Å; L112-M116 PolarHBondContact O-N 2.69Å; M116-L118 PolarHBondContact O-N 3.43Å; M116-A119 PolarHBondContact O-N 3.18Å; M116-S120 PolarHBondContact O-N 3.17Å; M116-I166 HydrophobicContact CB-CG2 4.09Å; M116-I166 WeakPolarHBondContact O-CG2 3.38Å; M116-S169 VanDerWaalsContact CE-C 3.47Å; M116-S169 WeakPolarHBondContact CE-O 3.4Å
117	T	90.2	Very high	90.9	Very high	1 Å²	1	40.3 Å²	40.3	1%	0.006	22%	0.219	C	C	.	.	H	α-helix	trans	-62.7	-42.3	174.8	55.7	0	0	0	0	111.9	V113 S114 A119 S120 V121 L172 S309	V113-T117 VanDerWaalsContact O-CG2 3.3Å; V113-T117 WeakPolarHBondContact O-CG2 3.28Å; V113-T117 PolarHBondContact O-N 3.43Å; V113-T117 PolarHBondContact O-OG1 2.86Å; V113-T117 VanDerWaalsContact O-OG1 3.11Å; S114-T117 WeakPolarHBondContact CA-OG1 3.45Å; S114-T117 PolarHBondContact O-OG1 2.89Å; T117-A119 PolarHBondContact O-N 3.46Å; T117-S120 WeakPolarHBondContact O-CB 3.22Å; T117-S120 PolarHBondContact O-N 3.36Å; T117-V121 WeakPolarHBondContact O-CG2 3.35Å; T117-V121 PolarHBondContact O-N 3.3Å; T117-L172 HydrophobicContact CG2-CD1 3.57Å; T117-L172 HydrophobicContact CG2-CD2 4.26Å; T117-L172 HydrophobicContact CG2-CG 3.93Å; T117-S309 WeakPolarHBondContact OG1-CB 3.28Å; T117-S309 PolarHBondContact OG1-OG 3.44Å
118	L	91.3	Very high	90.7	Very high	56 Å²	56	33.9 Å²	33.9	29%	0.293	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-42.3	174.7	-178.2	61.9	0	0	0	111.6	S114 M116 S120 V121 V122 Y302	S114-L118 VanDerWaalsContact O-CB 3.22Å; S114-L118 WeakPolarHBondContact O-CB 3.44Å; S114-L118 PolarHBondContact O-N 2.83Å; S114-L118 VanDerWaalsContact O-N 3.07Å; M116-L118 PolarHBondContact O-N 3.43Å; L118-S120 PolarHBondContact O-N 3.49Å; L118-V121 PolarHBondContact O-N 3.47Å; L118-V122 WeakPolarHBondContact O-CG2 3.38Å; L118-V122 PolarHBondContact O-N 3.38Å; L118-Y302 HydrophobicContact CD1-CD1 4.23Å
119	A	92.8	Very high	90.5	Very high	40 Å²	40	35.8 Å²	35.8	33%	0.331	21%	0.206	S	C	.	.	H	α-helix	trans	-61.4	-41	174.2	0	0	0	0	0	112.2	G115 M116 T117 V122 V123 I166	G115-A119 WeakPolarHBondContact O-CB 2.91Å; G115-A119 PolarHBondContact O-N 2.86Å; M116-A119 PolarHBondContact O-N 3.18Å; T117-A119 PolarHBondContact O-N 3.46Å; A119-V122 PolarHBondContact O-N 3.16Å; A119-V123 WeakPolarHBondContact O-CB 3.25Å; A119-V123 VanDerWaalsContact O-CG2 3.31Å; A119-V123 WeakPolarHBondContact O-CG2 3.46Å; A119-V123 PolarHBondContact O-N 3.14Å; A119-I166 HydrophobicContact CB-CG2 4.22Å
120	S	92.2	Very high	90.3	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.3	-42.2	173.6	-178.5	0	0	0	0	112.2	M116 T117 L118 S124 G163	M116-S120 PolarHBondContact O-N 3.17Å; T117-S120 WeakPolarHBondContact O-CB 3.22Å; T117-S120 PolarHBondContact O-N 3.36Å; L118-S120 PolarHBondContact O-N 3.49Å; S120-S124 VanDerWaalsContact O-CB 3.26Å; S120-S124 WeakPolarHBondContact O-CB 3.5Å; S120-S124 PolarHBondContact O-N 3.46Å; S120-S124 PolarHBondContact O-OG 3.13Å; S120-G163 PolarHBondContact OG-O 3.13Å
121	V	90.8	Very high	90.2	Very high	4 Å²	4	35 Å²	35	2%	0.024	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-45.6	174.1	174.1	0	0	0	0	111.3	T117 L118 S124 H125 Y302 P305 P382 I383	T117-V121 WeakPolarHBondContact O-CG2 3.35Å; T117-V121 PolarHBondContact O-N 3.3Å; L118-V121 PolarHBondContact O-N 3.47Å; V121-S124 PolarHBondContact O-N 3.22Å; V121-H125 WeakPolarHBondContact O-CB 3.48Å; V121-H125 PolarHBondContact O-N 3.47Å; V121-Y302 HydrophobicContact CG1-CD1 3.94Å; V121-Y302 HydrophobicContact CG1-CE1 4.17Å; V121-P305 HydrophobicContact CG1-CG 4.36Å; V121-P305 HydrophobicContact CG2-CB 3.78Å; V121-P305 HydrophobicContact CG2-CG 3.82Å; V121-P382 HydrophobicContact CG1-CG 4.47Å; V121-P382 HydrophobicContact CG2-CG 4.26Å; V121-I383 HydrophobicContact CG2-CG2 3.44Å; V121-I383 VanDerWaalsContact CG2-CG2 3.44Å
122	V	90.9	Very high	90	Very high	60 Å²	60	35.1 Å²	35.1	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-60.3	-49.7	178.2	167.5	0	0	0	0	110.9	L118 A119 S124 H125 Y126 Y302	L118-V122 WeakPolarHBondContact O-CG2 3.38Å; L118-V122 PolarHBondContact O-N 3.38Å; A119-V122 PolarHBondContact O-N 3.16Å; V122-S124 PolarHBondContact O-N 3.09Å; V122-H125 PolarHBondContact O-N 2.9Å; V122-Y126 HydrophobicContact CB-CD2 4.48Å; V122-Y126 HydrophobicContact CG1-CD2 3.86Å; V122-Y126 HydrophobicContact CG1-CE2 4.26Å; V122-Y126 WeakPolarHBondContact O-CB 3.24Å; V122-Y126 WeakPolarHBondContact O-CD2 3.28Å; V122-Y126 PolarHBondContact O-N 3.26Å; V122-Y302 HydrophobicContact CG2-CE1 4.47Å
123	V	92.3	Very high	89.7	Confident	30 Å²	30	34 Å²	34	18%	0.182	20%	0.195	C	C	.	.	H	α-helix	trans	-56.5	-52	176	166.6	0	0	0	0	110.9	A119 H125 I127 L162 I166	A119-V123 WeakPolarHBondContact O-CB 3.25Å; A119-V123 VanDerWaalsContact O-CG2 3.31Å; A119-V123 WeakPolarHBondContact O-CG2 3.46Å; A119-V123 PolarHBondContact O-N 3.14Å; V123-H125 VanDerWaalsContact C-N 3.32Å; V123-H125 PolarHBondContact O-N 3.38Å; V123-I127 HydrophobicContact CG1-CD1 3.98Å; V123-I127 WeakPolarHBondContact O-CB 3.24Å; V123-I127 WeakPolarHBondContact O-CG1 3.41Å; V123-I127 PolarHBondContact O-N 3.41Å; V123-I127 VanDerWaalsContact O-N 3.11Å; V123-L162 HydrophobicContact CG1-CB 3.84Å; V123-I166 HydrophobicContact CG2-CD1 4.14Å
124	S	88.8	Confident	89.6	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-61.3	-41.2	-178.1	-56	0	0	0	0	112.2	S120 V121 V122 S128 S159 P384	S120-S124 VanDerWaalsContact O-CB 3.26Å; S120-S124 WeakPolarHBondContact O-CB 3.5Å; S120-S124 PolarHBondContact O-N 3.46Å; S120-S124 PolarHBondContact O-OG 3.13Å; V121-S124 PolarHBondContact O-N 3.22Å; V122-S124 PolarHBondContact O-N 3.09Å; S124-S128 CarbonylContact O-C 3.5Å; S124-S128 PolarHBondContact O-N 3.08Å; S124-S159 WeakPolarHBondContact CA-OG 3.22Å; S124-S159 PolarHBondContact O-OG 3.01Å; S124-P384 WeakPolarHBondContact OG-CD 3.46Å
125	H	87.8	Confident	89.5	Confident	42 Å²	42	34.1 Å²	34.1	19%	0.194	20%	0.196	C	C	.	.	H	α-helix	trans	-80.3	-41.4	-173.9	-170.9	-81.2	0	0	0	113.5	V121 V122 V123 P129 R301	V121-H125 WeakPolarHBondContact O-CB 3.48Å; V121-H125 PolarHBondContact O-N 3.47Å; V122-H125 PolarHBondContact O-N 2.9Å; V123-H125 VanDerWaalsContact C-N 3.32Å; V123-H125 PolarHBondContact O-N 3.38Å; H125-P129 WeakPolarHBondContact O-CG 3.45Å; H125-R301 PolarHBondContact CE1-NE 2.9Å; H125-R301 VanDerWaalsContact CE1-NE 3.32Å; H125-R301 PolarHBondContact CE1-NH2 3.47Å; H125-R301 VanDerWaalsContact CE1-NH2 3.27Å; H125-R301 VanDerWaalsContact NE2-CZ 3.32Å; H125-R301 PolarHBondContact NE2-NE 2.93Å; H125-R301 PolarHBondContact NE2-NH2 3.42Å
126	Y	88.6	Confident	89.5	Confident	164 Å²	164	32.6 Å²	32.6	64%	0.643	18%	0.179	S	C	*	.	H	α-helix	trans	-84.4	-30.9	-176.9	-77.3	-85.7	0	0	0	113.6	V122 Y302	V122-Y126 HydrophobicContact CB-CD2 4.48Å; V122-Y126 HydrophobicContact CG1-CD2 3.86Å; V122-Y126 HydrophobicContact CG1-CE2 4.26Å; V122-Y126 WeakPolarHBondContact O-CB 3.24Å; V122-Y126 WeakPolarHBondContact O-CD2 3.28Å; V122-Y126 PolarHBondContact O-N 3.26Å; Y126-Y302 VanDerWaalsContact CE2-OH 3.29Å; Y126-Y302 WeakPolarHBondContact CE2-OH 3.4Å; Y126-Y302 PolarHBondContact OH-OH 3.33Å
127	I	89.5	Confident	89.3	Confident	71 Å²	71	31.5 Å²	31.5	36%	0.364	18%	0.175	S	C	.	.	H	α-helix	trans	-82.4	-51.1	178.7	-56	-178.1	0	0	0	111	V123	V123-I127 HydrophobicContact CG1-CD1 3.98Å; V123-I127 WeakPolarHBondContact O-CB 3.24Å; V123-I127 WeakPolarHBondContact O-CG1 3.41Å; V123-I127 PolarHBondContact O-N 3.41Å; V123-I127 VanDerWaalsContact O-N 3.11Å
128	S	88	Confident	89.3	Confident	16 Å²	16	31.6 Å²	31.6	11%	0.112	18%	0.175	C	C	.	.			trans	-165.3	98.8	-179.1	-152.1	0	0	0	0	112.7	S124 P130 A131 T156 S159	S124-S128 CarbonylContact O-C 3.5Å; S124-S128 PolarHBondContact O-N 3.08Å; S128-P130 VanDerWaalsContact C-N 3.3Å; S128-P130 VanDerWaalsContact O-N 3.16Å; S128-A131 WeakPolarHBondContact O-CB 3.48Å; S128-A131 PolarHBondContact O-N 3.42Å; S128-T156 VanDerWaalsContact OG-CG2 3.24Å; S128-T156 WeakPolarHBondContact OG-CG2 3.5Å; S128-S159 PolarHBondContact O-OG 3.11Å
129	P	86.5	Confident	89.4	Confident	66 Å²	66	28.9 Å²	28.9	43%	0.429	16%	0.161	S	C	.	.	G	3₁₀ helix	trans	-51	-33.6	179.1	-28.1	34.2	0	0	0	116.4	H125 A131 I132	H125-P129 WeakPolarHBondContact O-CG 3.45Å; P129-A131 PolarHBondContact O-N 3.05Å; P129-I132 WeakPolarHBondContact O-CB 3.4Å; P129-I132 WeakPolarHBondContact O-CG1 3.24Å; P129-I132 PolarHBondContact O-N 3.19Å; P129-I132 VanDerWaalsContact O-N 3.15Å
130	P	87.6	Confident	89.3	Confident	22 Å²	22	27.8 Å²	27.8	14%	0.143	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-63.9	-0.1	173.5	-22.8	35.1	0	0	0	115.4	S128 E150 Y151 T156	S128-P130 VanDerWaalsContact C-N 3.3Å; S128-P130 VanDerWaalsContact O-N 3.16Å; P130-E150 HydrophobicContact CG-CB 4.45Å; P130-Y151 HydrophobicContact CB-CD1 3.64Å; P130-Y151 HydrophobicContact CB-CD2 4.17Å; P130-Y151 HydrophobicContact CB-CE1 3.62Å; P130-Y151 HydrophobicContact CB-CE2 4.17Å; P130-Y151 HydrophobicContact CB-CG 3.92Å; P130-Y151 WeakPolarHBondContact O-CD1 3.43Å; P130-T156 HydrophobicContact CB-CG2 3.84Å; P130-T156 HydrophobicContact CG-CG2 4.44Å
131	A	88.1	Confident	89	Confident	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	-75.3	-20.4	169.9	0	0	0	0	0	113.9	S128 P129 S159 K160	S128-A131 WeakPolarHBondContact O-CB 3.48Å; S128-A131 PolarHBondContact O-N 3.42Å; P129-A131 PolarHBondContact O-N 3.05Å; A131-S159 VanDerWaalsContact CB-OG 3.31Å; A131-S159 WeakPolarHBondContact CB-OG 3.36Å; A131-K160 HydrophobicContact CB-CB 3.9Å; A131-K160 HydrophobicContact CB-CG 4.35Å; A131-K160 PolarHBondContact O-NZ 3.45Å
132	I	87	Confident	88.9	Confident	45 Å²	45	28.3 Å²	28.3	23%	0.231	15%	0.151	C	C	.	.	S	Bend	trans	-67.9	139	-168	-67.5	169	0	0	0	113.3	P129 P382	P129-I132 WeakPolarHBondContact O-CB 3.4Å; P129-I132 WeakPolarHBondContact O-CG1 3.24Å; P129-I132 PolarHBondContact O-N 3.19Å; P129-I132 VanDerWaalsContact O-N 3.15Å; I132-P382 HydrophobicContact CD1-CB 4.43Å; I132-P382 HydrophobicContact CG2-CB 4.15Å
133	G	86.2	Confident	88.7	Confident	13 Å²	13	26.9 Å²	26.9	13%	0.134	14%	0.141	C	C	.	.	S	Bend	trans	72.9	-165.3	-178.5	0	0	0	0	0	113.8	K160 I383 S385	G133-K160 PolarHBondContact O-NZ 2.71Å; G133-I383 VanDerWaalsContact CA-O 3.31Å; G133-I383 WeakPolarHBondContact CA-O 3.33Å; G133-I383 PolarHBondContact N-O 3.11Å; G133-S385 CarbonylContact C-O 3.57Å
134	S	88.3	Confident	88.1	Confident	19 Å²	19	27.5 Å²	27.5	13%	0.133	14%	0.14	C	C	.	.			trans	-59.2	-62.3	-176.4	165.1	0	0	0	0	113.3	I136 K160 G178 P179 S385	S134-I136 PolarHBondContact OG-N 3.22Å; S134-K160 VanDerWaalsContact O-CE 3.26Å; S134-K160 WeakPolarHBondContact O-CE 3.26Å; S134-K160 PolarHBondContact O-NZ 3.17Å; S134-G178 CarbonylContact O-C 3.51Å; S134-G178 WeakPolarHBondContact OG-CA 3.29Å; S134-P179 WeakPolarHBondContact O-CA 3.37Å; S134-S385 WeakPolarHBondContact CA-O 3.21Å; S134-S385 PolarHBondContact N-O 3.3Å
135	G	88.1	Confident	87.5	Confident	1 Å²	1	28 Å²	28	1%	0.01	15%	0.145	C	C	.	.			trans	98.3	-14.5	-172.3	0	0	0	0	0	114.1	E138 I139	G135-E138 VanDerWaalsContact CA-OE2 3.32Å; G135-E138 WeakPolarHBondContact CA-OE2 3.39Å; G135-E138 PolarHBondContact O-N 3.2Å; G135-I139 WeakPolarHBondContact O-CG1 3.16Å; G135-I139 PolarHBondContact O-N 3.34Å
136	I	92	Very high	87.2	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.021	14%	0.144	C	C	.	.	H	α-helix	trans	-55	-46.4	169.3	-72.8	175	0	0	0	112.4	S134 E138 I139 K140 V181 V237 Y478	S134-I136 PolarHBondContact OG-N 3.22Å; I136-E138 VanDerWaalsContact C-N 3.3Å; I136-E138 PolarHBondContact O-N 2.7Å; I136-I139 PolarHBondContact O-N 3.49Å; I136-K140 WeakPolarHBondContact O-CB 3.47Å; I136-K140 PolarHBondContact O-N 3.06Å; I136-V181 HydrophobicContact CD1-CG2 3.94Å; I136-V181 HydrophobicContact CG1-CB 4.04Å; I136-V181 HydrophobicContact CG1-CG1 4.35Å; I136-V181 HydrophobicContact CG1-CG2 3.99Å; I136-V237 HydrophobicContact CG2-CG1 3.42Å; I136-V237 VanDerWaalsContact CG2-CG1 3.42Å; I136-Y478 HydrophobicContact CB-CD1 3.93Å; I136-Y478 HydrophobicContact CB-CE1 3.98Å; I136-Y478 HydrophobicContact CD1-CD1 4.48Å; I136-Y478 HydrophobicContact CD1-CE1 3.72Å; I136-Y478 HydrophobicContact CD1-CE2 4.46Å; I136-Y478 HydrophobicContact CG1-CE1 4.43Å; I136-Y478 HydrophobicContact CG2-CD1 3.53Å; I136-Y478 HydrophobicContact CG2-CD2 4.14Å; I136-Y478 HydrophobicContact CG2-CE1 3.84Å; I136-Y478 HydrophobicContact CG2-CE2 4.39Å; I136-Y478 HydrophobicContact CG2-CG 3.69Å
137	P	89.3	Confident	86.7	Confident	8 Å²	8	23.3 Å²	23.3	5%	0.052	14%	0.136	C	C	.	.	H	α-helix	trans	-53.2	-46.1	176.1	-30	38.6	0	0	0	112.9	K140 T141 I482 L487	P137-K140 PolarHBondContact O-N 2.93Å; P137-T141 WeakPolarHBondContact O-CG2 3.44Å; P137-T141 PolarHBondContact O-N 3.02Å; P137-T141 VanDerWaalsContact O-N 3.09Å; P137-I482 HydrophobicContact CB-CG1 3.73Å; P137-L487 HydrophobicContact CB-CD1 4.01Å
138	E	90.5	Very high	86.4	Confident	2 Å²	2	21.5 Å²	21.5	1%	0.009	13%	0.128	C	C	.	.	H	α-helix	trans	-65.7	-44.9	179.2	-66.8	94.8	145.3	0	0	112.3	G135 I136 K140 T141 I142 L148 Y151 K485 L487	G135-E138 VanDerWaalsContact CA-OE2 3.32Å; G135-E138 WeakPolarHBondContact CA-OE2 3.39Å; G135-E138 PolarHBondContact O-N 3.2Å; I136-E138 VanDerWaalsContact C-N 3.3Å; I136-E138 PolarHBondContact O-N 2.7Å; E138-K140 VanDerWaalsContact C-N 3.33Å; E138-K140 PolarHBondContact O-N 3.39Å; E138-T141 PolarHBondContact O-N 2.95Å; E138-T141 VanDerWaalsContact O-N 3.09Å; E138-T141 PolarHBondContact O-OG1 2.97Å; E138-I142 WeakPolarHBondContact O-CG1 3.42Å; E138-I142 PolarHBondContact O-N 2.76Å; E138-L148 HydrophobicContact CB-CD1 4.39Å; E138-L148 HydrophobicContact CG-CD1 4.47Å; E138-Y151 HydrophobicContact CB-CD1 4.11Å; E138-Y151 HydrophobicContact CB-CE1 4.38Å; E138-Y151 HydrophobicContact CG-CD1 3.79Å; E138-Y151 HydrophobicContact CG-CE1 3.55Å; E138-Y151 HydrophobicContact CG-CG 4.45Å; E138-Y151 WeakPolarHBondContact OE1-CE1 3.38Å; E138-K485 VanDerWaalsContact CD-NZ 3.34Å; E138-K485 IonicContact OE1-NZ 3.12Å; E138-K485 PolarHBondContact OE1-NZ 2.99Å; E138-K485 IonicContact OE2-NZ 2.65Å; E138-K485 PolarHBondContact OE2-NZ 3.23Å; E138-L487 HydrophobicContact CG-CD1 3.84Å; E138-L487 HydrophobicContact CG-CD2 4.36Å
139	I	92	Very high	86.1	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-60	-41.5	174.1	-69.2	-57.6	0	0	0	111.8	G135 I136 T141 I142 L143 L152 S185 I212 C216 T238	G135-I139 WeakPolarHBondContact O-CG1 3.16Å; G135-I139 PolarHBondContact O-N 3.34Å; I136-I139 PolarHBondContact O-N 3.49Å; I139-T141 VanDerWaalsContact C-N 3.27Å; I139-T141 PolarHBondContact O-N 3.44Å; I139-I142 HydrophobicContact CD1-CD1 4.13Å; I139-I142 PolarHBondContact O-N 3.24Å; I139-I142 VanDerWaalsContact O-N 3.13Å; I139-L143 HydrophobicContact CG2-CD1 4.45Å; I139-L143 PolarHBondContact O-N 2.81Å; I139-L152 HydrophobicContact CD1-CD2 4.27Å; I139-S185 WeakPolarHBondContact CD1-OG 3.12Å; I139-I212 HydrophobicContact CD1-CG2 4.45Å; I139-C216 WeakPolarHBondContact CG2-SG 3.17Å; I139-T238 HydrophobicContact CG2-CG2 4.12Å
140	K	90.4	Very high	86	Confident	16 Å²	16	32.4 Å²	32.4	7%	0.07	17%	0.168	C	C	.	.	H	α-helix	trans	-61.2	-33.8	174.5	-164.5	179	-169	-179.4	0	111.8	I136 P137 E138 R144 V237 D479 I482 Y489	I136-K140 WeakPolarHBondContact O-CB 3.47Å; I136-K140 PolarHBondContact O-N 3.06Å; P137-K140 PolarHBondContact O-N 2.93Å; E138-K140 VanDerWaalsContact C-N 3.33Å; E138-K140 PolarHBondContact O-N 3.39Å; K140-R144 WeakPolarHBondContact O-CG 3.41Å; K140-R144 PolarHBondContact O-N 3.06Å; K140-V237 WeakPolarHBondContact CD-O 3.23Å; K140-V237 WeakPolarHBondContact CE-O 3.22Å; K140-D479 IonicContact NZ-OD1 2.63Å; K140-D479 PolarHBondContact NZ-OD1 2.93Å; K140-D479 IonicContact NZ-OD2 2.84Å; K140-D479 PolarHBondContact NZ-OD2 2.9Å; K140-I482 HydrophobicContact CB-CD1 4.26Å; K140-I482 HydrophobicContact CD-CD1 3.93Å; K140-I482 HydrophobicContact CG-CD1 4.3Å; K140-Y489 HydrophobicContact CD-CE2 4.35Å; K140-Y489 WeakPolarHBondContact CE-OH 3.45Å; K140-Y489 HydrophobicContact CG-CE2 4.13Å; K140-Y489 PolarHBondContact NZ-OH 3.33Å
141	T	87.2	Confident	86.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-75.2	-35.6	171.6	69.2	0	0	0	0	113.9	P137 E138 I139 R144 V146 L148 I482 L487 Y489	P137-T141 WeakPolarHBondContact O-CG2 3.44Å; P137-T141 PolarHBondContact O-N 3.02Å; P137-T141 VanDerWaalsContact O-N 3.09Å; E138-T141 PolarHBondContact O-N 2.95Å; E138-T141 VanDerWaalsContact O-N 3.09Å; E138-T141 PolarHBondContact O-OG1 2.97Å; I139-T141 VanDerWaalsContact C-N 3.27Å; I139-T141 PolarHBondContact O-N 3.44Å; T141-R144 CarbonylContact O-C 3.6Å; T141-R144 PolarHBondContact O-N 3.06Å; T141-V146 PolarHBondContact O-N 3.45Å; T141-L148 WeakPolarHBondContact OG1-CD1 3.48Å; T141-I482 HydrophobicContact CG2-CD1 4.14Å; T141-I482 HydrophobicContact CG2-CG1 4.34Å; T141-L487 HydrophobicContact CG2-CB 3.87Å; T141-L487 HydrophobicContact CG2-CD1 4.26Å; T141-Y489 HydrophobicContact CG2-CD2 4Å; T141-Y489 HydrophobicContact CG2-CG 4.42Å
142	I	88.6	Confident	86.2	Confident	15 Å²	15	34.2 Å²	34.2	8%	0.077	17%	0.173	C	C	.	.	H	α-helix	trans	-66.2	-44	178.3	-71.2	160.3	0	0	0	111.2	E138 I139 R144 G145 V146 L148 L152 I212	E138-I142 WeakPolarHBondContact O-CG1 3.42Å; E138-I142 PolarHBondContact O-N 2.76Å; I139-I142 HydrophobicContact CD1-CD1 4.13Å; I139-I142 PolarHBondContact O-N 3.24Å; I139-I142 VanDerWaalsContact O-N 3.13Å; I142-R144 VanDerWaalsContact C-N 3.28Å; I142-R144 PolarHBondContact O-N 3.01Å; I142-G145 PolarHBondContact O-N 2.93Å; I142-V146 WeakPolarHBondContact CA-O 3.4Å; I142-L148 HydrophobicContact CD1-CB 4.14Å; I142-L148 HydrophobicContact CG1-CB 4.02Å; I142-L148 HydrophobicContact CG1-CD1 4.49Å; I142-L148 HydrophobicContact CG1-CG 4.32Å; I142-L152 HydrophobicContact CD1-CD1 4.21Å; I142-L152 HydrophobicContact CD1-CG 4.2Å; I142-L152 HydrophobicContact CG2-CD1 4.32Å; I142-I212 HydrophobicContact CG2-CD1 4.41Å
143	L	86.7	Confident	86.3	Confident	30 Å²	30	34.1 Å²	34.1	16%	0.157	18%	0.177	C	C	.	.	H	α-helix	trans	-70.9	-22.4	177.8	-66	-172.5	0	0	0	113.1	I139 G145 A209 I212 A213 T238	I139-L143 HydrophobicContact CG2-CD1 4.45Å; I139-L143 PolarHBondContact O-N 2.81Å; L143-G145 PolarHBondContact O-N 2.77Å; L143-A209 HydrophobicContact CD2-CB 4.47Å; L143-I212 HydrophobicContact CD2-CB 4.39Å; L143-I212 HydrophobicContact CD2-CG2 3.97Å; L143-A213 HydrophobicContact CD1-CB 4.09Å; L143-A213 HydrophobicContact CD2-CB 4.36Å; L143-T238 WeakPolarHBondContact CD1-OG1 3.46Å
144	R	79.7	Confident	86.6	Confident	43 Å²	43	39.1 Å²	39.1	16%	0.162	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.5	22.5	164.2	-65.7	-171	-170.4	-145.1	-2.1	113.8	K140 T141 I142 V146 Y489 L490 N492	K140-R144 WeakPolarHBondContact O-CG 3.41Å; K140-R144 PolarHBondContact O-N 3.06Å; T141-R144 CarbonylContact O-C 3.6Å; T141-R144 PolarHBondContact O-N 3.06Å; I142-R144 VanDerWaalsContact C-N 3.28Å; I142-R144 PolarHBondContact O-N 3.01Å; R144-V146 PolarHBondContact O-N 2.95Å; R144-Y489 VanDerWaalsContact CZ-CE2 3.5Å; R144-Y489 PolarHBondContact NH2-OH 3.45Å; R144-L490 PolarHBondContact NH1-O 2.86Å; R144-N492 VanDerWaalsContact CZ-OD1 3.27Å; R144-N492 PolarHBondContact NH1-OD1 3.01Å; R144-N492 PolarHBondContact NH2-OD1 2.64Å
145	G	76.3	Confident	86.8	Confident	11 Å²	11	43.4 Å²	43.4	11%	0.113	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	85.7	1.6	169.2	0	0	0	0	0	116.2	I142 L143 V147 Q730	I142-G145 PolarHBondContact O-N 2.93Å; L143-G145 PolarHBondContact O-N 2.77Å; G145-V147 PolarHBondContact O-N 3.01Å; G145-Q730 PolarHBondContact O-NE2 3.31Å
146	V	79.9	Confident	87.1	Confident	26 Å²	26	43.3 Å²	43.3	16%	0.158	21%	0.213	C	C	.	.			trans	-96.3	100.3	-174.7	-173.3	0	0	0	0	111.2	T141 I142 R144 L148 P488 L746	T141-V146 PolarHBondContact O-N 3.45Å; I142-V146 WeakPolarHBondContact CA-O 3.4Å; R144-V146 PolarHBondContact O-N 2.95Å; V146-L148 PolarHBondContact O-N 3.08Å; V146-P488 HydrophobicContact CG1-CB 4.07Å; V146-P488 HydrophobicContact CG1-CG 3.73Å; V146-P488 WeakPolarHBondContact CG2-O 3.41Å; V146-L746 HydrophobicContact CG2-CD2 4.01Å
147	V	78.1	Confident	87.2	Confident	81 Å²	81	43.9 Å²	43.9	49%	0.491	22%	0.217	S	C	.	.			trans	-78	85	-165.9	-170.5	0	0	0	0	113	G145 K149	G145-V147 PolarHBondContact O-N 3.01Å; V147-K149 HydrophobicContact CG1-CG 3.94Å; V147-K149 PolarHBondContact O-N 3.31Å; V147-K149 VanDerWaalsContact O-N 3.1Å
148	L	84.4	Confident	87.5	Confident	34 Å²	34	45.8 Å²	45.8	18%	0.178	23%	0.228	C	C	.	.			trans	-77.4	83.1	171.1	-58.3	179.2	0	0	0	111.2	E138 T141 I142 V146 E150 Y151 L487 P488	E138-L148 HydrophobicContact CB-CD1 4.39Å; E138-L148 HydrophobicContact CG-CD1 4.47Å; T141-L148 WeakPolarHBondContact OG1-CD1 3.48Å; I142-L148 HydrophobicContact CD1-CB 4.14Å; I142-L148 HydrophobicContact CG1-CB 4.02Å; I142-L148 HydrophobicContact CG1-CD1 4.49Å; I142-L148 HydrophobicContact CG1-CG 4.32Å; V146-L148 PolarHBondContact O-N 3.08Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.25Å; L148-Y151 HydrophobicContact CB-CD2 3.86Å; L148-Y151 HydrophobicContact CD1-CD2 4.33Å; L148-Y151 HydrophobicContact CD1-CE2 4.39Å; L148-L487 HydrophobicContact CD1-CD2 4.24Å; L148-P488 HydrophobicContact CD2-CG 4.33Å
149	K	82	Confident	87.7	Confident	166 Å²	166	45.7 Å²	45.7	72%	0.722	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-35.3	-171.6	-73.5	-165.7	173.2	-166.3	0	115.3	V147 L152	V147-K149 HydrophobicContact CG1-CG 3.94Å; V147-K149 PolarHBondContact O-N 3.31Å; V147-K149 VanDerWaalsContact O-N 3.1Å; K149-L152 PolarHBondContact O-N 2.8Å
150	E	84.9	Confident	87.8	Confident	144 Å²	144	45.7 Å²	45.7	67%	0.673	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-33.7	-170.4	-68.7	168.1	-171.9	0	0	112.8	P130 L148 L152 S153 T156	P130-E150 HydrophobicContact CG-CB 4.45Å; L148-E150 VanDerWaalsContact C-N 3.33Å; L148-E150 PolarHBondContact O-N 3.25Å; E150-L152 VanDerWaalsContact C-N 3.25Å; E150-L152 PolarHBondContact O-N 3.37Å; E150-S153 WeakPolarHBondContact O-CB 3.22Å; E150-S153 PolarHBondContact O-N 2.65Å; E150-T156 WeakPolarHBondContact O-CG2 3.38Å
151	Y	88	Confident	88	Confident	52 Å²	52	46 Å²	46	20%	0.204	23%	0.23	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-32.6	175.3	-70.6	-96.6	0	0	0	111.6	P130 E138 L148 S153 T156 I186	P130-Y151 HydrophobicContact CB-CD1 3.64Å; P130-Y151 HydrophobicContact CB-CD2 4.17Å; P130-Y151 HydrophobicContact CB-CE1 3.62Å; P130-Y151 HydrophobicContact CB-CE2 4.17Å; P130-Y151 HydrophobicContact CB-CG 3.92Å; P130-Y151 WeakPolarHBondContact O-CD1 3.43Å; E138-Y151 HydrophobicContact CB-CD1 4.11Å; E138-Y151 HydrophobicContact CB-CE1 4.38Å; E138-Y151 HydrophobicContact CG-CD1 3.79Å; E138-Y151 HydrophobicContact CG-CE1 3.55Å; E138-Y151 HydrophobicContact CG-CG 4.45Å; E138-Y151 WeakPolarHBondContact OE1-CE1 3.38Å; L148-Y151 HydrophobicContact CB-CD2 3.86Å; L148-Y151 HydrophobicContact CD1-CD2 4.33Å; L148-Y151 HydrophobicContact CD1-CE2 4.39Å; Y151-S153 VanDerWaalsContact C-N 3.31Å; Y151-S153 PolarHBondContact O-N 2.67Å; Y151-T156 WeakPolarHBondContact O-CB 3.15Å; Y151-T156 PolarHBondContact O-OG1 3.36Å; Y151-I186 WeakPolarHBondContact O-CG1 3.32Å
152	L	90.3	Very high	88.3	Confident	9 Å²	9	49.7 Å²	49.7	5%	0.047	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.5	38.3	177.9	-59.9	175.7	0	0	0	113.4	I139 I142 K149 E150 I186 K193 I212	I139-L152 HydrophobicContact CD1-CD2 4.27Å; I142-L152 HydrophobicContact CD1-CD1 4.21Å; I142-L152 HydrophobicContact CD1-CG 4.2Å; I142-L152 HydrophobicContact CG2-CD1 4.32Å; K149-L152 PolarHBondContact O-N 2.8Å; E150-L152 VanDerWaalsContact C-N 3.25Å; E150-L152 PolarHBondContact O-N 3.37Å; L152-I186 HydrophobicContact CD2-CG1 4.29Å; L152-K193 PolarHBondContact O-NZ 3.14Å; L152-I212 HydrophobicContact CD1-CD1 3.64Å
153	S	89.8	Confident	88.5	Confident	43 Å²	43	49 Å²	49	30%	0.301	25%	0.246	S	C	.	.	S	Bend	trans	-91.8	158.2	177.5	-177.2	0	0	0	0	112.2	E150 Y151 M155 T156 I186	E150-S153 WeakPolarHBondContact O-CB 3.22Å; E150-S153 PolarHBondContact O-N 2.65Å; Y151-S153 VanDerWaalsContact C-N 3.31Å; Y151-S153 PolarHBondContact O-N 2.67Å; S153-M155 VanDerWaalsContact C-N 3.28Å; S153-M155 PolarHBondContact OG-N 3.47Å; S153-T156 PolarHBondContact N-OG1 3.35Å; S153-T156 PolarHBondContact O-OG1 3.48Å; S153-I186 WeakPolarHBondContact O-CG2 3.48Å
154	F	92.5	Very high	88.8	Confident	118 Å²	118	47.6 Å²	47.6	52%	0.518	24%	0.239	S	C	.	.	H	α-helix	trans	-70.2	-28.2	169	-175.2	-100.4	0	0	0	111.9	L157 V158 V190	F154-L157 HydrophobicContact CD2-CD2 4.21Å; F154-L157 HydrophobicContact CE2-CD2 4.07Å; F154-L157 WeakPolarHBondContact O-CB 3.16Å; F154-L157 PolarHBondContact O-N 3.36Å; F154-V158 HydrophobicContact CD1-CG2 4.28Å; F154-V158 HydrophobicContact CE1-CG2 3.77Å; F154-V158 HydrophobicContact CZ-CG2 4.06Å; F154-V158 PolarHBondContact O-N 3.28Å; F154-V190 HydrophobicContact CD2-CG1 4.42Å; F154-V190 HydrophobicContact CD2-CG2 4.33Å
155	M	92.9	Very high	89.4	Confident	108 Å²	108	45.8 Å²	45.8	53%	0.532	23%	0.233	S	C	.	.	H	α-helix	trans	-75.2	-26.4	178.4	-62.1	-55.7	-178.2	0	0	112.9	S153 S159	S153-M155 VanDerWaalsContact C-N 3.28Å; S153-M155 PolarHBondContact OG-N 3.47Å; M155-S159 WeakPolarHBondContact O-CB 3.44Å; M155-S159 PolarHBondContact O-N 3.23Å
156	T	93.5	Very high	90.2	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-70.3	-32.9	170.2	48.2	0	0	0	0	111.6	S128 P130 E150 Y151 S153 K160	S128-T156 VanDerWaalsContact OG-CG2 3.24Å; S128-T156 WeakPolarHBondContact OG-CG2 3.5Å; P130-T156 HydrophobicContact CB-CG2 3.84Å; P130-T156 HydrophobicContact CG-CG2 4.44Å; E150-T156 WeakPolarHBondContact O-CG2 3.38Å; Y151-T156 WeakPolarHBondContact O-CB 3.15Å; Y151-T156 PolarHBondContact O-OG1 3.36Å; S153-T156 PolarHBondContact N-OG1 3.35Å; S153-T156 PolarHBondContact O-OG1 3.48Å; T156-K160 WeakPolarHBondContact O-CB 3.27Å; T156-K160 PolarHBondContact O-N 3.18Å
157	L	94.6	Very high	90.7	Very high	16 Å²	16	45.9 Å²	45.9	8%	0.084	23%	0.229	C	C	.	.	H	α-helix	trans	-58.6	-58.7	171.7	-179.3	62.5	0	0	0	110.6	F154 S159 K160 T161 I183 I186 V187	F154-L157 HydrophobicContact CD2-CD2 4.21Å; F154-L157 HydrophobicContact CE2-CD2 4.07Å; F154-L157 WeakPolarHBondContact O-CB 3.16Å; F154-L157 PolarHBondContact O-N 3.36Å; L157-S159 PolarHBondContact O-N 3.35Å; L157-K160 PolarHBondContact O-N 3.34Å; L157-T161 HydrophobicContact CD1-CG2 3.96Å; L157-T161 HydrophobicContact CG-CG2 4.49Å; L157-T161 WeakPolarHBondContact O-CG2 3.39Å; L157-T161 PolarHBondContact O-N 3.36Å; L157-T161 PolarHBondContact O-OG1 3.33Å; L157-I183 HydrophobicContact CD1-CB 4.29Å; L157-I183 HydrophobicContact CD1-CG1 4.22Å; L157-I183 HydrophobicContact CD1-CG2 3.76Å; L157-I186 HydrophobicContact CB-CG2 3.81Å; L157-V187 HydrophobicContact CD1-CG2 4.01Å; L157-V187 HydrophobicContact CD2-CG2 4.08Å
158	V	94.9	Very high	91.2	Very high	48 Å²	48	43.4 Å²	43.4	29%	0.291	21%	0.213	S	C	.	.	H	α-helix	trans	-61.9	-42.9	-177.2	179.3	0	0	0	0	112.1	F154 K160 T161 L162	F154-V158 HydrophobicContact CD1-CG2 4.28Å; F154-V158 HydrophobicContact CE1-CG2 3.77Å; F154-V158 HydrophobicContact CZ-CG2 4.06Å; F154-V158 PolarHBondContact O-N 3.28Å; V158-K160 VanDerWaalsContact C-N 3.35Å; V158-K160 PolarHBondContact O-N 3.46Å; V158-T161 PolarHBondContact O-OG1 2.7Å; V158-L162 HydrophobicContact CG1-CD1 3.86Å; V158-L162 WeakPolarHBondContact O-CB 3.18Å; V158-L162 WeakPolarHBondContact O-CG 3.23Å; V158-L162 PolarHBondContact O-N 3.01Å
159	S	94.4	Very high	91.4	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-57.7	-46.9	174.4	-177.1	0	0	0	0	111.6	S124 S128 A131 M155 L157 G163	S124-S159 WeakPolarHBondContact CA-OG 3.22Å; S124-S159 PolarHBondContact O-OG 3.01Å; S128-S159 PolarHBondContact O-OG 3.11Å; A131-S159 VanDerWaalsContact CB-OG 3.31Å; A131-S159 WeakPolarHBondContact CB-OG 3.36Å; M155-S159 WeakPolarHBondContact O-CB 3.44Å; M155-S159 PolarHBondContact O-N 3.23Å; L157-S159 PolarHBondContact O-N 3.35Å; S159-G163 PolarHBondContact O-N 3.11Å
160	K	94.7	Very high	91.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-76.5	-39	-173.2	-160.8	170.2	-173.6	105.9	0	113.1	A131 G133 S134 T156 L157 V158 L164 P179 H182 I183 P384	A131-K160 HydrophobicContact CB-CB 3.9Å; A131-K160 HydrophobicContact CB-CG 4.35Å; A131-K160 PolarHBondContact O-NZ 3.45Å; G133-K160 PolarHBondContact O-NZ 2.71Å; S134-K160 VanDerWaalsContact O-CE 3.26Å; S134-K160 WeakPolarHBondContact O-CE 3.26Å; S134-K160 PolarHBondContact O-NZ 3.17Å; T156-K160 WeakPolarHBondContact O-CB 3.27Å; T156-K160 PolarHBondContact O-N 3.18Å; L157-K160 PolarHBondContact O-N 3.34Å; V158-K160 VanDerWaalsContact C-N 3.35Å; V158-K160 PolarHBondContact O-N 3.46Å; K160-L164 WeakPolarHBondContact O-CB 3.41Å; K160-L164 PolarHBondContact O-N 3.13Å; K160-P179 VanDerWaalsContact CE-CA 3.45Å; K160-H182 HydrophobicContact CD-CB 4.2Å; K160-H182 VanDerWaalsContact CD-ND1 3.29Å; K160-H182 WeakPolarHBondContact CD-ND1 3.29Å; K160-I183 HydrophobicContact CD-CG1 4.43Å; K160-I183 HydrophobicContact CG-CD1 4.49Å; K160-P384 HydrophobicContact CG-CB 3.96Å
161	T	93.8	Very high	91.5	Very high	21 Å²	21	28.8 Å²	28.8	13%	0.129	16%	0.156	C	C	.	.	H	α-helix	trans	-65.4	-47.3	177.2	55.1	0	0	0	0	111.4	M79 L157 V158 T165 I183	M79-T161 HydrophobicContact CE-CG2 3.56Å; M79-T161 HydrophobicContact SD-CG2 3.8Å; L157-T161 HydrophobicContact CD1-CG2 3.96Å; L157-T161 HydrophobicContact CG-CG2 4.49Å; L157-T161 WeakPolarHBondContact O-CG2 3.39Å; L157-T161 PolarHBondContact O-N 3.36Å; L157-T161 PolarHBondContact O-OG1 3.33Å; V158-T161 PolarHBondContact O-OG1 2.7Å; T161-T165 WeakPolarHBondContact O-CB 3.41Å; T161-T165 PolarHBondContact O-N 3.16Å; T161-T165 PolarHBondContact O-OG1 2.91Å; T161-I183 HydrophobicContact CG2-CD1 3.88Å; T161-I183 HydrophobicContact CG2-CG1 4.13Å; T161-I183 HydrophobicContact CG2-CG2 4.47Å
162	L	94.6	Very high	91.4	Very high	78 Å²	78	26.6 Å²	26.6	41%	0.408	15%	0.148	S	C	.	.	H	α-helix	trans	-65.2	-49.3	177.4	-66.3	175.4	0	0	0	111.6	V123 V158 L164 T165 I166	V123-L162 HydrophobicContact CG1-CB 3.84Å; V158-L162 HydrophobicContact CG1-CD1 3.86Å; V158-L162 WeakPolarHBondContact O-CB 3.18Å; V158-L162 WeakPolarHBondContact O-CG 3.23Å; V158-L162 PolarHBondContact O-N 3.01Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 3Å; L162-T165 PolarHBondContact O-N 2.84Å; L162-I166 VanDerWaalsContact O-CG1 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.17Å; L162-I166 PolarHBondContact O-N 2.82Å; L162-I166 VanDerWaalsContact O-N 3.12Å
163	G	92.4	Very high	91.1	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-59.7	-40.1	179.2	0	0	0	0	0	112.9	S120 S159 S167	S120-G163 PolarHBondContact OG-O 3.13Å; S159-G163 PolarHBondContact O-N 3.11Å; G163-S167 WeakPolarHBondContact O-CB 3.43Å; G163-S167 PolarHBondContact O-N 3.18Å; G163-S167 PolarHBondContact O-OG 3.28Å
164	L	93.2	Very high	91	Very high	1 Å²	1	24.8 Å²	24.8	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-70	-42.1	179.9	-178	66.5	0	0	0	112.3	K160 L162 I166 S167 L168 K176 P179 M180 I183 P384	K160-L164 WeakPolarHBondContact O-CB 3.41Å; K160-L164 PolarHBondContact O-N 3.13Å; L162-L164 VanDerWaalsContact C-N 3.31Å; L162-L164 PolarHBondContact O-N 3Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 PolarHBondContact O-N 3.38Å; L164-S167 WeakPolarHBondContact CA-OG 3.42Å; L164-S167 PolarHBondContact O-N 3.19Å; L164-S167 PolarHBondContact O-OG 3.04Å; L164-S167 VanDerWaalsContact O-OG 3.09Å; L164-L168 HydrophobicContact CD1-CD1 3.79Å; L164-L168 HydrophobicContact CD1-CG 4.23Å; L164-L168 HydrophobicContact CD2-CD1 4.46Å; L164-L168 HydrophobicContact CG-CD1 3.74Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 WeakPolarHBondContact O-CG 3.42Å; L164-L168 PolarHBondContact O-N 3.28Å; L164-K176 HydrophobicContact CD2-CB 4.14Å; L164-P179 HydrophobicContact CD1-CB 3.85Å; L164-P179 HydrophobicContact CD1-CG 3.82Å; L164-P179 HydrophobicContact CD2-CB 3.59Å; L164-P179 HydrophobicContact CD2-CG 4.46Å; L164-P179 HydrophobicContact CG-CB 4.27Å; L164-M180 HydrophobicContact CD2-CE 4.38Å; L164-I183 HydrophobicContact CD2-CD1 4.18Å; L164-P384 HydrophobicContact CB-CB 4.23Å; L164-P384 HydrophobicContact CB-CG 4.13Å; L164-P384 HydrophobicContact CD1-CB 4.41Å; L164-P384 VanDerWaalsContact N-CG 3.28Å
165	T	92.9	Very high	90.7	Very high	5 Å²	5	19.2 Å²	19.2	3%	0.031	11%	0.111	C	C	.	.	H	α-helix	trans	-57.4	-49.1	175.6	-56	0	0	0	0	109.8	L82 I83 L86 T161 L162 S169	L82-T165 HydrophobicContact CB-CG2 3.95Å; L82-T165 HydrophobicContact CD2-CG2 3.65Å; L82-T165 HydrophobicContact CG-CG2 3.58Å; I83-T165 HydrophobicContact CG1-CG2 3.89Å; L86-T165 HydrophobicContact CD1-CG2 4.16Å; T161-T165 WeakPolarHBondContact O-CB 3.41Å; T161-T165 PolarHBondContact O-N 3.16Å; T161-T165 PolarHBondContact O-OG1 2.91Å; L162-T165 PolarHBondContact O-N 2.84Å; T165-S169 VanDerWaalsContact O-CB 3.29Å; T165-S169 WeakPolarHBondContact O-CB 3.41Å; T165-S169 PolarHBondContact O-N 2.97Å; T165-S169 PolarHBondContact O-OG 2.83Å
166	I	92.5	Very high	90.6	Very high	40 Å²	40	15 Å²	15	21%	0.205	9%	0.09	C	C	.	.	H	α-helix	trans	-67.2	-41.2	-178.8	-60.6	165.9	0	0	0	111.2	M116 A119 V123 L162 L164 S169 S170	M116-I166 HydrophobicContact CB-CG2 4.09Å; M116-I166 WeakPolarHBondContact O-CG2 3.38Å; A119-I166 HydrophobicContact CB-CG2 4.22Å; V123-I166 HydrophobicContact CG2-CD1 4.14Å; L162-I166 VanDerWaalsContact O-CG1 3.31Å; L162-I166 WeakPolarHBondContact O-CG1 3.17Å; L162-I166 PolarHBondContact O-N 2.82Å; L162-I166 VanDerWaalsContact O-N 3.12Å; L164-I166 VanDerWaalsContact C-N 3.31Å; L164-I166 PolarHBondContact O-N 3.38Å; I166-S169 PolarHBondContact O-N 3.46Å; I166-S170 PolarHBondContact O-N 2.87Å
167	S	89.8	Confident	90.3	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-67.1	-42.9	-179.3	61.2	0	0	0	0	112.5	G163 L164 S170 I174 P384	G163-S167 WeakPolarHBondContact O-CB 3.43Å; G163-S167 PolarHBondContact O-N 3.18Å; G163-S167 PolarHBondContact O-OG 3.28Å; L164-S167 WeakPolarHBondContact CA-OG 3.42Å; L164-S167 PolarHBondContact O-N 3.19Å; L164-S167 PolarHBondContact O-OG 3.04Å; L164-S167 VanDerWaalsContact O-OG 3.09Å; S167-S170 PolarHBondContact O-N 2.92Å; S167-S170 PolarHBondContact O-OG 3.13Å; S167-I174 WeakPolarHBondContact OG-CD1 3.37Å; S167-P384 PolarHBondContact OG-O 3.23Å; S167-P384 VanDerWaalsContact OG-O 3.08Å
168	L	89.9	Confident	90.1	Very high	29 Å²	29	14.8 Å²	14.8	15%	0.152	9%	0.088	C	C	.	.	H	α-helix	trans	-65	-42.9	174.9	-73.9	162.3	0	0	0	111.8	I83 L164 S170 G171 I174 K176	I83-L168 HydrophobicContact CD1-CB 3.97Å; I83-L168 HydrophobicContact CD1-CD1 3.62Å; I83-L168 HydrophobicContact CD1-CG 4.45Å; I83-L168 HydrophobicContact CG1-CB 4.16Å; I83-L168 HydrophobicContact CG2-CB 4.13Å; L164-L168 HydrophobicContact CD1-CD1 3.79Å; L164-L168 HydrophobicContact CD1-CG 4.23Å; L164-L168 HydrophobicContact CD2-CD1 4.46Å; L164-L168 HydrophobicContact CG-CD1 3.74Å; L164-L168 WeakPolarHBondContact O-CB 3.46Å; L164-L168 WeakPolarHBondContact O-CG 3.42Å; L164-L168 PolarHBondContact O-N 3.28Å; L168-S170 PolarHBondContact O-N 2.9Å; L168-G171 PolarHBondContact O-N 3.06Å; L168-I174 HydrophobicContact CD2-CG1 3.9Å; L168-I174 WeakPolarHBondContact CD2-O 3.5Å; L168-I174 HydrophobicContact CG-CG1 4.46Å; L168-K176 HydrophobicContact CD1-CB 3.77Å
169	S	88.2	Confident	90	Very high	0 Å²	0	12.5 Å²	12.5	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-63.6	-21.2	179.2	-55.3	0	0	0	0	114	I83 L86 M116 T165 I166 G171	I83-S169 WeakPolarHBondContact CA-OG 3.29Å; L86-S169 WeakPolarHBondContact CB-OG 3.44Å; L86-S169 WeakPolarHBondContact CD1-OG 3.49Å; M116-S169 VanDerWaalsContact CE-C 3.47Å; M116-S169 WeakPolarHBondContact CE-O 3.4Å; T165-S169 VanDerWaalsContact O-CB 3.29Å; T165-S169 WeakPolarHBondContact O-CB 3.41Å; T165-S169 PolarHBondContact O-N 2.97Å; T165-S169 PolarHBondContact O-OG 2.83Å; I166-S169 PolarHBondContact O-N 3.46Å; S169-G171 PolarHBondContact O-N 3.24Å
170	S	86.7	Confident	89.9	Confident	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	-19.1	172.8	74.8	0	0	0	0	112.8	R90 I166 S167 L168	R90-S170 PolarHBondContact NH1-O 3Å; I166-S170 PolarHBondContact O-N 2.87Å; S167-S170 PolarHBondContact O-N 2.92Å; S167-S170 PolarHBondContact O-OG 3.13Å; L168-S170 PolarHBondContact O-N 2.9Å
171	G	83	Confident	89.9	Confident	36 Å²	36	12.7 Å²	12.7	37%	0.371	8%	0.076	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.5	25.1	-179	0	0	0	0	0	114.8	L168 S169	L168-G171 PolarHBondContact O-N 3.06Å; S169-G171 PolarHBondContact O-N 3.24Å
172	L	84.3	Confident	90	Very high	6 Å²	6	11.7 Å²	11.7	3%	0.031	7%	0.07	C	C	.	.			trans	-64	150	164.3	-66.7	-176.8	0	0	0	110.6	V113 T117 I174 V312 L381 I383	V113-L172 HydrophobicContact CG1-CD2 4.42Å; T117-L172 HydrophobicContact CG2-CD1 3.57Å; T117-L172 HydrophobicContact CG2-CD2 4.26Å; T117-L172 HydrophobicContact CG2-CG 3.93Å; L172-I174 HydrophobicContact CB-CD1 4.37Å; L172-I174 HydrophobicContact CB-CG1 4.23Å; L172-I174 HydrophobicContact CB-CG2 4.3Å; L172-I174 PolarHBondContact O-N 3.45Å; L172-V312 HydrophobicContact CD2-CB 3.98Å; L172-V312 HydrophobicContact CD2-CG1 3.61Å; L172-V312 HydrophobicContact CD2-CG2 4.34Å; L172-L381 HydrophobicContact CD1-CD1 3.48Å; L172-L381 VanDerWaalsContact CD1-CD1 3.48Å; L172-I383 HydrophobicContact CD1-CD1 3.72Å
173	P	84.2	Confident	90	Very high	7 Å²	7	8 Å²	8	5%	0.045	5%	0.05	C	C	.	.	S	Bend	trans	-73.4	76.2	173	31.3	-35.8	0	0	0	111.5	L371 L374	P173-L371 HydrophobicContact CB-CD1 3.73Å; P173-L371 HydrophobicContact CB-CD2 3.9Å; P173-L371 HydrophobicContact CB-CG 3.74Å; P173-L371 HydrophobicContact CG-CD1 4.24Å; P173-L371 HydrophobicContact CG-CG 4.12Å; P173-L374 HydrophobicContact CG-CB 3.87Å
174	I	87.6	Confident	90.1	Very high	7 Å²	7	8 Å²	8	4%	0.036	5%	0.05	C	C	.	.			trans	-136.6	153.7	177.9	63.7	176.5	0	0	0	110.1	S167 L168 L172 C378 I383	S167-I174 WeakPolarHBondContact OG-CD1 3.37Å; L168-I174 HydrophobicContact CD2-CG1 3.9Å; L168-I174 WeakPolarHBondContact CD2-O 3.5Å; L168-I174 HydrophobicContact CG-CG1 4.46Å; L172-I174 HydrophobicContact CB-CD1 4.37Å; L172-I174 HydrophobicContact CB-CG1 4.23Å; L172-I174 HydrophobicContact CB-CG2 4.3Å; L172-I174 PolarHBondContact O-N 3.45Å; I174-C378 HydrophobicContact CG2-CB 3.88Å; I174-I383 HydrophobicContact CD1-CD1 4.1Å
175	G	86.6	Confident	90.2	Very high	1 Å²	1	8 Å²	8	1%	0.01	5%	0.05	C	C	.	.	B	Isolated β-bridge	trans	-104.7	166.7	177.1	0	0	0	0	0	114.2	G386 T389	G175-G386 PolarHBondContact N-O 3.01Å; G175-G386 VanDerWaalsContact O-CA 3.26Å; G175-G386 WeakPolarHBondContact O-CA 3.19Å; G175-G386 PolarHBondContact O-N 2.71Å; G175-T389 WeakPolarHBondContact CA-OG1 3.26Å
176	K	90.7	Very high	90.3	Very high	19 Å²	19	7.7 Å²	7.7	8%	0.083	5%	0.048	C	C	.	.	S	Bend	trans	-86.8	-22	170.2	61.4	177.3	176.6	169.9	0	113.5	D80 L164 L168 G178 P179 M180 T223	D80-K176 IonicContact OD1-NZ 2.84Å; D80-K176 PolarHBondContact OD1-NZ 3.35Å; D80-K176 IonicContact OD2-NZ 3.88Å; D80-K176 PolarHBondContact OD2-NZ 3.16Å; L164-K176 HydrophobicContact CD2-CB 4.14Å; L168-K176 HydrophobicContact CD1-CB 3.77Å; K176-G178 PolarHBondContact O-N 2.98Å; K176-P179 WeakPolarHBondContact O-CB 3.48Å; K176-P179 VanDerWaalsContact O-CD 3.26Å; K176-P179 WeakPolarHBondContact O-CD 3.36Å; K176-M180 HydrophobicContact CB-CE 4.45Å; K176-M180 HydrophobicContact CB-CG 4.06Å; K176-M180 HydrophobicContact CD-CE 4.11Å; K176-M180 HydrophobicContact CG-CG 4.35Å; K176-M180 WeakPolarHBondContact O-CG 3.34Å; K176-M180 PolarHBondContact O-N 3.4Å; K176-T223 HydrophobicContact CD-CG2 3.87Å; K176-T223 HydrophobicContact CG-CG2 3.89Å
177	E	88	Confident	90.5	Very high	12 Å²	12	6.2 Å²	6.2	6%	0.056	4%	0.041	C	C	.	.	H	α-helix	trans	-46.2	-66.4	-167.4	-41.6	-40.3	108.6	0	0	114.4	M180 V181 T223 F224 F388 T389	E177-M180 WeakPolarHBondContact O-CA 3.44Å; E177-M180 WeakPolarHBondContact O-CB 3.38Å; E177-M180 PolarHBondContact O-N 3.26Å; E177-V181 WeakPolarHBondContact O-CG2 3.45Å; E177-V181 PolarHBondContact O-N 3.1Å; E177-T223 WeakPolarHBondContact OE2-CB 3.41Å; E177-T223 PolarHBondContact OE2-OG1 2.91Å; E177-F224 HydrophobicContact CB-CZ 4.32Å; E177-F224 HydrophobicContact CG-CE1 3.93Å; E177-F224 HydrophobicContact CG-CZ 3.73Å; E177-F224 VanDerWaalsContact OE2-CE1 3.3Å; E177-F224 WeakPolarHBondContact OE2-CE1 3.08Å; E177-F224 WeakPolarHBondContact OE2-CZ 3.45Å; E177-F388 HydrophobicContact CB-CB 3.98Å; E177-F388 HydrophobicContact CG-CB 3.78Å; E177-F388 HydrophobicContact CG-CD1 4.42Å; E177-F388 HydrophobicContact CG-CG 4.33Å; E177-T389 WeakPolarHBondContact CG-OG1 3.37Å; E177-T389 PolarHBondContact OE1-OG1 3.08Å
178	G	89.5	Confident	90.7	Very high	0 Å²	0	6.2 Å²	6.2	0%	0	4%	0.041	C	C	.	.	H	α-helix	trans	-57	-49.8	-178.2	0	0	0	0	0	113.5	S134 K176 M180 V181 H182	S134-G178 CarbonylContact O-C 3.51Å; S134-G178 WeakPolarHBondContact OG-CA 3.29Å; K176-G178 PolarHBondContact O-N 2.98Å; G178-M180 VanDerWaalsContact C-N 3.28Å; G178-M180 PolarHBondContact O-N 3.26Å; G178-V181 WeakPolarHBondContact O-CB 3.2Å; G178-V181 PolarHBondContact O-N 2.85Å; G178-H182 PolarHBondContact O-N 3.33Å
179	P	92.7	Very high	90.8	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-53.6	-38	170	-33	39.2	0	0	0	115.1	S134 K160 L164 K176 H182 I183 S385 G386	S134-P179 WeakPolarHBondContact O-CA 3.37Å; K160-P179 VanDerWaalsContact CE-CA 3.45Å; L164-P179 HydrophobicContact CD1-CB 3.85Å; L164-P179 HydrophobicContact CD1-CG 3.82Å; L164-P179 HydrophobicContact CD2-CB 3.59Å; L164-P179 HydrophobicContact CD2-CG 4.46Å; L164-P179 HydrophobicContact CG-CB 4.27Å; K176-P179 WeakPolarHBondContact O-CB 3.48Å; K176-P179 VanDerWaalsContact O-CD 3.26Å; K176-P179 WeakPolarHBondContact O-CD 3.36Å; P179-H182 WeakPolarHBondContact O-CB 3.42Å; P179-H182 PolarHBondContact O-N 3.31Å; P179-I183 WeakPolarHBondContact O-CD1 3.47Å; P179-I183 WeakPolarHBondContact O-CG1 3.17Å; P179-I183 PolarHBondContact O-N 3.18Å; P179-S385 VanDerWaalsContact CG-C 3.46Å; P179-G386 VanDerWaalsContact CD-CA 3.47Å
180	M	93.6	Very high	90.9	Very high	2 Å²	2	6.9 Å²	6.9	1%	0.01	5%	0.046	C	C	.	.	H	α-helix	trans	-71.5	-33.2	178.4	-71.9	-69.8	-162.7	0	0	113.2	M79 L164 K176 E177 G178 H182 I183 G184 T223	M79-M180 HydrophobicContact CB-CE 4.3Å; M79-M180 HydrophobicContact CE-CE 3.59Å; M79-M180 HydrophobicContact CE-SD 3.93Å; M79-M180 HydrophobicContact SD-CE 3.78Å; L164-M180 HydrophobicContact CD2-CE 4.38Å; K176-M180 HydrophobicContact CB-CE 4.45Å; K176-M180 HydrophobicContact CB-CG 4.06Å; K176-M180 HydrophobicContact CD-CE 4.11Å; K176-M180 HydrophobicContact CG-CG 4.35Å; K176-M180 WeakPolarHBondContact O-CG 3.34Å; K176-M180 PolarHBondContact O-N 3.4Å; E177-M180 WeakPolarHBondContact O-CA 3.44Å; E177-M180 WeakPolarHBondContact O-CB 3.38Å; E177-M180 PolarHBondContact O-N 3.26Å; G178-M180 VanDerWaalsContact C-N 3.28Å; G178-M180 PolarHBondContact O-N 3.26Å; M180-H182 VanDerWaalsContact C-N 3.28Å; M180-H182 PolarHBondContact O-N 2.51Å; M180-I183 PolarHBondContact O-N 2.96Å; M180-I183 HydrophobicContact SD-CB 4.42Å; M180-I183 HydrophobicContact SD-CD1 3.75Å; M180-I183 HydrophobicContact SD-CG2 4.35Å; M180-G184 PolarHBondContact O-N 3Å; M180-T223 HydrophobicContact CB-CG2 3.51Å; M180-T223 HydrophobicContact CG-CG2 3.48Å; M180-T223 VanDerWaalsContact CG-CG2 3.48Å
181	V	94.2	Very high	91.1	Very high	3 Å²	3	7.9 Å²	7.9	2%	0.018	5%	0.052	C	C	.	.	H	α-helix	trans	-58.3	-42.3	168.6	-166.5	0	0	0	0	111	I136 E177 G178 S185 C216 V220	I136-V181 HydrophobicContact CD1-CG2 3.94Å; I136-V181 HydrophobicContact CG1-CB 4.04Å; I136-V181 HydrophobicContact CG1-CG1 4.35Å; I136-V181 HydrophobicContact CG1-CG2 3.99Å; E177-V181 WeakPolarHBondContact O-CG2 3.45Å; E177-V181 PolarHBondContact O-N 3.1Å; G178-V181 WeakPolarHBondContact O-CB 3.2Å; G178-V181 PolarHBondContact O-N 2.85Å; V181-S185 WeakPolarHBondContact O-CB 3.4Å; V181-S185 PolarHBondContact O-N 3.37Å; V181-S185 PolarHBondContact O-OG 2.72Å; V181-C216 HydrophobicContact CG1-CB 3.73Å; V181-V220 HydrophobicContact CG1-CG2 4.48Å; V181-V220 HydrophobicContact CG2-CG2 3.5Å
182	H	94.7	Very high	91.2	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-69.4	-41.5	176.8	-167.5	-125.9	0	0	0	111.9	K160 G178 P179 M180 S185 I186	K160-H182 HydrophobicContact CD-CB 4.2Å; K160-H182 VanDerWaalsContact CD-ND1 3.29Å; K160-H182 WeakPolarHBondContact CD-ND1 3.29Å; G178-H182 PolarHBondContact O-N 3.33Å; P179-H182 WeakPolarHBondContact O-CB 3.42Å; P179-H182 PolarHBondContact O-N 3.31Å; M180-H182 VanDerWaalsContact C-N 3.28Å; M180-H182 PolarHBondContact O-N 2.51Å; H182-S185 WeakPolarHBondContact O-CB 3.49Å; H182-S185 PolarHBondContact O-N 2.92Å; H182-I186 WeakPolarHBondContact O-CD1 3.37Å; H182-I186 VanDerWaalsContact O-CG1 3.22Å; H182-I186 WeakPolarHBondContact O-CG1 3.42Å; H182-I186 PolarHBondContact O-N 2.65Å
183	I	95.7	Very high	91.2	Very high	0 Å²	0	11.2 Å²	11.2	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-59.4	-50	175.3	-74.6	158.6	0	0	0	110.8	M79 L157 K160 T161 L164 P179 M180 S185 I186 V187	M79-I183 HydrophobicContact CE-CD1 4.31Å; L157-I183 HydrophobicContact CD1-CB 4.29Å; L157-I183 HydrophobicContact CD1-CG1 4.22Å; L157-I183 HydrophobicContact CD1-CG2 3.76Å; K160-I183 HydrophobicContact CD-CG1 4.43Å; K160-I183 HydrophobicContact CG-CD1 4.49Å; T161-I183 HydrophobicContact CG2-CD1 3.88Å; T161-I183 HydrophobicContact CG2-CG1 4.13Å; T161-I183 HydrophobicContact CG2-CG2 4.47Å; L164-I183 HydrophobicContact CD2-CD1 4.18Å; P179-I183 WeakPolarHBondContact O-CD1 3.47Å; P179-I183 WeakPolarHBondContact O-CG1 3.17Å; P179-I183 PolarHBondContact O-N 3.18Å; M180-I183 PolarHBondContact O-N 2.96Å; M180-I183 HydrophobicContact SD-CB 4.42Å; M180-I183 HydrophobicContact SD-CD1 3.75Å; M180-I183 HydrophobicContact SD-CG2 4.35Å; I183-S185 VanDerWaalsContact C-N 3.33Å; I183-S185 PolarHBondContact O-N 3.07Å; I183-I186 PolarHBondContact O-N 2.97Å; I183-I186 VanDerWaalsContact O-N 3.14Å; I183-V187 HydrophobicContact CG2-CG2 4.48Å; I183-V187 WeakPolarHBondContact O-CG2 3.28Å; I183-V187 PolarHBondContact O-N 3.37Å
184	G	95	Very high	91.1	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-60.1	-40.2	176.4	0	0	0	0	0	112.9	M180 V187 A188 G215	M180-G184 PolarHBondContact O-N 3Å; G184-V187 PolarHBondContact O-N 2.84Å; G184-A188 VanDerWaalsContact O-CB 3.27Å; G184-A188 WeakPolarHBondContact O-CB 3.13Å; G184-A188 PolarHBondContact O-N 2.99Å; G184-G215 CarbonylContact C-O 3.24Å; G184-G215 WeakPolarHBondContact CA-O 3.29Å
185	S	94.8	Very high	90.7	Very high	0 Å²	0	14.7 Å²	14.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-61.7	-40.4	173	-62.6	0	0	0	0	113.5	I139 V181 H182 I183 S189 C216	I139-S185 WeakPolarHBondContact CD1-OG 3.12Å; V181-S185 WeakPolarHBondContact O-CB 3.4Å; V181-S185 PolarHBondContact O-N 3.37Å; V181-S185 PolarHBondContact O-OG 2.72Å; H182-S185 WeakPolarHBondContact O-CB 3.49Å; H182-S185 PolarHBondContact O-N 2.92Å; I183-S185 VanDerWaalsContact C-N 3.33Å; I183-S185 PolarHBondContact O-N 3.07Å; S185-S189 WeakPolarHBondContact O-CB 3.5Å; S185-S189 PolarHBondContact O-N 3.27Å; S185-C216 PolarHBondContact OG-SG 2.9Å
186	I	95.3	Very high	90.1	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-69.7	-46.4	176.8	-64.4	158.2	0	0	0	110.2	Y151 L152 S153 L157 H182 I183 A188 S189 V190	Y151-I186 WeakPolarHBondContact O-CG1 3.32Å; L152-I186 HydrophobicContact CD2-CG1 4.29Å; S153-I186 WeakPolarHBondContact O-CG2 3.48Å; L157-I186 HydrophobicContact CB-CG2 3.81Å; H182-I186 WeakPolarHBondContact O-CD1 3.37Å; H182-I186 VanDerWaalsContact O-CG1 3.22Å; H182-I186 WeakPolarHBondContact O-CG1 3.42Å; H182-I186 PolarHBondContact O-N 2.65Å; I183-I186 PolarHBondContact O-N 2.97Å; I183-I186 VanDerWaalsContact O-N 3.14Å; I186-A188 VanDerWaalsContact C-N 3.34Å; I186-A188 PolarHBondContact O-N 3.12Å; I186-S189 CarbonylContact O-C 3.54Å; I186-S189 WeakPolarHBondContact O-CA 3.26Å; I186-S189 WeakPolarHBondContact O-CB 3.43Å; I186-S189 PolarHBondContact O-N 2.65Å; I186-V190 HydrophobicContact CG2-CG2 4.12Å; I186-V190 WeakPolarHBondContact O-CG2 3.45Å; I186-V190 PolarHBondContact O-N 3.03Å
187	V	95.7	Very high	89.2	Confident	9 Å²	9	24.4 Å²	24.4	6%	0.055	12%	0.123	C	C	.	.	H	α-helix	trans	-57.2	-48.2	177.1	171.9	0	0	0	0	110.3	L68 S71 V72 L75 L157 I183 G184 S189 V190 I191	L68-V187 HydrophobicContact CD1-CB 4.32Å; L68-V187 HydrophobicContact CD1-CG1 3.86Å; S71-V187 VanDerWaalsContact OG-CG1 3.31Å; S71-V187 WeakPolarHBondContact OG-CG1 3.45Å; V72-V187 HydrophobicContact CG2-CB 4.22Å; V72-V187 HydrophobicContact CG2-CG1 4.09Å; L75-V187 HydrophobicContact CD1-CG2 3.76Å; L157-V187 HydrophobicContact CD1-CG2 4.01Å; L157-V187 HydrophobicContact CD2-CG2 4.08Å; I183-V187 HydrophobicContact CG2-CG2 4.48Å; I183-V187 WeakPolarHBondContact O-CG2 3.28Å; I183-V187 PolarHBondContact O-N 3.37Å; G184-V187 PolarHBondContact O-N 2.84Å; V187-S189 VanDerWaalsContact C-N 3.32Å; V187-S189 PolarHBondContact O-N 3.49Å; V187-V190 PolarHBondContact O-N 3.32Å; V187-V190 VanDerWaalsContact O-N 3.16Å; V187-I191 HydrophobicContact CG1-CD1 3.66Å; V187-I191 HydrophobicContact CG1-CG1 4.29Å; V187-I191 WeakPolarHBondContact O-CB 3.47Å; V187-I191 VanDerWaalsContact O-CG1 3.3Å; V187-I191 WeakPolarHBondContact O-CG1 3.19Å; V187-I191 PolarHBondContact O-N 3.08Å
188	A	93.8	Very high	88.3	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-54.8	-43.4	172.4	0	0	0	0	0	113	L68 G184 I186 C192 M211	L68-A188 HydrophobicContact CD1-CB 3.85Å; L68-A188 HydrophobicContact CD2-CB 4.06Å; G184-A188 VanDerWaalsContact O-CB 3.27Å; G184-A188 WeakPolarHBondContact O-CB 3.13Å; G184-A188 PolarHBondContact O-N 2.99Å; I186-A188 VanDerWaalsContact C-N 3.34Å; I186-A188 PolarHBondContact O-N 3.12Å; A188-C192 WeakPolarHBondContact O-CB 3.43Å; A188-C192 PolarHBondContact O-N 3.29Å; A188-M211 HydrophobicContact CB-CG 4.12Å; A188-M211 VanDerWaalsContact CB-O 3.29Å; A188-M211 WeakPolarHBondContact CB-O 3.1Å
189	S	92	Very high	87.1	Confident	0 Å²	0	28.5 Å²	28.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-67.9	-37.8	177.2	-166	0	0	0	0	112.9	S185 I186 V187 K193 Q208	S185-S189 WeakPolarHBondContact O-CB 3.5Å; S185-S189 PolarHBondContact O-N 3.27Å; I186-S189 CarbonylContact O-C 3.54Å; I186-S189 WeakPolarHBondContact O-CA 3.26Å; I186-S189 WeakPolarHBondContact O-CB 3.43Å; I186-S189 PolarHBondContact O-N 2.65Å; V187-S189 VanDerWaalsContact C-N 3.32Å; V187-S189 PolarHBondContact O-N 3.49Å; S189-K193 VanDerWaalsContact O-CD 3.25Å; S189-K193 WeakPolarHBondContact O-CD 3.5Å; S189-K193 WeakPolarHBondContact O-CG 3.3Å; S189-K193 PolarHBondContact O-N 2.98Å; S189-K193 VanDerWaalsContact O-N 3.14Å; S189-K193 WeakPolarHBondContact OG-CE 3.18Å; S189-K193 PolarHBondContact OG-NZ 2.91Å; S189-Q208 PolarHBondContact OG-NE2 2.84Å
190	V	91.3	Very high	85.7	Confident	42 Å²	42	36 Å²	36	26%	0.255	18%	0.18	S	C	.	.	H	α-helix	trans	-70.3	-46.4	177.9	170	0	0	0	0	111	F154 I186 V187 K193 S194	F154-V190 HydrophobicContact CD2-CG1 4.42Å; F154-V190 HydrophobicContact CD2-CG2 4.33Å; I186-V190 HydrophobicContact CG2-CG2 4.12Å; I186-V190 WeakPolarHBondContact O-CG2 3.45Å; I186-V190 PolarHBondContact O-N 3.03Å; V187-V190 PolarHBondContact O-N 3.32Å; V187-V190 VanDerWaalsContact O-N 3.16Å; V190-K193 PolarHBondContact O-N 2.79Å; V190-S194 PolarHBondContact O-N 2.88Å; V190-S194 PolarHBondContact O-OG 3.41Å
191	I	90.3	Very high	84.1	Confident	22 Å²	22	39.4 Å²	39.4	11%	0.113	20%	0.198	C	C	.	.	H	α-helix	trans	-61	-46.9	174.9	-65.7	174	0	0	0	110.1	I64 L68 V187 K193 S194 F195	I64-I191 HydrophobicContact CG2-CG2 3.66Å; L68-I191 HydrophobicContact CB-CD1 4.32Å; L68-I191 HydrophobicContact CD1-CD1 4.45Å; V187-I191 HydrophobicContact CG1-CD1 3.66Å; V187-I191 HydrophobicContact CG1-CG1 4.29Å; V187-I191 WeakPolarHBondContact O-CB 3.47Å; V187-I191 VanDerWaalsContact O-CG1 3.3Å; V187-I191 WeakPolarHBondContact O-CG1 3.19Å; V187-I191 PolarHBondContact O-N 3.08Å; I191-K193 VanDerWaalsContact C-N 3.29Å; I191-K193 PolarHBondContact O-N 3.27Å; I191-S194 PolarHBondContact O-N 2.79Å; I191-S194 PolarHBondContact O-OG 2.81Å; I191-S194 VanDerWaalsContact O-OG 3.07Å; I191-F195 HydrophobicContact CG2-CD2 3.69Å; I191-F195 HydrophobicContact CG2-CE2 3.66Å; I191-F195 HydrophobicContact CG2-CZ 4.44Å; I191-F195 WeakPolarHBondContact O-CB 3.38Å; I191-F195 VanDerWaalsContact O-CD2 3.27Å; I191-F195 WeakPolarHBondContact O-CD2 3.15Å; I191-F195 PolarHBondContact O-N 3.12Å
192	C	86.2	Confident	82.4	Confident	28 Å²	28	46.3 Å²	46.3	19%	0.189	24%	0.235	C	C	.	.	H	α-helix	trans	-58.3	-40.5	178.3	-172.1	0	0	0	0	112.3	A188 G196 M211	A188-C192 WeakPolarHBondContact O-CB 3.43Å; A188-C192 PolarHBondContact O-N 3.29Å; C192-G196 PolarHBondContact O-N 3.24Å; C192-M211 HydrophobicContact CB-CG 4.28Å
193	K	84.3	Confident	80.8	Confident	84 Å²	84	54.1 Å²	54.1	37%	0.365	27%	0.271	S	S	.	.	H	α-helix	trans	-68.2	-43.9	175.9	-71.2	160.8	-173	154.9	0	112.8	L152 S189 V190 I191 G196 Y197	L152-K193 PolarHBondContact O-NZ 3.14Å; S189-K193 VanDerWaalsContact O-CD 3.25Å; S189-K193 WeakPolarHBondContact O-CD 3.5Å; S189-K193 WeakPolarHBondContact O-CG 3.3Å; S189-K193 PolarHBondContact O-N 2.98Å; S189-K193 VanDerWaalsContact O-N 3.14Å; S189-K193 WeakPolarHBondContact OG-CE 3.18Å; S189-K193 PolarHBondContact OG-NZ 2.91Å; V190-K193 PolarHBondContact O-N 2.79Å; I191-K193 VanDerWaalsContact C-N 3.29Å; I191-K193 PolarHBondContact O-N 3.27Å; K193-G196 PolarHBondContact O-N 2.94Å; K193-Y197 PolarHBondContact O-N 3.27Å
194	S	82	Confident	79.6	Confident	51 Å²	51	59.2 Å²	59.2	36%	0.357	30%	0.299	S	S	.	.	H	α-helix	trans	-68.5	-41.7	-178.9	62.5	0	0	0	0	111.9	V190 I191 Y197 I198	V190-S194 PolarHBondContact O-N 2.88Å; V190-S194 PolarHBondContact O-OG 3.41Å; I191-S194 PolarHBondContact O-N 2.79Å; I191-S194 PolarHBondContact O-OG 2.81Å; I191-S194 VanDerWaalsContact O-OG 3.07Å; S194-Y197 PolarHBondContact O-N 3.24Å; S194-I198 VanDerWaalsContact O-CG1 3.3Å; S194-I198 WeakPolarHBondContact O-CG1 3.25Å; S194-I198 PolarHBondContact O-N 2.92Å
195	F	78.5	Confident	78.5	Confident	36 Å²	36	65 Å²	65	16%	0.158	32%	0.321	C	S	.	.	H	α-helix	trans	-66.5	-38.3	173.6	-80.2	-118.6	0	0	0	111.7	F58 I64 I191 Y197 I198 A199	F58-F195 HydrophobicContact CB-CD1 4.09Å; F58-F195 HydrophobicContact CB-CE1 4.35Å; F58-F195 HydrophobicContact CD1-CD1 4.06Å; F58-F195 AromaticContact CD1-CE1 3.46Å; F58-F195 HydrophobicContact CD1-CE1 3.46Å; F58-F195 VanDerWaalsContact CD1-CE1 3.46Å; F58-F195 HydrophobicContact CD1-CZ 4.29Å; F58-F195 AromaticContact CE1-CE1 3.91Å; F58-F195 HydrophobicContact CE1-CE1 3.91Å; F58-F195 HydrophobicContact CE1-CZ 4.3Å; F58-F195 HydrophobicContact CG-CD1 4.18Å; F58-F195 HydrophobicContact CG-CE1 4.04Å; I64-F195 HydrophobicContact CD1-CB 4.36Å; I64-F195 HydrophobicContact CD1-CD1 3.87Å; I64-F195 HydrophobicContact CD1-CG 4.32Å; I64-F195 HydrophobicContact CG1-CD1 3.68Å; I64-F195 HydrophobicContact CG1-CE1 3.83Å; I64-F195 HydrophobicContact CG1-CG 4.38Å; I191-F195 HydrophobicContact CG2-CD2 3.69Å; I191-F195 HydrophobicContact CG2-CE2 3.66Å; I191-F195 HydrophobicContact CG2-CZ 4.44Å; I191-F195 WeakPolarHBondContact O-CB 3.38Å; I191-F195 VanDerWaalsContact O-CD2 3.27Å; I191-F195 WeakPolarHBondContact O-CD2 3.15Å; I191-F195 PolarHBondContact O-N 3.12Å; F195-Y197 PolarHBondContact O-N 3.46Å; F195-I198 PolarHBondContact O-N 3.25Å; F195-A199 VanDerWaalsContact O-CB 3.31Å; F195-A199 WeakPolarHBondContact O-CB 3.38Å; F195-A199 PolarHBondContact O-N 3.32Å
196	G	74.1	Confident	77.7	Confident	21 Å²	21	70.8 Å²	70.8	22%	0.216	35%	0.352	C	S	.	.	H	α-helix	trans	-59.5	-43	173.2	0	0	0	0	0	113	C192 K193 Q200 L201	C192-G196 PolarHBondContact O-N 3.24Å; K193-G196 PolarHBondContact O-N 2.94Å; G196-Q200 WeakPolarHBondContact O-CA 3.47Å; G196-Q200 PolarHBondContact O-N 3.35Å; G196-L201 PolarHBondContact O-N 2.66Å
197	Y	71.9	Confident	76.9	Confident	202 Å²	202	73.4 Å²	73.4	79%	0.792	36%	0.361	S	S	*	.	H	α-helix	trans	-63.5	-46.4	174.7	179.3	-100.5	0	0	0	112.5	K193 S194 F195	K193-Y197 PolarHBondContact O-N 3.27Å; S194-Y197 PolarHBondContact O-N 3.24Å; F195-Y197 PolarHBondContact O-N 3.46Å
198	I	68.9	Low	76.4	Confident	93 Å²	93	75.1 Å²	75.1	48%	0.477	37%	0.369	S	S	.	.	H	α-helix	trans	-63.6	-47.2	179	-68.9	163.9	0	0	0	111.4	F58 S194 F195 Q200	F58-I198 HydrophobicContact CD2-CG2 4.12Å; F58-I198 HydrophobicContact CE2-CG2 4.39Å; S194-I198 VanDerWaalsContact O-CG1 3.3Å; S194-I198 WeakPolarHBondContact O-CG1 3.25Å; S194-I198 PolarHBondContact O-N 2.92Å; F195-I198 PolarHBondContact O-N 3.25Å; I198-Q200 VanDerWaalsContact C-N 3.32Å; I198-Q200 PolarHBondContact O-N 2.86Å
199	A	64.1	Low	76	Confident	5 Å²	5	76.8 Å²	76.8	4%	0.041	38%	0.382	C	S	.	.	H	α-helix	trans	-78.2	-14.6	-175.8	0	0	0	0	0	113.9	R55 F195 L201	R55-A199 PolarHBondContact NE-O 2.89Å; R55-A199 VanDerWaalsContact NE-O 3.16Å; R55-A199 PolarHBondContact NH2-O 3.17Å; F195-A199 VanDerWaalsContact O-CB 3.31Å; F195-A199 WeakPolarHBondContact O-CB 3.38Å; F195-A199 PolarHBondContact O-N 3.32Å; A199-L201 VanDerWaalsContact C-N 3.3Å; A199-L201 HydrophobicContact CB-CD1 3.74Å; A199-L201 HydrophobicContact CB-CG 3.73Å
200	Q	62.8	Low	75.8	Confident	158 Å²	158	78.1 Å²	78.1	74%	0.738	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	36	-171.2	-55.2	177.3	-26	0	0	113.3	G196 I198	G196-Q200 WeakPolarHBondContact O-CA 3.47Å; G196-Q200 PolarHBondContact O-N 3.35Å; I198-Q200 VanDerWaalsContact C-N 3.32Å; I198-Q200 PolarHBondContact O-N 2.86Å
201	L	60.8	Low	75.8	Confident	74 Å²	74	76.4 Å²	76.4	39%	0.387	38%	0.378	S	S	.	.			trans	-88.9	147	179.3	-66	172.1	0	0	0	111	G196 A199	G196-L201 PolarHBondContact O-N 2.66Å; A199-L201 VanDerWaalsContact C-N 3.3Å; A199-L201 HydrophobicContact CB-CD1 3.74Å; A199-L201 HydrophobicContact CB-CG 3.73Å
202	N	57.4	Low	75.9	Confident	148 Å²	148	75.6 Å²	75.6	79%	0.791	37%	0.374	S	S	*	.			trans	-61.8	144.7	172.8	-79	-24.6	0	0	0	111.3	N204	N202-N204 VanDerWaalsContact C-N 3.27Å; N202-N204 PolarHBondContact O-N 3.36Å
203	E	62	Low	76.2	Confident	163 Å²	163	74.4 Å²	74.4	76%	0.762	37%	0.366	S	S	*	.			trans	-69.5	77.7	177.4	-68.1	-170.1	149.5	0	0	111.9	R205	E203-R205 PolarHBondContact O-N 3.43Å
204	N	71	Confident	76.6	Confident	108 Å²	108	70.5 Å²	70.5	58%	0.578	35%	0.349	S	S	*	.			trans	-66.7	96	172.9	-76.8	-1.8	0	0	0	110	N202 N206 R207 Q208	N202-N204 VanDerWaalsContact C-N 3.27Å; N202-N204 PolarHBondContact O-N 3.36Å; N204-N206 PolarHBondContact O-N 2.9Å; N204-N206 VanDerWaalsContact O-N 3.09Å; N204-R207 HydrophobicContact CB-CB 4.09Å; N204-R207 WeakPolarHBondContact O-CA 3.37Å; N204-R207 WeakPolarHBondContact O-CB 3.31Å; N204-R207 PolarHBondContact O-N 3.36Å; N204-Q208 PolarHBondContact O-N 3.2Å; N204-Q208 VanDerWaalsContact O-N 3.1Å
205	R	72.2	Confident	77.2	Confident	122 Å²	122	68 Å²	68	46%	0.46	33%	0.332	S	S	.	.	H	α-helix	trans	-50.1	-37	-179.7	-65.5	-175	-174.9	170.1	4.5	113.4	E203 Q208 A209	E203-R205 PolarHBondContact O-N 3.43Å; R205-Q208 WeakPolarHBondContact O-CB 3.49Å; R205-Q208 PolarHBondContact O-N 2.96Å; R205-A209 PolarHBondContact O-N 2.94Å
206	N	76.2	Confident	78	Confident	121 Å²	121	66.3 Å²	66.3	65%	0.647	33%	0.325	S	S	*	.	H	α-helix	trans	-62.4	-48.6	177.9	-61.3	13.2	0	0	0	110.2	N204 Q208 A209 E210	N204-N206 PolarHBondContact O-N 2.9Å; N204-N206 VanDerWaalsContact O-N 3.09Å; N206-Q208 VanDerWaalsContact C-N 3.25Å; N206-Q208 PolarHBondContact O-N 2.97Å; N206-A209 PolarHBondContact O-N 3.35Å; N206-A209 VanDerWaalsContact O-N 3.09Å; N206-E210 VanDerWaalsContact O-CG 3.28Å; N206-E210 WeakPolarHBondContact O-CG 3.18Å; N206-E210 PolarHBondContact O-N 3.45Å
207	R	80.1	Confident	79	Confident	55 Å²	55	65.5 Å²	65.5	21%	0.208	32%	0.316	C	S	.	.	H	α-helix	trans	-58.9	-36.4	174.2	-168.1	-176.6	-174	-159.8	5.4	111.8	D61 N204 M211	D61-R207 IonicContact OD1-CZ 2.66Å; D61-R207 IonicContact OD1-NE 3.21Å; D61-R207 PolarHBondContact OD1-NE 3.31Å; D61-R207 IonicContact OD1-NH2 3.87Å; D61-R207 PolarHBondContact OD1-NH2 2.85Å; N204-R207 HydrophobicContact CB-CB 4.09Å; N204-R207 WeakPolarHBondContact O-CA 3.37Å; N204-R207 WeakPolarHBondContact O-CB 3.31Å; N204-R207 PolarHBondContact O-N 3.36Å; R207-M211 VanDerWaalsContact O-CB 3.26Å; R207-M211 WeakPolarHBondContact O-CB 3.35Å; R207-M211 PolarHBondContact O-N 3.45Å
208	Q	85.1	Confident	80.1	Confident	45 Å²	45	55.9 Å²	55.9	21%	0.21	28%	0.278	C	S	.	.	H	α-helix	trans	-65.8	-43.4	174.5	-166.1	-175.1	19.2	0	0	112.1	S189 N204 R205 N206 M211 I212	S189-Q208 PolarHBondContact OG-NE2 2.84Å; N204-Q208 PolarHBondContact O-N 3.2Å; N204-Q208 VanDerWaalsContact O-N 3.1Å; R205-Q208 WeakPolarHBondContact O-CB 3.49Å; R205-Q208 PolarHBondContact O-N 2.96Å; N206-Q208 VanDerWaalsContact C-N 3.25Å; N206-Q208 PolarHBondContact O-N 2.97Å; Q208-M211 PolarHBondContact O-N 2.89Å; Q208-I212 HydrophobicContact CG-CD1 4Å; Q208-I212 WeakPolarHBondContact O-CB 3.14Å; Q208-I212 WeakPolarHBondContact O-CD1 3.34Å; Q208-I212 VanDerWaalsContact O-CG1 3.24Å; Q208-I212 WeakPolarHBondContact O-CG1 3.24Å; Q208-I212 PolarHBondContact O-N 3.35Å
209	A	85.8	Confident	81.3	Confident	34 Å²	34	51.5 Å²	51.5	28%	0.281	26%	0.255	S	S	.	.	H	α-helix	trans	-66.5	-41	176.7	0	0	0	0	0	112.3	L143 R205 N206 M211 I212 A213	L143-A209 HydrophobicContact CD2-CB 4.47Å; R205-A209 PolarHBondContact O-N 2.94Å; N206-A209 PolarHBondContact O-N 3.35Å; N206-A209 VanDerWaalsContact O-N 3.09Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 3.16Å; A209-I212 PolarHBondContact O-N 3.47Å; A209-A213 WeakPolarHBondContact O-CB 3.49Å; A209-A213 PolarHBondContact O-N 3.05Å
210	E	87.5	Confident	82.7	Confident	28 Å²	28	51.4 Å²	51.4	13%	0.131	25%	0.254	C	S	.	.	H	α-helix	trans	-60.2	-41.5	172.8	-65.9	-179.3	143.7	0	0	111.8	N206 A213 A214 R245 N246 R249	N206-E210 VanDerWaalsContact O-CG 3.28Å; N206-E210 WeakPolarHBondContact O-CG 3.18Å; N206-E210 PolarHBondContact O-N 3.45Å; E210-A213 PolarHBondContact O-N 2.8Å; E210-A214 PolarHBondContact O-N 3.24Å; E210-A214 VanDerWaalsContact O-N 3.11Å; E210-R245 IonicContact OE1-CZ 2.89Å; E210-R245 IonicContact OE1-NE 3.38Å; E210-R245 PolarHBondContact OE1-NE 3.19Å; E210-R245 IonicContact OE1-NH2 2.66Å; E210-R245 PolarHBondContact OE1-NH2 3.21Å; E210-R245 IonicContact OE2-NH2 2.77Å; E210-N246 WeakPolarHBondContact CG-OD1 2.97Å; E210-R249 IonicContact OE1-NH1 2.72Å; E210-R249 PolarHBondContact OE1-NH1 3.15Å; E210-R249 IonicContact OE2-CZ 2.59Å; E210-R249 IonicContact OE2-NH1 3.4Å; E210-R249 PolarHBondContact OE2-NH1 2.89Å; E210-R249 IonicContact OE2-NH2 3.18Å
211	M	89.8	Confident	84.1	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.034	22%	0.219	C	C	.	.	H	α-helix	trans	-72	-38.8	178.1	-169.6	55.7	61.2	0	0	112.2	I64 L65 L68 A188 C192 R207 Q208 A209 A213 A214 G215	I64-M211 HydrophobicContact CB-CE 4.1Å; I64-M211 HydrophobicContact CG2-CE 3.66Å; I64-M211 HydrophobicContact CG2-SD 3.94Å; L65-M211 HydrophobicContact CD2-CE 3.96Å; L65-M211 HydrophobicContact CD2-SD 3.84Å; L65-M211 HydrophobicContact CG-CE 4.18Å; L68-M211 HydrophobicContact CD2-SD 3.96Å; A188-M211 HydrophobicContact CB-CG 4.12Å; A188-M211 VanDerWaalsContact CB-O 3.29Å; A188-M211 WeakPolarHBondContact CB-O 3.1Å; C192-M211 HydrophobicContact CB-CG 4.28Å; R207-M211 VanDerWaalsContact O-CB 3.26Å; R207-M211 WeakPolarHBondContact O-CB 3.35Å; R207-M211 PolarHBondContact O-N 3.45Å; Q208-M211 PolarHBondContact O-N 2.89Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 3.16Å; M211-A213 VanDerWaalsContact C-N 3.35Å; M211-A214 PolarHBondContact O-N 3.01Å; M211-G215 PolarHBondContact O-N 3.35Å
212	I	92.5	Very high	85.6	Confident	4 Å²	4	40.5 Å²	40.5	2%	0.021	20%	0.202	C	C	.	.	H	α-helix	trans	-59.8	-45.9	171.7	-72.6	162.6	0	0	0	110.2	I139 I142 L143 L152 Q208 A209 A214 G215 C216	I139-I212 HydrophobicContact CD1-CG2 4.45Å; I142-I212 HydrophobicContact CG2-CD1 4.41Å; L143-I212 HydrophobicContact CD2-CB 4.39Å; L143-I212 HydrophobicContact CD2-CG2 3.97Å; L152-I212 HydrophobicContact CD1-CD1 3.64Å; Q208-I212 HydrophobicContact CG-CD1 4Å; Q208-I212 WeakPolarHBondContact O-CB 3.14Å; Q208-I212 WeakPolarHBondContact O-CD1 3.34Å; Q208-I212 VanDerWaalsContact O-CG1 3.24Å; Q208-I212 WeakPolarHBondContact O-CG1 3.24Å; Q208-I212 PolarHBondContact O-N 3.35Å; A209-I212 PolarHBondContact O-N 3.47Å; I212-A214 VanDerWaalsContact C-N 3.32Å; I212-A214 PolarHBondContact O-N 2.96Å; I212-G215 CarbonylContact O-C 3.49Å; I212-G215 WeakPolarHBondContact O-CA 3.36Å; I212-G215 PolarHBondContact O-N 3.28Å; I212-C216 PolarHBondContact O-N 2.99Å; I212-C216 PolarHBondContact O-SG 3.28Å
213	A	92.5	Very high	87.1	Confident	4 Å²	4	33.7 Å²	33.7	3%	0.033	17%	0.165	C	C	.	.	H	α-helix	trans	-61.3	-37.1	177.7	0	0	0	0	0	113.1	L143 A209 E210 M211 C216 A217 F242	L143-A213 HydrophobicContact CD1-CB 4.09Å; L143-A213 HydrophobicContact CD2-CB 4.36Å; A209-A213 WeakPolarHBondContact O-CB 3.49Å; A209-A213 PolarHBondContact O-N 3.05Å; E210-A213 PolarHBondContact O-N 2.8Å; M211-A213 VanDerWaalsContact C-N 3.35Å; A213-C216 WeakPolarHBondContact O-CB 3.48Å; A213-C216 PolarHBondContact O-N 2.83Å; A213-A217 PolarHBondContact O-N 3.04Å; A213-F242 HydrophobicContact CB-CE2 3.95Å; A213-F242 HydrophobicContact CB-CZ 4.27Å
214	A	93.9	Very high	88.4	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.008	13%	0.132	C	C	.	.	H	α-helix	trans	-64.4	-42	169.5	0	0	0	0	0	111.5	L65 L68 E210 M211 I212 C216 A217 V218	L65-A214 HydrophobicContact CD2-CB 3.69Å; L68-A214 HydrophobicContact CD2-CB 4.22Å; E210-A214 PolarHBondContact O-N 3.24Å; E210-A214 VanDerWaalsContact O-N 3.11Å; M211-A214 PolarHBondContact O-N 3.01Å; I212-A214 VanDerWaalsContact C-N 3.32Å; I212-A214 PolarHBondContact O-N 2.96Å; A214-C216 VanDerWaalsContact C-N 3.3Å; A214-C216 PolarHBondContact O-N 2.81Å; A214-A217 PolarHBondContact O-N 3.25Å; A214-V218 WeakPolarHBondContact O-CG2 3.46Å; A214-V218 PolarHBondContact O-N 3.31Å
215	G	94.9	Very high	89.1	Confident	0 Å²	0	23.3 Å²	23.3	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-59.8	-35.1	174.3	0	0	0	0	0	114.1	G184 M211 I212 G219	G184-G215 CarbonylContact C-O 3.24Å; G184-G215 WeakPolarHBondContact CA-O 3.29Å; M211-G215 PolarHBondContact O-N 3.35Å; I212-G215 CarbonylContact O-C 3.49Å; I212-G215 WeakPolarHBondContact O-CA 3.36Å; I212-G215 PolarHBondContact O-N 3.28Å; G215-G219 PolarHBondContact O-N 3.49Å
216	C	94.3	Very high	89.9	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-60	-54.2	171	-56.4	0	0	0	0	111	I139 V181 S185 I212 A213 A214 V218 G219 V220 S234	I139-C216 WeakPolarHBondContact CG2-SG 3.17Å; V181-C216 HydrophobicContact CG1-CB 3.73Å; S185-C216 PolarHBondContact OG-SG 2.9Å; I212-C216 PolarHBondContact O-N 2.99Å; I212-C216 PolarHBondContact O-SG 3.28Å; A213-C216 WeakPolarHBondContact O-CB 3.48Å; A213-C216 PolarHBondContact O-N 2.83Å; A214-C216 VanDerWaalsContact C-N 3.3Å; A214-C216 PolarHBondContact O-N 2.81Å; C216-V218 PolarHBondContact O-N 3.11Å; C216-G219 PolarHBondContact O-N 2.98Å; C216-G219 VanDerWaalsContact O-N 3.1Å; C216-V220 WeakPolarHBondContact O-CG2 3.39Å; C216-V220 PolarHBondContact O-N 2.9Å; C216-V220 VanDerWaalsContact O-N 3.14Å; C216-S234 WeakPolarHBondContact CB-OG 3.2Å
217	A	94.7	Very high	90.8	Very high	4 Å²	4	12.9 Å²	12.9	3%	0.033	8%	0.079	C	C	.	.	H	α-helix	trans	-62.6	-41.3	-176.5	0	0	0	0	0	112.5	A213 A214 G219 V220 A221 V231 S234	A213-A217 PolarHBondContact O-N 3.04Å; A214-A217 PolarHBondContact O-N 3.25Å; A217-G219 VanDerWaalsContact C-N 3.35Å; A217-V220 PolarHBondContact O-N 3.43Å; A217-A221 VanDerWaalsContact O-CB 3.29Å; A217-A221 WeakPolarHBondContact O-CB 3.19Å; A217-A221 PolarHBondContact O-N 3.33Å; A217-V231 HydrophobicContact CB-CB 4.37Å; A217-V231 HydrophobicContact CB-CG2 3.95Å; A217-S234 PolarHBondContact N-OG 2.93Å
218	V	95.8	Very high	91.5	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.9	-43.8	172.7	174.4	0	0	0	0	111.1	L68 V72 A214 C216 V220 A221 C222 S253	L68-V218 HydrophobicContact CD2-CG2 4.36Å; L68-V218 HydrophobicContact CG-CG2 4.32Å; V72-V218 HydrophobicContact CB-CG1 3.63Å; V72-V218 HydrophobicContact CG1-CG1 3.86Å; V72-V218 HydrophobicContact CG2-CG1 3.87Å; A214-V218 WeakPolarHBondContact O-CG2 3.46Å; A214-V218 PolarHBondContact O-N 3.31Å; C216-V218 PolarHBondContact O-N 3.11Å; V218-V220 VanDerWaalsContact C-N 3.3Å; V218-V220 PolarHBondContact O-N 3.38Å; V218-A221 PolarHBondContact O-N 3.36Å; V218-C222 WeakPolarHBondContact O-CB 3.31Å; V218-C222 PolarHBondContact O-N 3.25Å; V218-S253 WeakPolarHBondContact CG2-OG 3.44Å
219	G	93.9	Very high	91.8	Very high	0 Å²	0	11.1 Å²	11.1	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-60.3	-35.3	178.6	0	0	0	0	0	113.8	G215 C216 A217 T223	G215-G219 PolarHBondContact O-N 3.49Å; C216-G219 PolarHBondContact O-N 2.98Å; C216-G219 VanDerWaalsContact O-N 3.1Å; A217-G219 VanDerWaalsContact C-N 3.35Å; G219-T223 WeakPolarHBondContact O-CG2 3.21Å; G219-T223 PolarHBondContact O-OG1 2.87Å
220	V	92.7	Very high	92.1	Very high	3 Å²	3	9.5 Å²	9.5	2%	0.018	6%	0.061	C	C	.	.	H	α-helix	trans	-80.7	-44.2	176.2	-172.8	0	0	0	0	111.8	V181 C216 A217 V218 C222 T223 F224 G230 F233	V181-V220 HydrophobicContact CG1-CG2 4.48Å; V181-V220 HydrophobicContact CG2-CG2 3.5Å; C216-V220 WeakPolarHBondContact O-CG2 3.39Å; C216-V220 PolarHBondContact O-N 2.9Å; C216-V220 VanDerWaalsContact O-N 3.14Å; A217-V220 PolarHBondContact O-N 3.43Å; V218-V220 VanDerWaalsContact C-N 3.3Å; V218-V220 PolarHBondContact O-N 3.38Å; V220-C222 VanDerWaalsContact C-N 3.28Å; V220-C222 PolarHBondContact O-N 3.38Å; V220-T223 PolarHBondContact O-N 3.33Å; V220-T223 PolarHBondContact O-OG1 3.38Å; V220-F224 HydrophobicContact CG1-CD2 3.77Å; V220-F224 HydrophobicContact CG1-CE2 3.57Å; V220-F224 WeakPolarHBondContact O-CD2 3.27Å; V220-F224 PolarHBondContact O-N 3.37Å; V220-G230 VanDerWaalsContact CG1-CA 3.49Å; V220-F233 HydrophobicContact CG1-CB 4.46Å; V220-F233 HydrophobicContact CG1-CD1 3.83Å; V220-F233 HydrophobicContact CG1-CG 4.49Å; V220-F233 HydrophobicContact CG2-CD1 4.07Å
221	A	93.2	Very high	92.4	Very high	0 Å²	0	8.3 Å²	8.3	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-62.5	-36.9	179.4	0	0	0	0	0	112.4	A217 V218 T223 G225 A226 A254	A217-A221 VanDerWaalsContact O-CB 3.29Å; A217-A221 WeakPolarHBondContact O-CB 3.19Å; A217-A221 PolarHBondContact O-N 3.33Å; V218-A221 PolarHBondContact O-N 3.36Å; A221-T223 VanDerWaalsContact C-N 3.3Å; A221-T223 PolarHBondContact O-N 3.27Å; A221-G225 CarbonylContact O-C 3.55Å; A221-G225 VanDerWaalsContact O-CA 3.27Å; A221-G225 WeakPolarHBondContact O-CA 3.43Å; A221-G225 PolarHBondContact O-N 3.31Å; A221-A226 PolarHBondContact O-N 2.88Å; A221-A254 HydrophobicContact CB-CB 3.51Å
222	C	92.1	Very high	92.7	Very high	3 Å²	3	10.6 Å²	10.6	2%	0.02	7%	0.068	C	C	.	.	H	α-helix	trans	-73.4	-16.1	-178.4	-166.4	0	0	0	0	114.3	V72 A73 S76 V218 V220 S257	V72-C222 HydrophobicContact CG1-CB 4.1Å; A73-C222 VanDerWaalsContact CA-SG 3.56Å; S76-C222 VanDerWaalsContact CB-SG 3.5Å; V218-C222 WeakPolarHBondContact O-CB 3.31Å; V218-C222 PolarHBondContact O-N 3.25Å; V220-C222 VanDerWaalsContact C-N 3.28Å; V220-C222 PolarHBondContact O-N 3.38Å; C222-S257 WeakPolarHBondContact CB-OG 3.45Å; C222-S257 PolarHBondContact SG-OG 3.22Å; C222-S257 VanDerWaalsContact SG-OG 3.38Å
223	T	89.7	Confident	92.8	Very high	5 Å²	5	10.6 Å²	10.6	3%	0.031	7%	0.068	C	C	.	.	H	α-helix	trans	-96.6	-36.9	-179.1	50.3	0	0	0	0	113.4	K176 E177 M180 G219 V220 A221 Y277	K176-T223 HydrophobicContact CD-CG2 3.87Å; K176-T223 HydrophobicContact CG-CG2 3.89Å; E177-T223 WeakPolarHBondContact OE2-CB 3.41Å; E177-T223 PolarHBondContact OE2-OG1 2.91Å; M180-T223 HydrophobicContact CB-CG2 3.51Å; M180-T223 HydrophobicContact CG-CG2 3.48Å; M180-T223 VanDerWaalsContact CG-CG2 3.48Å; G219-T223 WeakPolarHBondContact O-CG2 3.21Å; G219-T223 PolarHBondContact O-OG1 2.87Å; V220-T223 PolarHBondContact O-N 3.33Å; V220-T223 PolarHBondContact O-OG1 3.38Å; A221-T223 VanDerWaalsContact C-N 3.3Å; A221-T223 PolarHBondContact O-N 3.27Å; T223-Y277 WeakPolarHBondContact O-CD1 3.22Å
224	F	87.8	Confident	92.8	Very high	14 Å²	14	10.5 Å²	10.5	6%	0.061	7%	0.067	C	C	.	.	H	α-helix	trans	-87.2	-16.1	172.4	-58.3	-56.7	0	0	0	113.8	E177 V220 A226 Y277 F388 I445 L449	E177-F224 HydrophobicContact CB-CZ 4.32Å; E177-F224 HydrophobicContact CG-CE1 3.93Å; E177-F224 HydrophobicContact CG-CZ 3.73Å; E177-F224 VanDerWaalsContact OE2-CE1 3.3Å; E177-F224 WeakPolarHBondContact OE2-CE1 3.08Å; E177-F224 WeakPolarHBondContact OE2-CZ 3.45Å; V220-F224 HydrophobicContact CG1-CD2 3.77Å; V220-F224 HydrophobicContact CG1-CE2 3.57Å; V220-F224 WeakPolarHBondContact O-CD2 3.27Å; V220-F224 PolarHBondContact O-N 3.37Å; F224-A226 HydrophobicContact CB-CB 3.81Å; F224-A226 PolarHBondContact O-N 3.36Å; F224-Y277 WeakPolarHBondContact O-CB 3.36Å; F224-F388 AromaticContact CE1-CD1 3.63Å; F224-F388 HydrophobicContact CE1-CD1 3.63Å; F224-F388 AromaticContact CE1-CE1 3.49Å; F224-F388 HydrophobicContact CE1-CE1 3.49Å; F224-F388 VanDerWaalsContact CE1-CE1 3.49Å; F224-F388 HydrophobicContact CE1-CG 4.44Å; F224-F388 HydrophobicContact CE1-CZ 4.19Å; F224-F388 HydrophobicContact CE2-CE1 4.23Å; F224-F388 HydrophobicContact CE2-CE2 4.36Å; F224-F388 HydrophobicContact CE2-CZ 4.14Å; F224-F388 AromaticContact CZ-CD1 3.35Å; F224-F388 HydrophobicContact CZ-CD1 3.35Å; F224-F388 HydrophobicContact CZ-CD2 4.06Å; F224-F388 AromaticContact CZ-CE1 3.28Å; F224-F388 HydrophobicContact CZ-CE1 3.28Å; F224-F388 AromaticContact CZ-CE2 3.98Å; F224-F388 HydrophobicContact CZ-CE2 3.98Å; F224-F388 AromaticContact CZ-CG 3.75Å; F224-F388 HydrophobicContact CZ-CG 3.75Å; F224-F388 AromaticContact CZ-CZ 3.6Å; F224-F388 HydrophobicContact CZ-CZ 3.6Å; F224-I445 HydrophobicContact CB-CG2 4.13Å; F224-I445 HydrophobicContact CD1-CG2 4.02Å; F224-I445 HydrophobicContact CD2-CD1 4.01Å; F224-I445 HydrophobicContact CD2-CG1 4.27Å; F224-I445 HydrophobicContact CD2-CG2 3.73Å; F224-I445 HydrophobicContact CE1-CG2 4.38Å; F224-I445 HydrophobicContact CE2-CD1 3.76Å; F224-I445 HydrophobicContact CE2-CG1 4.49Å; F224-I445 HydrophobicContact CE2-CG2 4.1Å; F224-I445 HydrophobicContact CG-CG2 3.69Å; F224-I445 HydrophobicContact CZ-CG2 4.43Å; F224-L449 HydrophobicContact CB-CD2 4.31Å; F224-L449 HydrophobicContact CD1-CD1 4.33Å; F224-L449 VanDerWaalsContact O-CD2 3.3Å; F224-L449 WeakPolarHBondContact O-CD2 3.28Å
225	G	86.7	Confident	92.7	Very high	40 Å²	40	12 Å²	12	41%	0.412	7%	0.074	S	C	.	.	S	Bend	trans	70.2	10.9	-165.7	0	0	0	0	0	113.7	A221 P227	A221-G225 CarbonylContact O-C 3.55Å; A221-G225 VanDerWaalsContact O-CA 3.27Å; A221-G225 WeakPolarHBondContact O-CA 3.43Å; A221-G225 PolarHBondContact O-N 3.31Å; G225-P227 WeakPolarHBondContact O-CD 3.27Å
226	A	89.7	Confident	92.6	Very high	0 Å²	0	15.7 Å²	15.7	0%	0	9%	0.091	C	C	.	.			trans	-105.6	86.1	-172.8	0	0	0	0	0	111.4	A221 F224 I228 G230 E448	A221-A226 PolarHBondContact O-N 2.88Å; F224-A226 HydrophobicContact CB-CB 3.81Å; F224-A226 PolarHBondContact O-N 3.36Å; A226-I228 VanDerWaalsContact C-N 3.34Å; A226-I228 PolarHBondContact O-N 2.84Å; A226-G230 WeakPolarHBondContact O-CA 3.06Å; A226-G230 PolarHBondContact O-N 2.94Å; A226-E448 VanDerWaalsContact C-OE2 3.22Å; A226-E448 WeakPolarHBondContact CA-OE2 3.35Å; A226-E448 HydrophobicContact CB-CB 3.55Å; A226-E448 HydrophobicContact CB-CG 4.19Å
227	P	93.8	Very high	92.3	Very high	23 Å²	23	16 Å²	16	15%	0.149	9%	0.093	C	C	.	.	H	α-helix	trans	-64.3	-27.7	-177.5	25.9	-36	0	0	0	115.1	G225 V231 A254 V255 E448	G225-P227 WeakPolarHBondContact O-CD 3.27Å; P227-V231 WeakPolarHBondContact O-CG2 3.34Å; P227-A254 HydrophobicContact CB-CB 4.19Å; P227-V255 HydrophobicContact CB-CG2 4.01Å; P227-V255 HydrophobicContact CG-CG2 4.47Å; P227-E448 WeakPolarHBondContact CD-OE2 3.42Å; P227-E448 VanDerWaalsContact N-OE2 3.09Å
228	I	94.4	Very high	91.9	Very high	64 Å²	64	15.9 Å²	15.9	33%	0.328	9%	0.092	S	C	.	.	H	α-helix	trans	-82.4	-58.4	-179.2	-56.2	169.1	0	0	0	109.6	A226 G230 V231 L232 F251 M444 E448	A226-I228 VanDerWaalsContact C-N 3.34Å; A226-I228 PolarHBondContact O-N 2.84Å; I228-G230 VanDerWaalsContact C-N 3.31Å; I228-G230 PolarHBondContact O-N 2.89Å; I228-V231 PolarHBondContact O-N 2.98Å; I228-L232 HydrophobicContact CG2-CD1 4.1Å; I228-L232 WeakPolarHBondContact O-CG 3.13Å; I228-L232 PolarHBondContact O-N 3.5Å; I228-F251 HydrophobicContact CG1-CE2 3.86Å; I228-M444 HydrophobicContact CB-CE 3.94Å; I228-M444 HydrophobicContact CB-CG 4.36Å; I228-M444 HydrophobicContact CD1-CE 3.88Å; I228-M444 HydrophobicContact CG2-CE 3.96Å; I228-M444 HydrophobicContact CG2-CG 4.04Å; I228-E448 PolarHBondContact N-OE2 3.48Å
229	G	92.2	Very high	91	Very high	0 Å²	0	17 Å²	17	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-59.9	-37.9	179.2	0	0	0	0	0	112.8	V231 L232 F233 E448	G229-V231 PolarHBondContact O-N 2.96Å; G229-L232 PolarHBondContact O-N 3.46Å; G229-F233 VanDerWaalsContact O-CB 3.27Å; G229-F233 WeakPolarHBondContact O-CB 3.36Å; G229-F233 PolarHBondContact O-N 3.39Å; G229-E448 WeakPolarHBondContact CA-OE1 3.48Å; G229-E448 PolarHBondContact N-OE1 3.37Å
230	G	91.8	Very high	90	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-65.7	-36	176.7	0	0	0	0	0	113.9	V220 A226 I228 S234	V220-G230 VanDerWaalsContact CG1-CA 3.49Å; A226-G230 WeakPolarHBondContact O-CA 3.06Å; A226-G230 PolarHBondContact O-N 2.94Å; I228-G230 VanDerWaalsContact C-N 3.31Å; I228-G230 PolarHBondContact O-N 2.89Å; G230-S234 WeakPolarHBondContact O-CB 3.49Å; G230-S234 PolarHBondContact O-N 3.15Å
231	V	94.8	Very high	89.3	Confident	2 Å²	2	25.2 Å²	25.2	1%	0.012	14%	0.143	C	C	.	.	H	α-helix	trans	-69.4	-45.8	173.4	173.1	0	0	0	0	110.6	A217 P227 I228 G229 S234 I235 Y247 F251 A254	A217-V231 HydrophobicContact CB-CB 4.37Å; A217-V231 HydrophobicContact CB-CG2 3.95Å; P227-V231 WeakPolarHBondContact O-CG2 3.34Å; I228-V231 PolarHBondContact O-N 2.98Å; G229-V231 PolarHBondContact O-N 2.96Å; V231-S234 WeakPolarHBondContact O-CB 3.38Å; V231-S234 PolarHBondContact O-N 3.1Å; V231-I235 HydrophobicContact CG1-CD1 4.02Å; V231-I235 WeakPolarHBondContact O-CG1 3.27Å; V231-I235 PolarHBondContact O-N 2.94Å; V231-I235 VanDerWaalsContact O-N 3.08Å; V231-Y247 HydrophobicContact CG1-CD2 3.66Å; V231-Y247 HydrophobicContact CG1-CE2 3.81Å; V231-F251 HydrophobicContact CG2-CB 4.19Å; V231-F251 HydrophobicContact CG2-CD2 4.45Å; V231-A254 HydrophobicContact CG2-CB 3.9Å
232	L	94.9	Very high	88.8	Confident	56 Å²	56	28 Å²	28	29%	0.293	16%	0.155	S	C	.	.	H	α-helix	trans	-61.8	-46	178.6	-66.6	172.7	0	0	0	111.7	I228 G229 S234 I235 E236 Y247 M444	I228-L232 HydrophobicContact CG2-CD1 4.1Å; I228-L232 WeakPolarHBondContact O-CG 3.13Å; I228-L232 PolarHBondContact O-N 3.5Å; G229-L232 PolarHBondContact O-N 3.46Å; L232-S234 VanDerWaalsContact C-N 3.35Å; L232-S234 PolarHBondContact O-N 3.05Å; L232-I235 WeakPolarHBondContact O-CB 3.4Å; L232-I235 PolarHBondContact O-N 2.94Å; L232-E236 WeakPolarHBondContact O-CG 3.38Å; L232-E236 PolarHBondContact O-N 2.76Å; L232-Y247 HydrophobicContact CD2-CE2 4.29Å; L232-M444 HydrophobicContact CD1-CB 4.41Å; L232-M444 HydrophobicContact CD1-CG 4.26Å
233	F	94.2	Very high	88.4	Confident	4 Å²	4	30.2 Å²	30.2	2%	0.018	17%	0.174	C	C	.	.	H	α-helix	trans	-61.8	-41.1	176.4	-178.8	-94.4	0	0	0	112.4	V220 G229 I235 V237 F388 T437 T439 S441 T442 I445 Y478	V220-F233 HydrophobicContact CG1-CB 4.46Å; V220-F233 HydrophobicContact CG1-CD1 3.83Å; V220-F233 HydrophobicContact CG1-CG 4.49Å; V220-F233 HydrophobicContact CG2-CD1 4.07Å; G229-F233 VanDerWaalsContact O-CB 3.27Å; G229-F233 WeakPolarHBondContact O-CB 3.36Å; G229-F233 PolarHBondContact O-N 3.39Å; F233-I235 PolarHBondContact O-N 2.92Å; F233-V237 HydrophobicContact CD1-CG2 4.21Å; F233-V237 HydrophobicContact CD2-CG2 4.01Å; F233-V237 HydrophobicContact CE1-CG2 3.93Å; F233-V237 HydrophobicContact CE2-CG2 3.7Å; F233-V237 HydrophobicContact CG-CG2 4.25Å; F233-V237 HydrophobicContact CZ-CG2 3.66Å; F233-V237 WeakPolarHBondContact O-CB 3.22Å; F233-V237 WeakPolarHBondContact O-CG2 3.43Å; F233-V237 PolarHBondContact O-N 3.44Å; F233-F388 HydrophobicContact CD2-CE2 4.04Å; F233-F388 HydrophobicContact CE1-CD2 4.33Å; F233-F388 AromaticContact CE2-CD2 3.77Å; F233-F388 HydrophobicContact CE2-CD2 3.77Å; F233-F388 AromaticContact CE2-CE2 3.58Å; F233-F388 HydrophobicContact CE2-CE2 3.58Å; F233-F388 AromaticContact CZ-CD2 3.6Å; F233-F388 HydrophobicContact CZ-CD2 3.6Å; F233-F388 AromaticContact CZ-CE2 3.87Å; F233-F388 HydrophobicContact CZ-CE2 3.87Å; F233-T437 HydrophobicContact CE2-CG2 4.42Å; F233-T437 HydrophobicContact CZ-CG2 4.49Å; F233-T439 HydrophobicContact CD2-CG2 3.8Å; F233-T439 HydrophobicContact CE2-CG2 3.78Å; F233-S441 WeakPolarHBondContact CA-OG 3.05Å; F233-S441 WeakPolarHBondContact CB-OG 3.23Å; F233-S441 PolarHBondContact N-OG 2.68Å; F233-T442 HydrophobicContact CE2-CG2 4.47Å; F233-I445 HydrophobicContact CB-CD1 3.77Å; F233-I445 HydrophobicContact CD2-CD1 4.19Å; F233-I445 HydrophobicContact CG-CD1 4Å; F233-Y478 HydrophobicContact CZ-CE2 4.28Å
234	S	93.1	Very high	88.3	Confident	2 Å²	2	35.9 Å²	35.9	1%	0.014	20%	0.203	C	C	.	.	H	α-helix	trans	-60.2	-34.2	172.7	-179.9	0	0	0	0	112.5	C216 A217 G230 V231 L232 T238	C216-S234 WeakPolarHBondContact CB-OG 3.2Å; A217-S234 PolarHBondContact N-OG 2.93Å; G230-S234 WeakPolarHBondContact O-CB 3.49Å; G230-S234 PolarHBondContact O-N 3.15Å; V231-S234 WeakPolarHBondContact O-CB 3.38Å; V231-S234 PolarHBondContact O-N 3.1Å; L232-S234 VanDerWaalsContact C-N 3.35Å; L232-S234 PolarHBondContact O-N 3.05Å; S234-T238 WeakPolarHBondContact O-CB 3.27Å; S234-T238 VanDerWaalsContact O-CG2 3.32Å; S234-T238 WeakPolarHBondContact O-CG2 3.31Å; S234-T238 PolarHBondContact O-N 2.66Å; S234-T238 PolarHBondContact O-OG1 3.08Å
235	I	92.4	Very high	88.3	Confident	33 Å²	33	42.3 Å²	42.3	17%	0.169	23%	0.227	C	C	.	.	H	α-helix	trans	-73.8	-52.9	178.8	-68.4	167.2	0	0	0	110.6	V231 L232 F233 V237 T238 S239 F242 Y247	V231-I235 HydrophobicContact CG1-CD1 4.02Å; V231-I235 WeakPolarHBondContact O-CG1 3.27Å; V231-I235 PolarHBondContact O-N 2.94Å; V231-I235 VanDerWaalsContact O-N 3.08Å; L232-I235 WeakPolarHBondContact O-CB 3.4Å; L232-I235 PolarHBondContact O-N 2.94Å; F233-I235 PolarHBondContact O-N 2.92Å; I235-V237 PolarHBondContact O-N 3.33Å; I235-T238 PolarHBondContact O-N 3.02Å; I235-S239 PolarHBondContact O-N 3.06Å; I235-S239 VanDerWaalsContact O-N 3.1Å; I235-S239 PolarHBondContact O-OG 3.26Å; I235-F242 HydrophobicContact CD1-CD1 3.57Å; I235-F242 HydrophobicContact CD1-CE1 3.46Å; I235-F242 VanDerWaalsContact CD1-CE1 3.46Å; I235-F242 HydrophobicContact CD1-CG 4.39Å; I235-F242 HydrophobicContact CD1-CZ 4.22Å; I235-F242 HydrophobicContact CG1-CD1 3.63Å; I235-F242 HydrophobicContact CG1-CD2 4.27Å; I235-F242 HydrophobicContact CG1-CE1 3.47Å; I235-F242 VanDerWaalsContact CG1-CE1 3.47Å; I235-F242 HydrophobicContact CG1-CE2 4.16Å; I235-F242 HydrophobicContact CG1-CG 4.02Å; I235-F242 HydrophobicContact CG1-CZ 3.77Å; I235-F242 HydrophobicContact CG2-CB 3.94Å; I235-F242 HydrophobicContact CG2-CD1 4.19Å; I235-F242 HydrophobicContact CG2-CG 3.98Å; I235-Y247 HydrophobicContact CD1-CD2 3.73Å
236	E	91.6	Very high	88.3	Confident	77 Å²	77	41.2 Å²	41.2	36%	0.36	21%	0.212	S	C	.	.	H	α-helix	trans	-58	-44.2	-178.6	-70.8	175.8	-170.3	0	0	112.1	L232 T439 V440 S441	L232-E236 WeakPolarHBondContact O-CG 3.38Å; L232-E236 PolarHBondContact O-N 2.76Å; E236-T439 HydrophobicContact CB-CG2 4.09Å; E236-T439 WeakPolarHBondContact OE2-CA 3.34Å; E236-T439 WeakPolarHBondContact OE2-CB 3.44Å; E236-V440 PolarHBondContact OE2-N 3.03Å; E236-S441 VanDerWaalsContact CD-OG 3.28Å; E236-S441 WeakPolarHBondContact OE1-CB 3.16Å; E236-S441 PolarHBondContact OE1-N 3.44Å; E236-S441 VanDerWaalsContact OE2-CB 3.31Å; E236-S441 WeakPolarHBondContact OE2-CB 3.4Å; E236-S441 PolarHBondContact OE2-N 3.4Å; E236-S441 PolarHBondContact OE2-OG 3.28Å
237	V	89.2	Confident	88.4	Confident	6 Å²	6	43.9 Å²	43.9	4%	0.036	22%	0.222	C	C	.	.	H	α-helix	trans	-77.8	-36.2	-176.2	176.3	0	0	0	0	112.9	I136 K140 F233 I235 T439 Y478	I136-V237 HydrophobicContact CG2-CG1 3.42Å; I136-V237 VanDerWaalsContact CG2-CG1 3.42Å; K140-V237 WeakPolarHBondContact CD-O 3.23Å; K140-V237 WeakPolarHBondContact CE-O 3.22Å; F233-V237 HydrophobicContact CD1-CG2 4.21Å; F233-V237 HydrophobicContact CD2-CG2 4.01Å; F233-V237 HydrophobicContact CE1-CG2 3.93Å; F233-V237 HydrophobicContact CE2-CG2 3.7Å; F233-V237 HydrophobicContact CG-CG2 4.25Å; F233-V237 HydrophobicContact CZ-CG2 3.66Å; F233-V237 WeakPolarHBondContact O-CB 3.22Å; F233-V237 WeakPolarHBondContact O-CG2 3.43Å; F233-V237 PolarHBondContact O-N 3.44Å; I235-V237 PolarHBondContact O-N 3.33Å; V237-T439 HydrophobicContact CG2-CG2 3.43Å; V237-T439 VanDerWaalsContact CG2-CG2 3.43Å; V237-Y478 HydrophobicContact CG1-CD2 3.54Å; V237-Y478 HydrophobicContact CG1-CE2 3.79Å; V237-Y478 HydrophobicContact CG1-CG 4.19Å; V237-Y478 HydrophobicContact CG2-CD2 4.42Å; V237-Y478 HydrophobicContact CG2-CE2 4.19Å
238	T	85.2	Confident	88.3	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-100.7	-17.4	-167.8	74.7	0	0	0	0	115	I139 L143 S234 I235	I139-T238 HydrophobicContact CG2-CG2 4.12Å; L143-T238 WeakPolarHBondContact CD1-OG1 3.46Å; S234-T238 WeakPolarHBondContact O-CB 3.27Å; S234-T238 VanDerWaalsContact O-CG2 3.32Å; S234-T238 WeakPolarHBondContact O-CG2 3.31Å; S234-T238 PolarHBondContact O-N 2.66Å; S234-T238 PolarHBondContact O-OG1 3.08Å; I235-T238 PolarHBondContact O-N 3.02Å
239	S	76.6	Confident	88.2	Confident	24 Å²	24	47.5 Å²	47.5	17%	0.168	23%	0.229	C	C	.	.			trans	-139.1	158	-170.4	72.5	0	0	0	0	113.5	I235 F242	I235-S239 PolarHBondContact O-N 3.06Å; I235-S239 VanDerWaalsContact O-N 3.1Å; I235-S239 PolarHBondContact O-OG 3.26Å; S239-F242 WeakPolarHBondContact OG-CD2 3.46Å
240	V	74	Confident	88.1	Confident	75 Å²	75	47.5 Å²	47.5	46%	0.455	23%	0.229	S	C	.	.	S	Bend	trans	-108.1	-35.2	170.2	-173.8	0	0	0	0	110.8
241	H	77.8	Confident	88.2	Confident	99 Å²	99	50.1 Å²	50.1	46%	0.458	24%	0.241	S	C	.	.	S	Bend	trans	-122.9	126.5	175.3	-49.2	122.4	0	0	0	107.4	S725 L726	H241-S725 PolarHBondContact ND1-O 3.36Å; H241-L726 VanDerWaalsContact CE1-CD2 3.48Å; H241-L726 WeakPolarHBondContact CE1-CD2 3.23Å
242	F	81.9	Confident	88.2	Confident	58 Å²	58	53 Å²	53	25%	0.254	25%	0.253	S	S	.	.			trans	-132.9	126.1	-175.6	-158.5	-106.5	0	0	0	110.5	A213 I235 S239 N246 Y247	A213-F242 HydrophobicContact CB-CE2 3.95Å; A213-F242 HydrophobicContact CB-CZ 4.27Å; I235-F242 HydrophobicContact CD1-CD1 3.57Å; I235-F242 HydrophobicContact CD1-CE1 3.46Å; I235-F242 VanDerWaalsContact CD1-CE1 3.46Å; I235-F242 HydrophobicContact CD1-CG 4.39Å; I235-F242 HydrophobicContact CD1-CZ 4.22Å; I235-F242 HydrophobicContact CG1-CD1 3.63Å; I235-F242 HydrophobicContact CG1-CD2 4.27Å; I235-F242 HydrophobicContact CG1-CE1 3.47Å; I235-F242 VanDerWaalsContact CG1-CE1 3.47Å; I235-F242 HydrophobicContact CG1-CE2 4.16Å; I235-F242 HydrophobicContact CG1-CG 4.02Å; I235-F242 HydrophobicContact CG1-CZ 3.77Å; I235-F242 HydrophobicContact CG2-CB 3.94Å; I235-F242 HydrophobicContact CG2-CD1 4.19Å; I235-F242 HydrophobicContact CG2-CG 3.98Å; S239-F242 WeakPolarHBondContact OG-CD2 3.46Å; F242-N246 HydrophobicContact CD1-CB 4.32Å; F242-N246 HydrophobicContact CE1-CB 3.62Å; F242-N246 HydrophobicContact CE2-CB 4.15Å; F242-N246 HydrophobicContact CZ-CB 3.52Å; F242-Y247 VanDerWaalsContact CE1-N 3.32Å
243	A	83.7	Confident	88.2	Confident	51 Å²	51	50.4 Å²	50.4	42%	0.421	24%	0.239	S	C	.	.			trans	-74.2	131.3	178.2	0	0	0	0	0	110.3	R245 N246 Y247	A243-R245 PolarHBondContact O-N 3.14Å; A243-R245 VanDerWaalsContact O-N 3.07Å; A243-N246 WeakPolarHBondContact O-CA 3.33Å; A243-N246 WeakPolarHBondContact O-CB 3.43Å; A243-N246 PolarHBondContact O-N 3.11Å; A243-Y247 PolarHBondContact O-N 3.23Å
244	L	88.5	Confident	88.1	Confident	123 Å²	123	50.2 Å²	50.2	64%	0.644	24%	0.239	S	C	*	.	H	α-helix	trans	-57	-27.3	179.4	-172.3	64.5	0	0	0	113.1	N246 Y247 W248	L244-N246 VanDerWaalsContact C-N 3.26Å; L244-N246 PolarHBondContact O-N 3.09Å; L244-Y247 HydrophobicContact CD1-CD1 4.08Å; L244-Y247 HydrophobicContact CD1-CG 4.34Å; L244-Y247 WeakPolarHBondContact O-CB 3.16Å; L244-Y247 PolarHBondContact O-N 2.96Å; L244-W248 VanDerWaalsContact O-CD1 3.3Å; L244-W248 PolarHBondContact O-N 2.86Å; L244-W248 VanDerWaalsContact O-N 3.16Å
245	R	86.7	Confident	88.2	Confident	150 Å²	150	52.2 Å²	52.2	57%	0.566	25%	0.251	S	S	*	.	H	α-helix	trans	-57.3	-37.5	169.9	-179.9	169.9	68.8	-156.4	2.4	112.7	E210 A243 R249	E210-R245 IonicContact OE1-CZ 2.89Å; E210-R245 IonicContact OE1-NE 3.38Å; E210-R245 PolarHBondContact OE1-NE 3.19Å; E210-R245 IonicContact OE1-NH2 2.66Å; E210-R245 PolarHBondContact OE1-NH2 3.21Å; E210-R245 IonicContact OE2-NH2 2.77Å; A243-R245 PolarHBondContact O-N 3.14Å; A243-R245 VanDerWaalsContact O-N 3.07Å; R245-R249 VanDerWaalsContact O-CG 3.28Å; R245-R249 WeakPolarHBondContact O-CG 3.36Å; R245-R249 PolarHBondContact O-N 2.95Å; R245-R249 VanDerWaalsContact O-N 3.14Å
246	N	87.8	Confident	88.2	Confident	17 Å²	17	54 Å²	54	9%	0.091	26%	0.257	C	S	.	.	H	α-helix	trans	-77.4	-28.7	179.5	-62.4	-15.8	0	0	0	111.7	E210 F242 A243 L244 R249 G250	E210-N246 WeakPolarHBondContact CG-OD1 2.97Å; F242-N246 HydrophobicContact CD1-CB 4.32Å; F242-N246 HydrophobicContact CE1-CB 3.62Å; F242-N246 HydrophobicContact CE2-CB 4.15Å; F242-N246 HydrophobicContact CZ-CB 3.52Å; A243-N246 WeakPolarHBondContact O-CA 3.33Å; A243-N246 WeakPolarHBondContact O-CB 3.43Å; A243-N246 PolarHBondContact O-N 3.11Å; L244-N246 VanDerWaalsContact C-N 3.26Å; L244-N246 PolarHBondContact O-N 3.09Å; N246-R249 PolarHBondContact OD1-NH1 2.83Å; N246-G250 PolarHBondContact O-N 2.94Å
247	Y	91.8	Very high	88.2	Confident	55 Å²	55	50.3 Å²	50.3	22%	0.216	24%	0.24	C	C	.	.	H	α-helix	trans	-61.1	-53.2	171.1	169.3	-91.4	0	0	0	109.9	V231 L232 I235 F242 A243 L244 R249 G250 F251	V231-Y247 HydrophobicContact CG1-CD2 3.66Å; V231-Y247 HydrophobicContact CG1-CE2 3.81Å; L232-Y247 HydrophobicContact CD2-CE2 4.29Å; I235-Y247 HydrophobicContact CD1-CD2 3.73Å; F242-Y247 VanDerWaalsContact CE1-N 3.32Å; A243-Y247 PolarHBondContact O-N 3.23Å; L244-Y247 HydrophobicContact CD1-CD1 4.08Å; L244-Y247 HydrophobicContact CD1-CG 4.34Å; L244-Y247 WeakPolarHBondContact O-CB 3.16Å; L244-Y247 PolarHBondContact O-N 2.96Å; Y247-R249 VanDerWaalsContact C-N 3.35Å; Y247-R249 PolarHBondContact O-N 2.79Å; Y247-G250 PolarHBondContact O-N 3.08Å; Y247-F251 VanDerWaalsContact O-CB 3.3Å; Y247-F251 WeakPolarHBondContact O-CB 3.41Å; Y247-F251 PolarHBondContact O-N 3.31Å
248	W	92.1	Very high	88.2	Confident	139 Å²	139	51.2 Å²	51.2	53%	0.527	25%	0.248	S	C	.	.	H	α-helix	trans	-61	-39.8	178.4	-74.7	112	0	0	0	113.4	L244 F251 F252	L244-W248 VanDerWaalsContact O-CD1 3.3Å; L244-W248 PolarHBondContact O-N 2.86Å; L244-W248 VanDerWaalsContact O-N 3.16Å; W248-F251 HydrophobicContact CE3-CD1 4.27Å; W248-F251 HydrophobicContact CZ3-CD1 4.2Å; W248-F251 HydrophobicContact CZ3-CE1 4.5Å; W248-F252 WeakPolarHBondContact O-CB 3.48Å; W248-F252 PolarHBondContact O-N 3.46Å
249	R	90.9	Very high	88.5	Confident	24 Å²	24	56 Å²	56	9%	0.091	27%	0.273	C	S	.	.	H	α-helix	trans	-65	-44.5	174.9	-72.7	175.5	169.1	161.7	-12.8	112.6	D61 L65 E210 R245 N246 Y247 S253	D61-R249 IonicContact OD2-CZ 3.35Å; D61-R249 IonicContact OD2-NE 2.83Å; D61-R249 IonicContact OD2-NH2 2.69Å; D61-R249 PolarHBondContact OD2-NH2 3.41Å; L65-R249 HydrophobicContact CD1-CB 3.64Å; L65-R249 HydrophobicContact CD1-CG 3.62Å; L65-R249 HydrophobicContact CD2-CB 4.19Å; E210-R249 IonicContact OE1-NH1 2.72Å; E210-R249 PolarHBondContact OE1-NH1 3.15Å; E210-R249 IonicContact OE2-CZ 2.59Å; E210-R249 IonicContact OE2-NH1 3.4Å; E210-R249 PolarHBondContact OE2-NH1 2.89Å; E210-R249 IonicContact OE2-NH2 3.18Å; R245-R249 VanDerWaalsContact O-CG 3.28Å; R245-R249 WeakPolarHBondContact O-CG 3.36Å; R245-R249 PolarHBondContact O-N 2.95Å; R245-R249 VanDerWaalsContact O-N 3.14Å; N246-R249 PolarHBondContact OD1-NH1 2.83Å; Y247-R249 VanDerWaalsContact C-N 3.35Å; Y247-R249 PolarHBondContact O-N 2.79Å; R249-S253 WeakPolarHBondContact O-CB 3.4Å; R249-S253 PolarHBondContact O-N 3.28Å; R249-S253 VanDerWaalsContact O-N 3.11Å
250	G	91.7	Very high	89.2	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-63.6	-49	176.9	0	0	0	0	0	111.9	N246 Y247 S253 A254	N246-G250 PolarHBondContact O-N 2.94Å; Y247-G250 PolarHBondContact O-N 3.08Å; G250-S253 PolarHBondContact O-N 3.06Å; G250-A254 VanDerWaalsContact O-CB 3.23Å; G250-A254 WeakPolarHBondContact O-CB 3.41Å; G250-A254 PolarHBondContact O-N 2.59Å
251	F	94.2	Very high	89.8	Confident	54 Å²	54	53.4 Å²	53.4	24%	0.237	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-48	177.9	179.1	-107.8	0	0	0	112.8	I228 V231 Y247 W248 S253 A254 V255	I228-F251 HydrophobicContact CG1-CE2 3.86Å; V231-F251 HydrophobicContact CG2-CB 4.19Å; V231-F251 HydrophobicContact CG2-CD2 4.45Å; Y247-F251 VanDerWaalsContact O-CB 3.3Å; Y247-F251 WeakPolarHBondContact O-CB 3.41Å; Y247-F251 PolarHBondContact O-N 3.31Å; W248-F251 HydrophobicContact CE3-CD1 4.27Å; W248-F251 HydrophobicContact CZ3-CD1 4.2Å; W248-F251 HydrophobicContact CZ3-CE1 4.5Å; F251-S253 VanDerWaalsContact C-N 3.34Å; F251-S253 PolarHBondContact O-N 3.36Å; F251-A254 WeakPolarHBondContact O-CB 3.4Å; F251-A254 PolarHBondContact O-N 3.37Å; F251-V255 HydrophobicContact CD2-CG2 4.27Å; F251-V255 HydrophobicContact CE1-CG2 4.1Å; F251-V255 HydrophobicContact CE2-CG2 3.81Å; F251-V255 HydrophobicContact CZ-CG2 3.72Å; F251-V255 WeakPolarHBondContact O-CG2 3.49Å; F251-V255 PolarHBondContact O-N 3.03Å
252	F	93.8	Very high	90.1	Very high	64 Å²	64	49.2 Å²	49.2	28%	0.281	24%	0.238	S	C	.	.	H	α-helix	trans	-56.9	-47.6	175.2	-179.5	-97.6	0	0	0	111.7	W62 L65 I66 W248 A254 V255 F256	W62-F252 HydrophobicContact CB-CE1 4.34Å; W62-F252 AromaticContact CE3-CD1 3.62Å; W62-F252 HydrophobicContact CE3-CD1 3.62Å; W62-F252 HydrophobicContact CE3-CD2 4.37Å; W62-F252 AromaticContact CE3-CE1 3.71Å; W62-F252 HydrophobicContact CE3-CE1 3.71Å; W62-F252 HydrophobicContact CE3-CE2 4.45Å; W62-F252 AromaticContact CE3-CG 3.95Å; W62-F252 HydrophobicContact CE3-CG 3.95Å; W62-F252 HydrophobicContact CE3-CZ 4.13Å; W62-F252 HydrophobicContact CZ3-CB 4.04Å; W62-F252 AromaticContact CZ3-CD1 3.98Å; W62-F252 HydrophobicContact CZ3-CD1 3.98Å; W62-F252 HydrophobicContact CZ3-CD2 4.27Å; W62-F252 HydrophobicContact CZ3-CE1 4.45Å; W62-F252 AromaticContact CZ3-CG 3.86Å; W62-F252 HydrophobicContact CZ3-CG 3.86Å; L65-F252 HydrophobicContact CB-CD1 4.21Å; I66-F252 HydrophobicContact CD1-CE1 4.17Å; I66-F252 HydrophobicContact CD1-CZ 4.17Å; I66-F252 HydrophobicContact CG1-CE1 3.81Å; I66-F252 HydrophobicContact CG1-CZ 4.24Å; W248-F252 WeakPolarHBondContact O-CB 3.48Å; W248-F252 PolarHBondContact O-N 3.46Å; F252-A254 VanDerWaalsContact C-N 3.34Å; F252-A254 PolarHBondContact O-N 3.02Å; F252-V255 PolarHBondContact O-N 2.98Å; F252-F256 HydrophobicContact CD1-CD2 4.32Å; F252-F256 HydrophobicContact CD2-CE2 4.32Å; F252-F256 HydrophobicContact CE1-CD2 4.11Å; F252-F256 AromaticContact CE1-CE2 3.97Å; F252-F256 HydrophobicContact CE1-CE2 3.97Å; F252-F256 HydrophobicContact CE2-CD2 4.37Å; F252-F256 AromaticContact CE2-CE2 3.73Å; F252-F256 HydrophobicContact CE2-CE2 3.73Å; F252-F256 HydrophobicContact CZ-CD2 4.14Å; F252-F256 AromaticContact CZ-CE2 3.54Å; F252-F256 HydrophobicContact CZ-CE2 3.54Å; F252-F256 HydrophobicContact CZ-CZ 4.47Å; F252-F256 WeakPolarHBondContact O-CD2 3.34Å; F252-F256 PolarHBondContact O-N 2.97Å
253	S	94	Very high	90.3	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-34.7	178	-161.7	0	0	0	0	112.8	L65 G69 V218 R249 G250 F251 S257	L65-S253 PolarHBondContact O-OG 3.18Å; G69-S253 PolarHBondContact N-OG 3.26Å; V218-S253 WeakPolarHBondContact CG2-OG 3.44Å; R249-S253 WeakPolarHBondContact O-CB 3.4Å; R249-S253 PolarHBondContact O-N 3.28Å; R249-S253 VanDerWaalsContact O-N 3.11Å; G250-S253 PolarHBondContact O-N 3.06Å; F251-S253 VanDerWaalsContact C-N 3.34Å; F251-S253 PolarHBondContact O-N 3.36Å; S253-S257 WeakPolarHBondContact O-CB 3.31Å; S253-S257 PolarHBondContact O-N 2.99Å
254	A	93.9	Very high	90.5	Very high	0 Å²	0	51.1 Å²	51.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-68.6	-42.6	177.2	0	0	0	0	0	112.2	A221 P227 V231 G250 F251 F252 S257 A258	A221-A254 HydrophobicContact CB-CB 3.51Å; P227-A254 HydrophobicContact CB-CB 4.19Å; V231-A254 HydrophobicContact CG2-CB 3.9Å; G250-A254 VanDerWaalsContact O-CB 3.23Å; G250-A254 WeakPolarHBondContact O-CB 3.41Å; G250-A254 PolarHBondContact O-N 2.59Å; F251-A254 WeakPolarHBondContact O-CB 3.4Å; F251-A254 PolarHBondContact O-N 3.37Å; F252-A254 VanDerWaalsContact C-N 3.34Å; F252-A254 PolarHBondContact O-N 3.02Å; A254-S257 WeakPolarHBondContact O-CB 3.43Å; A254-S257 PolarHBondContact O-N 3.26Å; A254-S257 VanDerWaalsContact O-N 3.15Å; A254-A258 PolarHBondContact O-N 3Å
255	V	93.8	Very high	90.2	Very high	45 Å²	45	47.5 Å²	47.5	27%	0.273	22%	0.221	S	C	.	.	H	α-helix	trans	-62	-45.2	175	170.3	0	0	0	0	110.9	P227 F251 F252 S257 A258 I259	P227-V255 HydrophobicContact CB-CG2 4.01Å; P227-V255 HydrophobicContact CG-CG2 4.47Å; F251-V255 HydrophobicContact CD2-CG2 4.27Å; F251-V255 HydrophobicContact CE1-CG2 4.1Å; F251-V255 HydrophobicContact CE2-CG2 3.81Å; F251-V255 HydrophobicContact CZ-CG2 3.72Å; F251-V255 WeakPolarHBondContact O-CG2 3.49Å; F251-V255 PolarHBondContact O-N 3.03Å; F252-V255 PolarHBondContact O-N 2.98Å; V255-S257 VanDerWaalsContact C-N 3.3Å; V255-S257 PolarHBondContact O-N 2.97Å; V255-A258 PolarHBondContact O-N 3.08Å; V255-I259 HydrophobicContact CG1-CD1 3.74Å; V255-I259 HydrophobicContact CG1-CG1 4.44Å; V255-I259 VanDerWaalsContact O-CG1 3.32Å; V255-I259 WeakPolarHBondContact O-CG1 3.29Å; V255-I259 PolarHBondContact O-N 3.33Å
256	F	92.7	Very high	89.9	Confident	69 Å²	69	45 Å²	45	30%	0.303	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-37.8	172.7	-89	-81	0	0	0	112.6	I66 F252 V260	I66-F256 HydrophobicContact CD1-CE1 4.42Å; I66-F256 HydrophobicContact CD1-CE2 4.23Å; I66-F256 HydrophobicContact CD1-CZ 4.07Å; I66-F256 HydrophobicContact CG1-CD1 4.3Å; I66-F256 HydrophobicContact CG1-CD2 3.99Å; I66-F256 HydrophobicContact CG1-CE1 4.27Å; I66-F256 HydrophobicContact CG1-CE2 3.97Å; I66-F256 HydrophobicContact CG1-CG 4.17Å; I66-F256 HydrophobicContact CG1-CZ 4.11Å; I66-F256 HydrophobicContact CG2-CD1 4.32Å; F252-F256 HydrophobicContact CD1-CD2 4.32Å; F252-F256 HydrophobicContact CD2-CE2 4.32Å; F252-F256 HydrophobicContact CE1-CD2 4.11Å; F252-F256 AromaticContact CE1-CE2 3.97Å; F252-F256 HydrophobicContact CE1-CE2 3.97Å; F252-F256 HydrophobicContact CE2-CD2 4.37Å; F252-F256 AromaticContact CE2-CE2 3.73Å; F252-F256 HydrophobicContact CE2-CE2 3.73Å; F252-F256 HydrophobicContact CZ-CD2 4.14Å; F252-F256 AromaticContact CZ-CE2 3.54Å; F252-F256 HydrophobicContact CZ-CE2 3.54Å; F252-F256 HydrophobicContact CZ-CZ 4.47Å; F252-F256 WeakPolarHBondContact O-CD2 3.34Å; F252-F256 PolarHBondContact O-N 2.97Å; F256-V260 WeakPolarHBondContact O-CB 3.49Å; F256-V260 VanDerWaalsContact O-CG2 3.22Å; F256-V260 WeakPolarHBondContact O-CG2 3.22Å; F256-V260 PolarHBondContact O-N 3.41Å
257	S	92.7	Very high	89.6	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.7	-45.2	174.6	-158.9	0	0	0	0	112	G69 A73 C222 S253 A254 V255 Y261	G69-S257 PolarHBondContact O-OG 3.03Å; A73-S257 WeakPolarHBondContact CB-O 3.06Å; C222-S257 WeakPolarHBondContact CB-OG 3.45Å; C222-S257 PolarHBondContact SG-OG 3.22Å; C222-S257 VanDerWaalsContact SG-OG 3.38Å; S253-S257 WeakPolarHBondContact O-CB 3.31Å; S253-S257 PolarHBondContact O-N 2.99Å; A254-S257 WeakPolarHBondContact O-CB 3.43Å; A254-S257 PolarHBondContact O-N 3.26Å; A254-S257 VanDerWaalsContact O-N 3.15Å; V255-S257 VanDerWaalsContact C-N 3.3Å; V255-S257 PolarHBondContact O-N 2.97Å; S257-Y261 VanDerWaalsContact O-CB 3.22Å; S257-Y261 WeakPolarHBondContact O-CB 3.4Å; S257-Y261 PolarHBondContact O-N 2.87Å
258	A	88.9	Confident	88.9	Confident	25 Å²	25	51.5 Å²	51.5	21%	0.207	26%	0.255	C	S	.	.	H	α-helix	trans	-66.1	-43.1	179.4	0	0	0	0	0	112.3	A254 V255 Y261 G262	A254-A258 PolarHBondContact O-N 3Å; V255-A258 PolarHBondContact O-N 3.08Å; A258-Y261 PolarHBondContact O-N 3.48Å; A258-G262 PolarHBondContact O-N 3.49Å
259	I	90.3	Very high	87.8	Confident	104 Å²	104	49.7 Å²	49.7	53%	0.533	25%	0.252	S	S	.	.	H	α-helix	trans	-62.1	-48.3	176.6	-68.3	167.1	0	0	0	110.9	V255 Y261 G262 F263	V255-I259 HydrophobicContact CG1-CD1 3.74Å; V255-I259 HydrophobicContact CG1-CG1 4.44Å; V255-I259 VanDerWaalsContact O-CG1 3.32Å; V255-I259 WeakPolarHBondContact O-CG1 3.29Å; V255-I259 PolarHBondContact O-N 3.33Å; I259-Y261 VanDerWaalsContact C-N 3.32Å; I259-Y261 PolarHBondContact O-N 2.84Å; I259-G262 PolarHBondContact O-N 3.47Å; I259-F263 VanDerWaalsContact O-CB 3.3Å; I259-F263 WeakPolarHBondContact O-CB 3.45Å; I259-F263 PolarHBondContact O-N 2.81Å
260	V	91	Very high	85.9	Confident	29 Å²	29	54.7 Å²	54.7	18%	0.176	29%	0.291	C	S	.	.	H	α-helix	trans	-64.1	-39.6	178.5	172.5	0	0	0	0	110.9	V70 A73 F256 L264	V70-V260 HydrophobicContact CG2-CG2 3.96Å; A73-V260 HydrophobicContact CB-CB 3.84Å; A73-V260 HydrophobicContact CB-CG1 3.64Å; F256-V260 WeakPolarHBondContact O-CB 3.49Å; F256-V260 VanDerWaalsContact O-CG2 3.22Å; F256-V260 WeakPolarHBondContact O-CG2 3.22Å; F256-V260 PolarHBondContact O-N 3.41Å; V260-L264 HydrophobicContact CG1-CD1 3.9Å; V260-L264 HydrophobicContact CG1-CG 4.41Å; V260-L264 WeakPolarHBondContact O-CB 3.13Å; V260-L264 VanDerWaalsContact O-CG 3.22Å; V260-L264 WeakPolarHBondContact O-CG 3.26Å; V260-L264 PolarHBondContact O-N 2.88Å
261	Y	87.9	Confident	83.8	Confident	14 Å²	14	63 Å²	63	6%	0.055	32%	0.322	C	S	.	.	H	α-helix	trans	-64.1	-49.5	177.3	-165.1	-76.6	0	0	0	111.6	F77 D80 S257 A258 I259 F263 L264 V265 Y277	F77-Y261 HydrophobicContact CB-CD2 4.16Å; F77-Y261 HydrophobicContact CB-CE2 3.8Å; F77-Y261 HydrophobicContact CD2-CE1 4.38Å; F77-Y261 HydrophobicContact CD2-CE2 4.24Å; F77-Y261 AromaticContact CD2-CZ 3.98Å; D80-Y261 PolarHBondContact OD2-OH 2.86Å; S257-Y261 VanDerWaalsContact O-CB 3.22Å; S257-Y261 WeakPolarHBondContact O-CB 3.4Å; S257-Y261 PolarHBondContact O-N 2.87Å; A258-Y261 PolarHBondContact O-N 3.48Å; I259-Y261 VanDerWaalsContact C-N 3.32Å; I259-Y261 PolarHBondContact O-N 2.84Å; Y261-F263 VanDerWaalsContact C-N 3.34Å; Y261-F263 PolarHBondContact O-N 3.43Å; Y261-L264 PolarHBondContact O-N 2.85Å; Y261-V265 HydrophobicContact CD1-CG2 3.84Å; Y261-V265 HydrophobicContact CE1-CG2 3.45Å; Y261-V265 VanDerWaalsContact CE1-CG2 3.45Å; Y261-V265 WeakPolarHBondContact O-CG2 3.36Å; Y261-V265 PolarHBondContact O-N 2.95Å; Y261-Y277 HydrophobicContact CE1-CD2 4.17Å; Y261-Y277 AromaticContact CE1-CE2 3.54Å; Y261-Y277 HydrophobicContact CE1-CE2 3.54Å; Y261-Y277 AromaticContact CE1-CZ 3.97Å; Y261-Y277 AromaticContact CZ-CZ 4Å; Y261-Y277 PolarHBondContact OH-OH 3.12Å
262	G	83.5	Confident	81.4	Confident	12 Å²	12	69.9 Å²	69.9	12%	0.124	35%	0.354	C	S	.	.	H	α-helix	trans	-61	-40	177	0	0	0	0	0	113.2	A258 I259 V265 M266	A258-G262 PolarHBondContact O-N 3.49Å; I259-G262 PolarHBondContact O-N 3.47Å; G262-V265 PolarHBondContact O-N 3.07Å; G262-M266 WeakPolarHBondContact O-CB 3.46Å; G262-M266 PolarHBondContact O-N 3.34Å
263	F	87.5	Confident	79	Confident	113 Å²	113	72.1 Å²	72.1	50%	0.496	37%	0.374	S	S	.	.	H	α-helix	trans	-64	-41	174.5	-179.1	-107.7	0	0	0	112.5	I259 Y261 M266 L267	I259-F263 VanDerWaalsContact O-CB 3.3Å; I259-F263 WeakPolarHBondContact O-CB 3.45Å; I259-F263 PolarHBondContact O-N 2.81Å; Y261-F263 VanDerWaalsContact C-N 3.34Å; Y261-F263 PolarHBondContact O-N 3.43Å; F263-M266 HydrophobicContact CD2-CE 3.75Å; F263-M266 HydrophobicContact CE2-CE 3.9Å; F263-M266 PolarHBondContact O-N 2.97Å; F263-L267 HydrophobicContact CD1-CD1 3.91Å; F263-L267 HydrophobicContact CE1-CD1 3.46Å; F263-L267 VanDerWaalsContact CE1-CD1 3.46Å; F263-L267 HydrophobicContact CE1-CG 4.25Å; F263-L267 HydrophobicContact CZ-CD1 3.83Å; F263-L267 HydrophobicContact CZ-CD2 4.44Å; F263-L267 HydrophobicContact CZ-CG 4.23Å; F263-L267 WeakPolarHBondContact O-CG 3.36Å; F263-L267 PolarHBondContact O-N 3.4Å
264	L	86.7	Confident	76.4	Confident	36 Å²	36	77.8 Å²	77.8	19%	0.188	41%	0.408	C	S	.	.	H	α-helix	trans	-64.9	-40.9	174.4	-75.5	169.4	0	0	0	112.2	V74 F77 V260 Y261 L267 L268	V74-L264 HydrophobicContact CG2-CD1 3.97Å; F77-L264 HydrophobicContact CB-CD1 4.08Å; F77-L264 HydrophobicContact CD1-CB 3.73Å; F77-L264 HydrophobicContact CD1-CD1 3.98Å; F77-L264 HydrophobicContact CD1-CD2 4.27Å; F77-L264 HydrophobicContact CD1-CG 4.21Å; F77-L264 HydrophobicContact CD2-CB 4Å; F77-L264 HydrophobicContact CE1-CB 3.69Å; F77-L264 HydrophobicContact CE1-CD2 4.26Å; F77-L264 HydrophobicContact CE1-CG 4.42Å; F77-L264 HydrophobicContact CE2-CB 3.99Å; F77-L264 HydrophobicContact CG-CB 3.86Å; F77-L264 HydrophobicContact CG-CD1 4.1Å; F77-L264 HydrophobicContact CZ-CB 3.83Å; F77-L264 WeakPolarHBondContact CZ-O 3.38Å; V260-L264 HydrophobicContact CG1-CD1 3.9Å; V260-L264 HydrophobicContact CG1-CG 4.41Å; V260-L264 WeakPolarHBondContact O-CB 3.13Å; V260-L264 VanDerWaalsContact O-CG 3.22Å; V260-L264 WeakPolarHBondContact O-CG 3.26Å; V260-L264 PolarHBondContact O-N 2.88Å; Y261-L264 PolarHBondContact O-N 2.85Å; L264-L267 PolarHBondContact O-N 3.3Å; L264-L268 PolarHBondContact O-N 3.14Å
265	V	81.5	Confident	73.7	Confident	46 Å²	46	81.3 Å²	81.3	28%	0.279	43%	0.433	S	S	.	.	H	α-helix	trans	-58.7	-50.6	173.5	171.5	0	0	0	0	110.7	F77 Y261 G262 L267 L268 H269	F77-V265 HydrophobicContact CD2-CG2 4.13Å; F77-V265 HydrophobicContact CE2-CB 4.39Å; F77-V265 HydrophobicContact CE2-CG2 3.78Å; Y261-V265 HydrophobicContact CD1-CG2 3.84Å; Y261-V265 HydrophobicContact CE1-CG2 3.45Å; Y261-V265 VanDerWaalsContact CE1-CG2 3.45Å; Y261-V265 WeakPolarHBondContact O-CG2 3.36Å; Y261-V265 PolarHBondContact O-N 2.95Å; G262-V265 PolarHBondContact O-N 3.07Å; V265-L267 VanDerWaalsContact C-N 3.25Å; V265-L267 PolarHBondContact O-N 3.31Å; V265-L268 PolarHBondContact O-N 2.94Å; V265-H269 PolarHBondContact O-N 2.86Å
266	M	80.5	Confident	71	Confident	97 Å²	97	81.7 Å²	81.7	48%	0.478	44%	0.441	S	S	.	.	H	α-helix	trans	-60.1	-30.8	178.6	-172.9	-170.3	80.3	0	0	113.3	G262 F263	G262-M266 WeakPolarHBondContact O-CB 3.46Å; G262-M266 PolarHBondContact O-N 3.34Å; F263-M266 HydrophobicContact CD2-CE 3.75Å; F263-M266 HydrophobicContact CE2-CE 3.9Å; F263-M266 PolarHBondContact O-N 2.97Å
267	L	82.5	Confident	69	Low	105 Å²	105	81.3 Å²	81.3	55%	0.55	44%	0.438	S	S	.	.	H	α-helix	trans	-74.7	-25.9	177.7	-79.7	176.2	0	0	0	114.5	F263 L264 V265	F263-L267 HydrophobicContact CD1-CD1 3.91Å; F263-L267 HydrophobicContact CE1-CD1 3.46Å; F263-L267 VanDerWaalsContact CE1-CD1 3.46Å; F263-L267 HydrophobicContact CE1-CG 4.25Å; F263-L267 HydrophobicContact CZ-CD1 3.83Å; F263-L267 HydrophobicContact CZ-CD2 4.44Å; F263-L267 HydrophobicContact CZ-CG 4.23Å; F263-L267 WeakPolarHBondContact O-CG 3.36Å; F263-L267 PolarHBondContact O-N 3.4Å; L264-L267 PolarHBondContact O-N 3.3Å; V265-L267 VanDerWaalsContact C-N 3.25Å; V265-L267 PolarHBondContact O-N 3.31Å
268	L	77.2	Confident	66.2	Low	105 Å²	105	83.2 Å²	83.2	55%	0.55	45%	0.451	S	S	.	.	H	α-helix	trans	-110.5	-28.5	-178.9	-66.5	-168.5	0	0	0	114.4	F77 L81 L264 V265	F77-L268 HydrophobicContact CE1-CD1 3.62Å; F77-L268 HydrophobicContact CE1-CG 4.2Å; F77-L268 HydrophobicContact CZ-CB 4.2Å; F77-L268 HydrophobicContact CZ-CD1 3.64Å; F77-L268 HydrophobicContact CZ-CG 3.99Å; L81-L268 HydrophobicContact CD1-CD1 3.58Å; L81-L268 HydrophobicContact CD2-CD1 3.93Å; L81-L268 HydrophobicContact CG-CD1 4.4Å; L264-L268 PolarHBondContact O-N 3.14Å; V265-L268 PolarHBondContact O-N 2.94Å
269	H	67.8	Low	63.3	Low	100 Å²	100	83.1 Å²	83.1	46%	0.463	45%	0.448	S	S	.	.	S	Bend	trans	-108.8	114.8	172.1	-66.7	81.6	0	0	0	108	V265 R271	V265-H269 PolarHBondContact O-N 2.86Å; H269-R271 PolarHBondContact O-N 3.28Å
270	S	52.6	Low	60.8	Low	129 Å²	129	78.7 Å²	78.7	90%	0.902	43%	0.426	S	S	*	.			trans	-71.9	59.6	177.4	-48.7	0	0	0	0	112
271	R	46.7	Very low	58.4	Low	177 Å²	177	77.3 Å²	77.3	67%	0.668	42%	0.418	S	S	*	.			trans	-106.5	132.9	169.5	-72.5	-170.2	172.3	-162	-1.1	108.4	H269 T273	H269-R271 PolarHBondContact O-N 3.28Å; R271-T273 VanDerWaalsContact C-N 3.28Å; R271-T273 PolarHBondContact O-N 3.33Å
272	E	44.6	Very low	56.2	Low	197 Å²	197	77.5 Å²	77.5	92%	0.921	42%	0.419	S	S	*	.	S	Bend	trans	-80.2	-2.6	-164.5	-57.6	-174.3	134.4	0	0	114.7
273	T	42.4	Very low	54.2	Low	112 Å²	112	77 Å²	77	69%	0.687	41%	0.413	S	S	*	.	S	Bend	trans	-138.6	148.1	-177.4	53.4	0	0	0	0	112.7	R271 S275	R271-T273 VanDerWaalsContact C-N 3.28Å; R271-T273 PolarHBondContact O-N 3.33Å; T273-S275 VanDerWaalsContact C-N 3.29Å; T273-S275 PolarHBondContact O-N 3.17Å
274	V	40.4	Very low	52	Low	118 Å²	118	72.4 Å²	72.4	72%	0.715	39%	0.393	S	S	*	.			trans	-78.5	79.6	172.8	-176.5	0	0	0	0	108.8
275	S	37.2	Very low	50	Low	74 Å²	74	74.8 Å²	74.8	52%	0.517	41%	0.406	S	S	.	.			trans	-74.8	145.5	175.2	59.4	0	0	0	0	112	T273	T273-S275 VanDerWaalsContact C-N 3.29Å; T273-S275 PolarHBondContact O-N 3.17Å
276	A	37.4	Very low	48.4	Very low	54 Å²	54	77 Å²	77	45%	0.446	42%	0.419	S	S	.	.			trans	-59	157.9	176.9	0	0	0	0	0	113.1	C278	A276-C278 PolarHBondContact O-N 3.48Å; A276-C278 VanDerWaalsContact O-N 3.09Å
277	Y	49.6	Very low	46.5	Very low	60 Å²	60	76.3 Å²	76.3	24%	0.235	42%	0.422	C	S	.	.			trans	-88	85.8	-160.9	-149.6	-108.7	0	0	0	113.8	D80 T223 F224 Y261 L449	D80-Y277 PolarHBondContact OD2-OH 3.2Å; T223-Y277 WeakPolarHBondContact O-CD1 3.22Å; F224-Y277 WeakPolarHBondContact O-CB 3.36Å; Y261-Y277 HydrophobicContact CE1-CD2 4.17Å; Y261-Y277 AromaticContact CE1-CE2 3.54Å; Y261-Y277 HydrophobicContact CE1-CE2 3.54Å; Y261-Y277 AromaticContact CE1-CZ 3.97Å; Y261-Y277 AromaticContact CZ-CZ 4Å; Y261-Y277 PolarHBondContact OH-OH 3.12Å; Y277-L449 WeakPolarHBondContact O-CD2 3.42Å
278	C	33.4	Very low	44.5	Very low	41 Å²	41	78.7 Å²	78.7	28%	0.277	44%	0.435	S	S	.	.			trans	27	101.4	163.9	-68.1	0	0	0	0	117.7	A276 N332 E336	A276-C278 PolarHBondContact O-N 3.48Å; A276-C278 VanDerWaalsContact O-N 3.09Å; C278-N332 HydrophobicContact CB-CB 3.62Å; C278-N332 VanDerWaalsContact CB-ND2 3.34Å; C278-N332 WeakPolarHBondContact CB-ND2 3.45Å; C278-E336 PolarHBondContact SG-OE1 2.91Å
279	P	29.2	Very low	42.8	Very low	23 Å²	23	83 Å²	83	15%	0.149	45%	0.449	C	S	.	.			trans	-74.8	153	-177.1	34.5	-38.9	0	0	0	113	N332 L335 E336 F339	P279-N332 CarbonylContact O-C 3.14Å; P279-L335 HydrophobicContact CB-CB 3.52Å; P279-L335 HydrophobicContact CB-CD2 3.91Å; P279-L335 HydrophobicContact CB-CG 4.28Å; P279-L335 HydrophobicContact CG-CB 3.87Å; P279-L335 WeakPolarHBondContact O-CB 3.33Å; P279-L335 PolarHBondContact O-N 2.79Å; P279-L335 VanDerWaalsContact O-N 3.07Å; P279-E336 HydrophobicContact CG-CG 4.05Å; P279-E336 PolarHBondContact O-N 3.17Å; P279-F339 HydrophobicContact CB-CD2 3.85Å; P279-F339 HydrophobicContact CB-CE2 3.83Å; P279-F339 HydrophobicContact CG-CD2 3.97Å; P279-F339 HydrophobicContact CG-CE2 4.44Å
280	T	36.7	Very low	41.4	Very low	11 Å²	11	83 Å²	83	7%	0.067	47%	0.466	C	S	.	.			trans	-120.8	130.7	-168.4	64.7	0	0	0	0	123.2	S331 L335 T389 L393	T280-S331 WeakPolarHBondContact CA-O 3.45Å; T280-S331 WeakPolarHBondContact CB-O 3.47Å; T280-L335 WeakPolarHBondContact O-CD1 3.36Å; T280-L335 WeakPolarHBondContact O-CD2 3.33Å; T280-T389 HydrophobicContact CG2-CG2 4.06Å; T280-L393 WeakPolarHBondContact O-CD2 3.11Å; T280-L393 WeakPolarHBondContact OG1-CD2 3.36Å
281	A	42	Very low	41.3	Very low	0 Å²	0	86.8 Å²	86.8	0%	0	47%	0.466	C	S	.	.			trans	30.4	-160.9	157.7	0	0	0	0	0	125.3	S331 L334 L335 L338 L393	A281-S331 PolarHBondContact N-O 3.23Å; A281-L334 HydrophobicContact CB-CB 3.27Å; A281-L334 HydrophobicContact CB-CD1 3.65Å; A281-L334 HydrophobicContact CB-CG 4.09Å; A281-L335 WeakPolarHBondContact O-CD1 3.43Å; A281-L338 WeakPolarHBondContact O-CD1 3.33Å; A281-L393 VanDerWaalsContact C-CA 3.47Å; A281-L393 VanDerWaalsContact C-CB 3.45Å; A281-L393 CarbonylContact C-O 3.48Å; A281-L393 HydrophobicContact CB-CB 4.26Å; A281-L393 HydrophobicContact CB-CD1 3.97Å; A281-L393 HydrophobicContact CB-CD2 3.72Å; A281-L393 HydrophobicContact CB-CG 4.09Å; A281-L393 CarbonylContact O-C 3.08Å; A281-L393 WeakPolarHBondContact O-CA 3.26Å
282	F	40.6	Very low	41.5	Very low	18 Å²	18	84.5 Å²	84.5	8%	0.079	46%	0.463	C	S	.	.			cis	174.3	144.4	-7.9	-106.9	-25.1	0	0	0	107.1	T325 H326 L334 F367 L371 L393	F282-T325 WeakPolarHBondContact CE1-O 3.34Å; F282-T325 WeakPolarHBondContact CZ-O 3.45Å; F282-H326 HydrophobicContact CE1-CB 4.23Å; F282-L334 HydrophobicContact CD1-CD1 3.91Å; F282-L334 HydrophobicContact CD2-CD1 4.43Å; F282-L334 HydrophobicContact CE1-CD1 3.37Å; F282-L334 HydrophobicContact CE1-CD2 4.25Å; F282-L334 HydrophobicContact CE1-CG 4.43Å; F282-L334 HydrophobicContact CE2-CD1 3.97Å; F282-L334 HydrophobicContact CG-CD1 4.4Å; F282-L334 HydrophobicContact CZ-CD1 3.41Å; F282-L334 VanDerWaalsContact CZ-CD1 3.41Å; F282-F367 VanDerWaalsContact CA-CZ 3.41Å; F282-F367 HydrophobicContact CB-CZ 4.38Å; F282-F367 AromaticContact CD1-CE2 3.65Å; F282-F367 HydrophobicContact CD1-CE2 3.65Å; F282-F367 AromaticContact CD1-CZ 3.64Å; F282-F367 HydrophobicContact CD1-CZ 3.64Å; F282-F367 HydrophobicContact CE1-CE2 4.36Å; F282-F367 HydrophobicContact CG-CZ 4.47Å; F282-L371 HydrophobicContact CB-CD1 3.77Å; F282-L371 HydrophobicContact CB-CD2 3.94Å; F282-L371 HydrophobicContact CB-CG 4.42Å; F282-L371 HydrophobicContact CD2-CD1 3.55Å; F282-L371 HydrophobicContact CE2-CD1 4.25Å; F282-L371 HydrophobicContact CG-CD1 3.75Å; F282-L393 HydrophobicContact CB-CB 3.89Å; F282-L393 HydrophobicContact CB-CD1 3.76Å; F282-L393 HydrophobicContact CB-CG 4.31Å; F282-L393 HydrophobicContact CD2-CD1 3.82Å; F282-L393 HydrophobicContact CG-CD1 4.26Å; F282-L393 VanDerWaalsContact N-CB 3.32Å; F282-L393 PolarHBondContact N-O 3.34Å; F282-L393 CarbonylContact O-C 3.5Å; F282-L393 WeakPolarHBondContact O-CB 3.35Å
283	S	42.7	Very low	41.9	Very low	0 Å²	0	82.2 Å²	82.2	0%	0	46%	0.456	C	S	.	.			trans	-156.4	-140.9	164.1	-101	0	0	0	0	126.6	F367 L371 A394	S283-F367 VanDerWaalsContact C-CA 3.44Å; S283-F367 CarbonylContact C-O 3.4Å; S283-F367 WeakPolarHBondContact CA-O 3.42Å; S283-F367 WeakPolarHBondContact CB-O 3.44Å; S283-L371 WeakPolarHBondContact O-CB 3.31Å; S283-L371 PolarHBondContact O-N 3.43Å; S283-A394 VanDerWaalsContact OG-CA 3.26Å; S283-A394 WeakPolarHBondContact OG-CA 3.15Å; S283-A394 WeakPolarHBondContact OG-CB 3.28Å
284	F	41.2	Very low	42.5	Very low	18 Å²	18	84.1 Å²	84.1	8%	0.079	46%	0.461	C	S	.	.			trans	-118.9	0	-133.4	82	110.7	0	0	0	118.9	S366 F367 Y368 S369 T370 F372 A394	F284-S366 CarbonylContact O-C 3.52Å; F284-S366 WeakPolarHBondContact O-CA 3.45Å; F284-F367 VanDerWaalsContact N-CA 3.34Å; F284-F367 PolarHBondContact N-O 2.7Å; F284-F367 PolarHBondContact O-N 3.45Å; F284-Y368 WeakPolarHBondContact CD1-O 3.29Å; F284-Y368 AromaticContact CD2-CD2 3.68Å; F284-Y368 HydrophobicContact CD2-CD2 3.68Å; F284-Y368 AromaticContact CD2-CE2 3.68Å; F284-Y368 HydrophobicContact CD2-CE2 3.68Å; F284-Y368 HydrophobicContact CD2-CG 4.14Å; F284-Y368 WeakPolarHBondContact CD2-O 3.38Å; F284-Y368 HydrophobicContact CE2-CD1 4.43Å; F284-Y368 AromaticContact CE2-CD2 3.59Å; F284-Y368 HydrophobicContact CE2-CD2 3.59Å; F284-Y368 AromaticContact CE2-CE1 3.98Å; F284-Y368 HydrophobicContact CE2-CE1 3.98Å; F284-Y368 AromaticContact CE2-CE2 3.06Å; F284-Y368 HydrophobicContact CE2-CE2 3.06Å; F284-Y368 HydrophobicContact CE2-CG 4.2Å; F284-Y368 AromaticContact CE2-CZ 3.23Å; F284-Y368 WeakPolarHBondContact CE2-O 3.36Å; F284-Y368 WeakPolarHBondContact CE2-OH 3.32Å; F284-Y368 WeakPolarHBondContact CG-O 3.34Å; F284-Y368 HydrophobicContact CZ-CE1 4.09Å; F284-Y368 AromaticContact CZ-CE2 3.89Å; F284-Y368 HydrophobicContact CZ-CE2 3.89Å; F284-Y368 AromaticContact CZ-CZ 3.54Å; F284-Y368 WeakPolarHBondContact CZ-OH 3.24Å; F284-Y368 VanDerWaalsContact N-CA 3.34Å; F284-Y368 PolarHBondContact O-N 2.81Å; F284-S369 WeakPolarHBondContact CD1-O 3.26Å; F284-S369 WeakPolarHBondContact O-CA 3.29Å; F284-S369 PolarHBondContact O-N 3.06Å; F284-T370 VanDerWaalsContact CA-CB 3.48Å; F284-F372 HydrophobicContact CB-CB 3.84Å; F284-F372 HydrophobicContact CD1-CB 3.05Å; F284-F372 AromaticContact CD1-CD1 3.6Å; F284-F372 HydrophobicContact CD1-CD1 3.6Å; F284-F372 HydrophobicContact CD1-CD2 4.43Å; F284-F372 AromaticContact CD1-CG 3.52Å; F284-F372 HydrophobicContact CD1-CG 3.52Å; F284-F372 HydrophobicContact CD2-CB 3.6Å; F284-F372 HydrophobicContact CD2-CG 4.45Å; F284-F372 HydrophobicContact CE1-CB 3.32Å; F284-F372 AromaticContact CE1-CD1 3.29Å; F284-F372 HydrophobicContact CE1-CD1 3.29Å; F284-F372 AromaticContact CE1-CD2 3.8Å; F284-F372 HydrophobicContact CE1-CD2 3.8Å; F284-F372 AromaticContact CE1-CE1 3.9Å; F284-F372 HydrophobicContact CE1-CE1 3.9Å; F284-F372 HydrophobicContact CE1-CE2 4.34Å; F284-F372 AromaticContact CE1-CG 3.23Å; F284-F372 HydrophobicContact CE1-CG 3.23Å; F284-F372 HydrophobicContact CE1-CZ 4.37Å; F284-F372 HydrophobicContact CE2-CB 3.67Å; F284-F372 HydrophobicContact CE2-CD2 4.18Å; F284-F372 HydrophobicContact CE2-CG 4.08Å; F284-F372 HydrophobicContact CG-CB 3.35Å; F284-F372 HydrophobicContact CG-CG 4.26Å; F284-F372 HydrophobicContact CZ-CB 3.62Å; F284-F372 HydrophobicContact CZ-CD1 4.03Å; F284-F372 AromaticContact CZ-CD2 3.64Å; F284-F372 HydrophobicContact CZ-CD2 3.64Å; F284-F372 HydrophobicContact CZ-CE2 4.19Å; F284-F372 AromaticContact CZ-CG 3.54Å; F284-F372 HydrophobicContact CZ-CG 3.54Å; F284-A394 HydrophobicContact CE2-CB 4.14Å
285	D	44.4	Very low	42.8	Very low	86 Å²	86	87 Å²	87	46%	0.46	46%	0.464	S	S	.	.	B	Isolated β-bridge		0	148.6	0	-153.9	38.6	0	0	0	128.5	S369 T370	D285-S369 VanDerWaalsContact CA-CB 3.46Å; D285-S369 WeakPolarHBondContact CA-O 3.15Å; D285-S369 WeakPolarHBondContact CA-OG 3.44Å; D285-S369 VanDerWaalsContact CB-OG 3.22Å; D285-S369 WeakPolarHBondContact CB-OG 3.27Å; D285-S369 PolarHBondContact N-OG 3.19Å; D285-S369 WeakPolarHBondContact OD1-CB 3.43Å; D285-T370 VanDerWaalsContact C-CA 3.5Å; D285-T370 VanDerWaalsContact C-OG1 3.26Å; D285-T370 VanDerWaalsContact CA-CA 3.45Å; D285-T370 VanDerWaalsContact CA-CB 3.42Å; D285-T370 WeakPolarHBondContact O-CB 3.5Å; D285-T370 PolarHBondContact O-OG1 3.27Å
286	T	47.4	Very low	43.4	Very low	92 Å²	92	89.1 Å²	89.1	56%	0.564	46%	0.461	S	S	*	.			cis	-165.1	0	29.5	-12.3	0	0	0	0	115.6	F373	T286-F373 VanDerWaalsContact C-CE2 3.41Å; T286-F373 VanDerWaalsContact CA-CE2 3.41Å; T286-F373 WeakPolarHBondContact O-CD2 3.37Å
287	P	40.2	Very low	44	Very low	82 Å²	82	90.8 Å²	90.8	53%	0.532	48%	0.475	S	S	.	.				0	170.6	0	45.8	-31.1	0	0	0	122.2	F373	P287-F373 HydrophobicContact CB-CD1 4.16Å; P287-F373 HydrophobicContact CB-CD2 4.39Å; P287-F373 HydrophobicContact CB-CE1 3.89Å; P287-F373 HydrophobicContact CB-CE2 4.13Å; P287-F373 HydrophobicContact CB-CG 4.44Å; P287-F373 HydrophobicContact CB-CZ 3.91Å; P287-F373 HydrophobicContact CG-CE1 3.91Å; P287-F373 HydrophobicContact CG-CE2 3.87Å; P287-F373 HydrophobicContact CG-CZ 3.51Å
288	L	41.5	Very low	44.1	Very low	155 Å²	155	92.3 Å²	92.3	81%	0.812	50%	0.501	S	S	*	.			trans	-161.7	132.9	162.6	-144.8	85.7	0	0	0	121.4
289	K	41.7	Very low	44.9	Very low	196 Å²	196	96.1 Å²	96.1	85%	0.852	52%	0.518	S	S	*	.			trans	31.9	145.7	149.1	-68.4	169.8	-174.5	169.9	0	125.2
290	A	38.4	Very low	46.2	Very low	99 Å²	99	95.7 Å²	95.7	82%	0.818	52%	0.517	S	S	*	.			trans	-115.5	132.8	-178	0	0	0	0	0	115.8
291	K	49.6	Very low	47.6	Very low	209 Å²	209	102 Å²	102	91%	0.909	54%	0.54	S	S	*	.			trans	-155.8	9	161.9	-126.6	176.5	-174	-179.6	0	115.7
292	Q	50.9	Low	49.3	Very low	129 Å²	129	105.4 Å²	105.4	60%	0.603	55%	0.553	S	S	*	*			trans	-112.4	4.7	-166.4	-68.3	165.6	-22.3	0	0	114.4	I294 F295 Y296	Q292-I294 VanDerWaalsContact C-N 3.28Å; Q292-I294 PolarHBondContact O-N 3.06Å; Q292-F295 PolarHBondContact O-N 3.2Å; Q292-Y296 HydrophobicContact CB-CD2 4.16Å; Q292-Y296 HydrophobicContact CB-CE2 3.61Å; Q292-Y296 PolarHBondContact OE1-OH 3.1Å
293	L	53.4	Low	51	Low	149 Å²	149	107.5 Å²	107.5	78%	0.78	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-30.1	-158.8	-166.1	65.9	0	0	0	116
294	I	55.8	Low	52.6	Low	152 Å²	152	110.8 Å²	110.8	78%	0.779	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.9	-36	-171.4	-63	172.5	0	0	0	112.4	Q292 Y296	Q292-I294 VanDerWaalsContact C-N 3.28Å; Q292-I294 PolarHBondContact O-N 3.06Å; I294-Y296 VanDerWaalsContact C-N 3.33Å; I294-Y296 PolarHBondContact O-N 3.29Å
295	F	46.1	Very low	54.3	Low	178 Å²	178	110 Å²	110	78%	0.781	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-23.7	-179.8	-74.7	-83.5	0	0	0	113.1	Q292 A297	Q292-F295 PolarHBondContact O-N 3.2Å; F295-A297 VanDerWaalsContact C-N 3.31Å; F295-A297 PolarHBondContact O-N 2.95Å
296	Y	49.7	Very low	56.1	Low	119 Å²	119	109 Å²	109	47%	0.467	58%	0.576	S	S	.	*	H	α-helix	trans	-72	-19	179.1	-74.4	-61.1	0	0	0	114.3	Q292 I294 A298 G300	Q292-Y296 HydrophobicContact CB-CD2 4.16Å; Q292-Y296 HydrophobicContact CB-CE2 3.61Å; Q292-Y296 PolarHBondContact OE1-OH 3.1Å; I294-Y296 VanDerWaalsContact C-N 3.33Å; I294-Y296 PolarHBondContact O-N 3.29Å; Y296-A298 PolarHBondContact O-N 3.09Å; Y296-G300 VanDerWaalsContact O-CA 3.27Å; Y296-G300 WeakPolarHBondContact O-CA 3.5Å; Y296-G300 PolarHBondContact O-N 2.94Å
297	A	50.4	Low	57.9	Low	89 Å²	89	109.5 Å²	109.5	74%	0.736	57%	0.574	S	S	*	*	H	α-helix	trans	-63.7	-36.8	-171.9	0	0	0	0	0	114.1	F295	F295-A297 VanDerWaalsContact C-N 3.31Å; F295-A297 PolarHBondContact O-N 2.95Å
298	A	50	Low	60	Low	93 Å²	93	106.2 Å²	106.2	77%	0.769	55%	0.552	S	S	*	*	H	α-helix	trans	-88	-43.9	179.8	0	0	0	0	0	112.8	Y296	Y296-A298 PolarHBondContact O-N 3.09Å
299	L	51.4	Low	61.9	Low	121 Å²	121	98.8 Å²	98.8	63%	0.634	51%	0.513	S	S	*	.	H	α-helix	trans	-74.8	-26.6	-179.3	-77.9	160.2	0	0	0	113.1	R301 T303	L299-R301 PolarHBondContact O-N 2.96Å; L299-T303 WeakPolarHBondContact O-CB 3.46Å; L299-T303 PolarHBondContact O-OG1 3.24Å
300	G	56.6	Low	64	Low	13 Å²	13	91.5 Å²	91.5	13%	0.134	49%	0.485	C	S	.	.	H	α-helix	trans	-68	-22.2	-166.6	0	0	0	0	0	116.3	Y296 Y302 L304 P305	Y296-G300 VanDerWaalsContact O-CA 3.27Å; Y296-G300 WeakPolarHBondContact O-CA 3.5Å; Y296-G300 PolarHBondContact O-N 2.94Å; G300-Y302 VanDerWaalsContact C-N 3.27Å; G300-Y302 PolarHBondContact O-N 2.88Å; G300-Y302 VanDerWaalsContact O-N 3.08Å; G300-L304 VanDerWaalsContact O-CB 3.28Å; G300-L304 WeakPolarHBondContact O-CB 3.33Å; G300-L304 PolarHBondContact O-N 2.7Å; G300-P305 WeakPolarHBondContact O-CD 3.32Å
301	R	66.3	Low	66.3	Low	144 Å²	144	90.8 Å²	90.8	54%	0.543	47%	0.467	S	S	.	.	H	α-helix	trans	-52.3	-40.4	-168.1	-162	-173	-143.3	121.5	5.1	114.4	H125 L299	H125-R301 PolarHBondContact CE1-NE 2.9Å; H125-R301 VanDerWaalsContact CE1-NE 3.32Å; H125-R301 PolarHBondContact CE1-NH2 3.47Å; H125-R301 VanDerWaalsContact CE1-NH2 3.27Å; H125-R301 VanDerWaalsContact NE2-CZ 3.32Å; H125-R301 PolarHBondContact NE2-NE 2.93Å; H125-R301 PolarHBondContact NE2-NH2 3.42Å; L299-R301 PolarHBondContact O-N 2.96Å
302	Y	76.8	Confident	67.9	Low	71 Å²	71	80.9 Å²	80.9	28%	0.278	42%	0.424	S	S	.	.	H	α-helix	trans	-119	-32.7	175.5	-54.7	-63.1	0	0	0	111.9	L118 V121 V122 Y126 G300 P305 L306	L118-Y302 HydrophobicContact CD1-CD1 4.23Å; V121-Y302 HydrophobicContact CG1-CD1 3.94Å; V121-Y302 HydrophobicContact CG1-CE1 4.17Å; V122-Y302 HydrophobicContact CG2-CE1 4.47Å; Y126-Y302 VanDerWaalsContact CE2-OH 3.29Å; Y126-Y302 WeakPolarHBondContact CE2-OH 3.4Å; Y126-Y302 PolarHBondContact OH-OH 3.33Å; G300-Y302 VanDerWaalsContact C-N 3.27Å; G300-Y302 PolarHBondContact O-N 2.88Å; G300-Y302 VanDerWaalsContact O-N 3.08Å; Y302-P305 VanDerWaalsContact O-CD 3.31Å; Y302-P305 WeakPolarHBondContact O-CD 3.36Å; Y302-L306 WeakPolarHBondContact O-CB 3.47Å; Y302-L306 PolarHBondContact O-N 3.48Å
303	T	76.9	Confident	69.5	Low	62 Å²	62	74.8 Å²	74.8	38%	0.38	40%	0.395	S	S	.	.	H	α-helix	trans	-70.6	-35.7	-175.7	-33.2	0	0	0	0	113.2	L299 L306 I307	L299-T303 WeakPolarHBondContact O-CB 3.46Å; L299-T303 PolarHBondContact O-OG1 3.24Å; T303-L306 PolarHBondContact O-N 3.26Å; T303-I307 HydrophobicContact CG2-CD1 3.88Å; T303-I307 HydrophobicContact CG2-CG1 4.34Å; T303-I307 WeakPolarHBondContact O-CB 3.41Å; T303-I307 VanDerWaalsContact O-CG1 3.26Å; T303-I307 WeakPolarHBondContact O-CG1 3.47Å; T303-I307 PolarHBondContact O-N 2.67Å
304	L	75.3	Confident	71	Confident	69 Å²	69	71.6 Å²	71.6	36%	0.361	38%	0.378	S	S	.	.	H	α-helix	trans	-65.7	-49.4	174.5	177.8	69.1	0	0	0	111.2	G300 L306 I307 V308	G300-L304 VanDerWaalsContact O-CB 3.28Å; G300-L304 WeakPolarHBondContact O-CB 3.33Å; G300-L304 PolarHBondContact O-N 2.7Å; L304-L306 VanDerWaalsContact C-N 3.28Å; L304-L306 PolarHBondContact O-N 3.24Å; L304-I307 PolarHBondContact O-N 2.77Å; L304-V308 HydrophobicContact CD1-CG2 3.84Å; L304-V308 HydrophobicContact CG-CG2 4.32Å; L304-V308 VanDerWaalsContact O-CB 3.29Å; L304-V308 WeakPolarHBondContact O-CB 3.35Å; L304-V308 WeakPolarHBondContact O-CG2 3.27Å; L304-V308 PolarHBondContact O-N 2.9Å
305	P	77.6	Confident	72.4	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.006	35%	0.354	C	S	.	.	H	α-helix	trans	-53.1	-43.1	170.4	-21.4	22.7	0	0	0	114.2	V121 G300 Y302 S309 L381 P382	V121-P305 HydrophobicContact CG1-CG 4.36Å; V121-P305 HydrophobicContact CG2-CB 3.78Å; V121-P305 HydrophobicContact CG2-CG 3.82Å; G300-P305 WeakPolarHBondContact O-CD 3.32Å; Y302-P305 VanDerWaalsContact O-CD 3.31Å; Y302-P305 WeakPolarHBondContact O-CD 3.36Å; P305-S309 VanDerWaalsContact O-CB 3.25Å; P305-S309 WeakPolarHBondContact O-CB 3.48Å; P305-S309 PolarHBondContact O-N 3.49Å; P305-S309 PolarHBondContact O-OG 3.09Å; P305-L381 HydrophobicContact CB-CD2 4.2Å; P305-P382 HydrophobicContact CG-CG 3.73Å
306	L	83.3	Confident	74.2	Confident	67 Å²	67	58.6 Å²	58.6	35%	0.351	32%	0.32	S	S	.	.	H	α-helix	trans	-65.4	-53.1	-179.4	-168.9	71.9	0	0	0	111.2	Y302 T303 L304 V308 S309 V310	Y302-L306 WeakPolarHBondContact O-CB 3.47Å; Y302-L306 PolarHBondContact O-N 3.48Å; T303-L306 PolarHBondContact O-N 3.26Å; L304-L306 VanDerWaalsContact C-N 3.28Å; L304-L306 PolarHBondContact O-N 3.24Å; L306-V308 VanDerWaalsContact C-N 3.35Å; L306-V308 PolarHBondContact O-N 3.48Å; L306-S309 PolarHBondContact O-N 3.07Å; L306-S309 PolarHBondContact O-OG 2.73Å; L306-S309 VanDerWaalsContact O-OG 3.08Å; L306-V310 WeakPolarHBondContact O-CB 3.4Å; L306-V310 VanDerWaalsContact O-CG2 3.29Å; L306-V310 WeakPolarHBondContact O-CG2 3.41Å; L306-V310 PolarHBondContact O-N 2.97Å
307	I	84	Confident	75.9	Confident	102 Å²	102	53.6 Å²	53.6	52%	0.523	30%	0.302	S	S	.	.	H	α-helix	trans	-58.2	-46.7	178.1	-70	168.2	0	0	0	111	T303 L304 V310 L311	T303-I307 HydrophobicContact CG2-CD1 3.88Å; T303-I307 HydrophobicContact CG2-CG1 4.34Å; T303-I307 WeakPolarHBondContact O-CB 3.41Å; T303-I307 VanDerWaalsContact O-CG1 3.26Å; T303-I307 WeakPolarHBondContact O-CG1 3.47Å; T303-I307 PolarHBondContact O-N 2.67Å; L304-I307 PolarHBondContact O-N 2.77Å; I307-V310 PolarHBondContact O-N 3.22Å; I307-L311 WeakPolarHBondContact O-CB 3.46Å; I307-L311 PolarHBondContact O-N 3.22Å
308	V	83.5	Confident	77.3	Confident	12 Å²	12	49.9 Å²	49.9	7%	0.073	27%	0.27	C	S	.	.	H	α-helix	trans	-64.9	-44.1	-179.9	165.1	0	0	0	0	111.4	L304 L306 L311 V312 I377 L381	L304-V308 HydrophobicContact CD1-CG2 3.84Å; L304-V308 HydrophobicContact CG-CG2 4.32Å; L304-V308 VanDerWaalsContact O-CB 3.29Å; L304-V308 WeakPolarHBondContact O-CB 3.35Å; L304-V308 WeakPolarHBondContact O-CG2 3.27Å; L304-V308 PolarHBondContact O-N 2.9Å; L306-V308 VanDerWaalsContact C-N 3.35Å; L306-V308 PolarHBondContact O-N 3.48Å; V308-L311 WeakPolarHBondContact O-CB 3.37Å; V308-L311 PolarHBondContact O-N 3.43Å; V308-V312 HydrophobicContact CG1-CG2 4.34Å; V308-V312 VanDerWaalsContact O-CG2 3.31Å; V308-V312 WeakPolarHBondContact O-CG2 3.23Å; V308-V312 PolarHBondContact O-N 2.91Å; V308-I377 HydrophobicContact CB-CG2 4.27Å; V308-I377 HydrophobicContact CG1-CG2 3.28Å; V308-I377 HydrophobicContact CG2-CG2 4.04Å; V308-L381 HydrophobicContact CB-CD2 3.81Å; V308-L381 HydrophobicContact CG1-CD1 4.06Å; V308-L381 HydrophobicContact CG1-CD2 3.59Å; V308-L381 HydrophobicContact CG1-CG 3.97Å; V308-L381 HydrophobicContact CG2-CD2 4.49Å
309	S	82.4	Confident	78.6	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-70	-31.9	178.8	58.2	0	0	0	0	113.1	S114 T117 P305 L306 A313	S114-S309 WeakPolarHBondContact CA-OG 3.39Å; T117-S309 WeakPolarHBondContact OG1-CB 3.28Å; T117-S309 PolarHBondContact OG1-OG 3.44Å; P305-S309 VanDerWaalsContact O-CB 3.25Å; P305-S309 WeakPolarHBondContact O-CB 3.48Å; P305-S309 PolarHBondContact O-N 3.49Å; P305-S309 PolarHBondContact O-OG 3.09Å; L306-S309 PolarHBondContact O-N 3.07Å; L306-S309 PolarHBondContact O-OG 2.73Å; L306-S309 VanDerWaalsContact O-OG 3.08Å; S309-A313 WeakPolarHBondContact O-CB 3.46Å; S309-A313 PolarHBondContact O-N 3.13Å
310	V	86.6	Confident	79.8	Confident	43 Å²	43	50 Å²	50	26%	0.261	25%	0.249	S	C	.	.	H	α-helix	trans	-65.5	-43.4	168.9	170.2	0	0	0	0	110.9	I110 L306 I307 A313 I314	I110-V310 HydrophobicContact CG2-CB 4.41Å; I110-V310 HydrophobicContact CG2-CG1 4.05Å; I110-V310 HydrophobicContact CG2-CG2 3.99Å; L306-V310 WeakPolarHBondContact O-CB 3.4Å; L306-V310 VanDerWaalsContact O-CG2 3.29Å; L306-V310 WeakPolarHBondContact O-CG2 3.41Å; L306-V310 PolarHBondContact O-N 2.97Å; I307-V310 PolarHBondContact O-N 3.22Å; V310-A313 PolarHBondContact O-N 3.49Å; V310-I314 HydrophobicContact CG1-CD1 3.81Å; V310-I314 HydrophobicContact CG1-CG1 4.49Å; V310-I314 WeakPolarHBondContact O-CD1 3.43Å; V310-I314 VanDerWaalsContact O-CG1 3.25Å; V310-I314 WeakPolarHBondContact O-CG1 3.38Å; V310-I314 PolarHBondContact O-N 2.99Å
311	L	86	Confident	80.6	Confident	84 Å²	84	50.6 Å²	50.6	44%	0.44	25%	0.254	S	S	.	.	H	α-helix	trans	-61	-48.2	175.5	179.1	64.6	0	0	0	111.7	I307 V308 A313 I314 V315	I307-L311 WeakPolarHBondContact O-CB 3.46Å; I307-L311 PolarHBondContact O-N 3.22Å; V308-L311 WeakPolarHBondContact O-CB 3.37Å; V308-L311 PolarHBondContact O-N 3.43Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 2.83Å; L311-I314 PolarHBondContact O-N 2.59Å; L311-V315 WeakPolarHBondContact O-CG2 3.43Å; L311-V315 PolarHBondContact O-N 3.42Å
312	V	83.3	Confident	80.9	Confident	1 Å²	1	44 Å²	44	1%	0.006	23%	0.231	C	C	.	.	H	α-helix	trans	-63.7	-39.4	176	177.5	0	0	0	0	110.7	L172 V308 I314 V315 T316 L374	L172-V312 HydrophobicContact CD2-CB 3.98Å; L172-V312 HydrophobicContact CD2-CG1 3.61Å; L172-V312 HydrophobicContact CD2-CG2 4.34Å; V308-V312 HydrophobicContact CG1-CG2 4.34Å; V308-V312 VanDerWaalsContact O-CG2 3.31Å; V308-V312 WeakPolarHBondContact O-CG2 3.23Å; V308-V312 PolarHBondContact O-N 2.91Å; V312-I314 PolarHBondContact O-N 3Å; V312-V315 PolarHBondContact O-N 2.87Å; V312-T316 HydrophobicContact CG1-CG2 4.19Å; V312-T316 WeakPolarHBondContact O-CB 3.3Å; V312-T316 WeakPolarHBondContact O-CG2 3.46Å; V312-T316 PolarHBondContact O-N 3.02Å; V312-T316 PolarHBondContact O-OG1 3.32Å; V312-L374 HydrophobicContact CG2-CD2 4.09Å
313	A	83.2	Confident	80.8	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.1	-40.6	175.5	0	0	0	0	0	112.4	W109 I110 V113 S309 V310 L311 T316 L317	W109-A313 VanDerWaalsContact CD1-O 3.25Å; W109-A313 PolarHBondContact NE1-O 3.48Å; I110-A313 HydrophobicContact CB-CB 4.35Å; I110-A313 HydrophobicContact CG1-CB 4.02Å; I110-A313 HydrophobicContact CG2-CB 4.5Å; V113-A313 HydrophobicContact CB-CB 3.83Å; V113-A313 HydrophobicContact CG1-CB 3.94Å; V113-A313 HydrophobicContact CG2-CB 4.22Å; S309-A313 WeakPolarHBondContact O-CB 3.46Å; S309-A313 PolarHBondContact O-N 3.13Å; V310-A313 PolarHBondContact O-N 3.49Å; L311-A313 VanDerWaalsContact C-N 3.33Å; L311-A313 PolarHBondContact O-N 2.83Å; A313-T316 WeakPolarHBondContact CA-OG1 3.37Å; A313-T316 CarbonylContact O-C 3.44Å; A313-T316 PolarHBondContact O-N 2.85Å; A313-T316 PolarHBondContact O-OG1 3.41Å; A313-L317 WeakPolarHBondContact O-CG 3.23Å; A313-L317 PolarHBondContact O-N 3.35Å; A313-L317 VanDerWaalsContact O-N 3.08Å
314	I	86.6	Confident	81	Confident	82 Å²	82	46.6 Å²	46.6	42%	0.421	24%	0.242	S	C	.	.	H	α-helix	trans	-63.7	-48.5	175.8	-70.8	162.9	0	0	0	110.8	I110 V310 L311 V312 T316 L317	I110-I314 HydrophobicContact CD1-CG1 3.84Å; I110-I314 HydrophobicContact CG1-CG1 4.43Å; V310-I314 HydrophobicContact CG1-CD1 3.81Å; V310-I314 HydrophobicContact CG1-CG1 4.49Å; V310-I314 WeakPolarHBondContact O-CD1 3.43Å; V310-I314 VanDerWaalsContact O-CG1 3.25Å; V310-I314 WeakPolarHBondContact O-CG1 3.38Å; V310-I314 PolarHBondContact O-N 2.99Å; L311-I314 PolarHBondContact O-N 2.59Å; V312-I314 PolarHBondContact O-N 3Å; I314-T316 VanDerWaalsContact C-N 3.27Å; I314-T316 PolarHBondContact O-N 3.11Å; I314-L317 WeakPolarHBondContact O-CB 3.44Å; I314-L317 WeakPolarHBondContact O-CG 3.45Å; I314-L317 PolarHBondContact O-N 3.33Å
315	V	85.1	Confident	80.9	Confident	44 Å²	44	43.4 Å²	43.4	27%	0.267	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-33.6	178.2	176.6	0	0	0	0	111.6	L311 V312 G321 T325 L374	L311-V315 WeakPolarHBondContact O-CG2 3.43Å; L311-V315 PolarHBondContact O-N 3.42Å; V312-V315 PolarHBondContact O-N 2.87Å; V315-G321 CarbonylContact O-C 3.45Å; V315-G321 WeakPolarHBondContact O-CA 3.38Å; V315-T325 HydrophobicContact CG1-CG2 4.48Å; V315-L374 HydrophobicContact CB-CD2 4.19Å; V315-L374 HydrophobicContact CG1-CD1 4.03Å; V315-L374 HydrophobicContact CG1-CD2 4.08Å; V315-L374 HydrophobicContact CG2-CD2 4.38Å
316	T	84	Confident	81	Confident	13 Å²	13	44 Å²	44	8%	0.08	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.9	9.1	177.7	58.1	0	0	0	0	114.3	W109 V312 A313 I314 P318 S327	W109-T316 PolarHBondContact NE1-O 3.39Å; W109-T316 PolarHBondContact NE1-OG1 3.18Å; V312-T316 HydrophobicContact CG1-CG2 4.19Å; V312-T316 WeakPolarHBondContact O-CB 3.3Å; V312-T316 WeakPolarHBondContact O-CG2 3.46Å; V312-T316 PolarHBondContact O-N 3.02Å; V312-T316 PolarHBondContact O-OG1 3.32Å; A313-T316 WeakPolarHBondContact CA-OG1 3.37Å; A313-T316 CarbonylContact O-C 3.44Å; A313-T316 PolarHBondContact O-N 2.85Å; A313-T316 PolarHBondContact O-OG1 3.41Å; I314-T316 VanDerWaalsContact C-N 3.27Å; I314-T316 PolarHBondContact O-N 3.11Å; T316-P318 VanDerWaalsContact O-CD 3.28Å; T316-P318 WeakPolarHBondContact O-CD 3.32Å; T316-P318 VanDerWaalsContact O-N 3.12Å; T316-S327 WeakPolarHBondContact O-CB 3.31Å; T316-S327 PolarHBondContact O-OG 2.9Å
317	L	83.9	Confident	80.5	Confident	14 Å²	14	41.3 Å²	41.3	7%	0.073	22%	0.215	C	C	.	.			trans	-57.5	116.8	179.4	-83.9	170.5	0	0	0	110.9	I106 W109 I110 A313 I314 N319 Y320 G322	I106-L317 HydrophobicContact CB-CD2 4.22Å; I106-L317 HydrophobicContact CG1-CD2 4.21Å; I106-L317 HydrophobicContact CG2-CD1 4.04Å; I106-L317 HydrophobicContact CG2-CD2 3.91Å; W109-L317 HydrophobicContact CB-CD2 4.04Å; W109-L317 HydrophobicContact CG-CD2 4.1Å; I110-L317 HydrophobicContact CG1-CD2 4.46Å; A313-L317 WeakPolarHBondContact O-CG 3.23Å; A313-L317 PolarHBondContact O-N 3.35Å; A313-L317 VanDerWaalsContact O-N 3.08Å; I314-L317 WeakPolarHBondContact O-CB 3.44Å; I314-L317 WeakPolarHBondContact O-CG 3.45Å; I314-L317 PolarHBondContact O-N 3.33Å; L317-N319 PolarHBondContact O-N 3.12Å; L317-Y320 HydrophobicContact CB-CD2 4.46Å; L317-Y320 HydrophobicContact CD1-CD2 4.49Å; L317-Y320 PolarHBondContact O-N 3.39Å; L317-G322 WeakPolarHBondContact O-CA 3.4Å; L317-G322 PolarHBondContact O-N 2.88Å
318	P	80.4	Confident	80.2	Confident	12 Å²	12	39.1 Å²	39.1	8%	0.078	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-33.9	-168.3	-33.5	37.8	0	0	0	115.8	Y94 W109 T316 G322 K323 L328	Y94-P318 HydrophobicContact CD1-CG 4.31Å; Y94-P318 HydrophobicContact CE1-CB 3.89Å; Y94-P318 HydrophobicContact CE1-CG 3.72Å; Y94-P318 HydrophobicContact CE2-CG 4.25Å; W109-P318 HydrophobicContact CD2-CG 4.19Å; W109-P318 HydrophobicContact CE3-CG 4.04Å; W109-P318 HydrophobicContact CH2-CG 3.97Å; W109-P318 HydrophobicContact CZ2-CG 4.15Å; W109-P318 HydrophobicContact CZ3-CG 3.93Å; T316-P318 VanDerWaalsContact O-CD 3.28Å; T316-P318 WeakPolarHBondContact O-CD 3.32Å; T316-P318 VanDerWaalsContact O-N 3.12Å; P318-G322 CarbonylContact O-C 3.59Å; P318-K323 PolarHBondContact O-N 2.91Å; P318-L328 HydrophobicContact CB-CD1 4.1Å; P318-L328 HydrophobicContact CB-CD2 4.21Å; P318-L328 HydrophobicContact CB-CG 4.02Å; P318-L328 HydrophobicContact CG-CD2 3.8Å; P318-L328 HydrophobicContact CG-CG 4.07Å
319	N	77.4	Confident	79.8	Confident	71 Å²	71	41.5 Å²	41.5	38%	0.38	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-20	-175.4	-58.2	-7.8	0	0	0	113.9	Y94 L102 L317	Y94-N319 PolarHBondContact OH-ND2 3.04Å; Y94-N319 PolarHBondContact OH-OD1 2.89Å; L102-N319 WeakPolarHBondContact CD1-ND2 3.43Å; L317-N319 PolarHBondContact O-N 3.12Å
320	Y	75.7	Confident	79.7	Confident	146 Å²	146	44.8 Å²	44.8	57%	0.573	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-114.6	-105.7	-177.4	-62.2	-76.2	0	0	0	110.1	I106 L317 G322 K323	I106-Y320 HydrophobicContact CD1-CE2 4.26Å; L317-Y320 HydrophobicContact CB-CD2 4.46Å; L317-Y320 HydrophobicContact CD1-CD2 4.49Å; L317-Y320 PolarHBondContact O-N 3.39Å; Y320-G322 PolarHBondContact O-N 3.47Å; Y320-G322 VanDerWaalsContact O-N 3.13Å; Y320-K323 WeakPolarHBondContact O-CB 3.27Å; Y320-K323 PolarHBondContact O-N 3.41Å
321	G	74.7	Confident	79.1	Confident	24 Å²	24	44.2 Å²	44.2	25%	0.247	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-13.5	178.7	0	0	0	0	0	114.1	V315 K323 V324 T325	V315-G321 CarbonylContact O-C 3.45Å; V315-G321 WeakPolarHBondContact O-CA 3.38Å; G321-K323 VanDerWaalsContact C-N 3.28Å; G321-K323 PolarHBondContact O-N 3.02Å; G321-V324 WeakPolarHBondContact O-CB 3.24Å; G321-V324 PolarHBondContact O-N 2.76Å; G321-V324 VanDerWaalsContact O-N 3.16Å; G321-T325 PolarHBondContact O-N 2.82Å; G321-T325 PolarHBondContact O-OG1 2.83Å
322	G	72.3	Confident	78.5	Confident	6 Å²	6	42.9 Å²	42.9	6%	0.062	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-13	169.2	0	0	0	0	0	115.2	L317 P318 Y320 T325 H326 S327	L317-G322 WeakPolarHBondContact O-CA 3.4Å; L317-G322 PolarHBondContact O-N 2.88Å; P318-G322 CarbonylContact O-C 3.59Å; Y320-G322 PolarHBondContact O-N 3.47Å; Y320-G322 VanDerWaalsContact O-N 3.13Å; G322-T325 WeakPolarHBondContact CA-OG1 3.29Å; G322-H326 VanDerWaalsContact O-CA 3.23Å; G322-H326 WeakPolarHBondContact O-CA 3.26Å; G322-H326 PolarHBondContact O-N 3.41Å; G322-H326 VanDerWaalsContact O-N 3.11Å; G322-S327 PolarHBondContact O-N 3.1Å
323	K	75.4	Confident	78.1	Confident	147 Å²	147	44 Å²	44	64%	0.639	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-36	163.6	-68.2	-169.4	177.8	-169.5	0	111.9	P318 Y320 G321 H326	P318-K323 PolarHBondContact O-N 2.91Å; Y320-K323 WeakPolarHBondContact O-CB 3.27Å; Y320-K323 PolarHBondContact O-N 3.41Å; G321-K323 VanDerWaalsContact C-N 3.28Å; G321-K323 PolarHBondContact O-N 3.02Å; K323-H326 PolarHBondContact O-CE1 3.23Å; K323-H326 PolarHBondContact O-ND1 2.84Å
324	V	79.5	Confident	77.9	Confident	41 Å²	41	44 Å²	44	25%	0.248	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-54.1	175.4	172.7	0	0	0	0	109.7	G321 H326 V363 S366 F367	G321-V324 WeakPolarHBondContact O-CB 3.24Å; G321-V324 PolarHBondContact O-N 2.76Å; G321-V324 VanDerWaalsContact O-N 3.16Å; V324-H326 VanDerWaalsContact C-N 3.26Å; V324-H326 PolarHBondContact O-N 2.98Å; V324-V363 HydrophobicContact CB-CG1 4.35Å; V324-V363 HydrophobicContact CG1-CG1 4.16Å; V324-S366 WeakPolarHBondContact CG1-O 3.28Å; V324-F367 WeakPolarHBondContact O-CD2 3.46Å; V324-F367 WeakPolarHBondContact O-CE2 3.48Å
325	T	73.6	Confident	77.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.012	22%	0.217	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.6	18.4	-174.5	58.6	0	0	0	0	114.2	F282 V315 G321 G322 S327 L374	F282-T325 WeakPolarHBondContact CE1-O 3.34Å; F282-T325 WeakPolarHBondContact CZ-O 3.45Å; V315-T325 HydrophobicContact CG1-CG2 4.48Å; G321-T325 PolarHBondContact O-N 2.82Å; G321-T325 PolarHBondContact O-OG1 2.83Å; G322-T325 WeakPolarHBondContact CA-OG1 3.29Å; T325-S327 VanDerWaalsContact O-CA 3.31Å; T325-S327 WeakPolarHBondContact O-CA 3.08Å; T325-S327 PolarHBondContact O-N 2.71Å; T325-L374 HydrophobicContact CG2-CD1 4.47Å
326	H	79.6	Confident	77.5	Confident	13 Å²	13	42.3 Å²	42.3	6%	0.06	23%	0.225	C	C	.	.	T	Hydrogen-bonded Turn	trans	26.1	44	-177	-53.3	-50.7	0	0	0	116.1	F282 G322 K323 V324 L328 L329 L334 T359 W360 F367	F282-H326 HydrophobicContact CE1-CB 4.23Å; G322-H326 VanDerWaalsContact O-CA 3.23Å; G322-H326 WeakPolarHBondContact O-CA 3.26Å; G322-H326 PolarHBondContact O-N 3.41Å; G322-H326 VanDerWaalsContact O-N 3.11Å; K323-H326 PolarHBondContact O-CE1 3.23Å; K323-H326 PolarHBondContact O-ND1 2.84Å; V324-H326 VanDerWaalsContact C-N 3.26Å; V324-H326 PolarHBondContact O-N 2.98Å; H326-L328 PolarHBondContact O-N 3.15Å; H326-L329 WeakPolarHBondContact O-CB 3.31Å; H326-L329 PolarHBondContact O-N 3.32Å; H326-L334 HydrophobicContact CB-CD2 4.04Å; H326-T359 WeakPolarHBondContact CE1-CG2 3.17Å; H326-T359 PolarHBondContact CE1-O 2.82Å; H326-W360 AromaticContact CD2-CE2 3.95Å; H326-W360 AromaticContact CD2-CZ2 3.95Å; H326-W360 AromaticContact NE2-CD2 3.88Å; H326-W360 AromaticContact NE2-CE2 3.87Å; H326-F367 AromaticContact CD2-CE2 3.61Å; H326-F367 AromaticContact CD2-CZ 3.88Å
327	S	73.8	Confident	77.4	Confident	10 Å²	10	43 Å²	43	7%	0.07	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-10.5	-157.1	61.2	0	0	0	0	117.5	R90 T316 G322 T325	R90-S327 PolarHBondContact NH2-O 2.91Å; T316-S327 WeakPolarHBondContact O-CB 3.31Å; T316-S327 PolarHBondContact O-OG 2.9Å; G322-S327 PolarHBondContact O-N 3.1Å; T325-S327 VanDerWaalsContact O-CA 3.31Å; T325-S327 WeakPolarHBondContact O-CA 3.08Å; T325-S327 PolarHBondContact O-N 2.71Å
328	L	77.4	Confident	77.5	Confident	56 Å²	56	42.5 Å²	42.5	29%	0.293	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-19.9	175.5	-67.1	175.8	0	0	0	112.7	N91 Y94 W109 P318 H326	N91-L328 PolarHBondContact ND2-O 2.86Å; Y94-L328 HydrophobicContact CD1-CD2 4.27Å; Y94-L328 HydrophobicContact CE1-CD2 4.49Å; W109-L328 HydrophobicContact CH2-CD2 4.23Å; W109-L328 HydrophobicContact CZ3-CD2 4.04Å; P318-L328 HydrophobicContact CB-CD1 4.1Å; P318-L328 HydrophobicContact CB-CD2 4.21Å; P318-L328 HydrophobicContact CB-CG 4.02Å; P318-L328 HydrophobicContact CG-CD2 3.8Å; P318-L328 HydrophobicContact CG-CG 4.07Å; H326-L328 PolarHBondContact O-N 3.15Å
329	L	75.1	Confident	77.7	Confident	62 Å²	62	43.6 Å²	43.6	33%	0.325	23%	0.228	S	C	.	.	S	Bend	trans	-83.6	143.9	178.4	-77.8	68.8	0	0	0	109.9	H326 A333 L334	H326-L329 WeakPolarHBondContact O-CB 3.31Å; H326-L329 PolarHBondContact O-N 3.32Å; L329-A333 HydrophobicContact CB-CB 4.33Å; L329-A333 HydrophobicContact CD2-CB 4.33Å; L329-A333 HydrophobicContact CG-CB 4.48Å; L329-L334 HydrophobicContact CB-CD1 3.83Å; L329-L334 HydrophobicContact CB-CD2 3.78Å; L329-L334 HydrophobicContact CB-CG 3.79Å; L329-L334 HydrophobicContact CD2-CD2 3.51Å; L329-L334 HydrophobicContact CD2-CG 4.14Å; L329-L334 HydrophobicContact CG-CD2 4.26Å
330	T	79.4	Confident	78	Confident	70 Å²	70	40.7 Å²	40.7	43%	0.429	21%	0.213	S	C	.	.			trans	-72.5	152.6	170.4	53	0	0	0	0	109.5	T87 N332 A333 L334	T87-T330 HydrophobicContact CG2-CG2 4.38Å; T330-N332 PolarHBondContact O-N 3.46Å; T330-N332 VanDerWaalsContact O-N 3.08Å; T330-A333 PolarHBondContact O-N 3.12Å; T330-L334 WeakPolarHBondContact O-CD1 3.46Å; T330-L334 WeakPolarHBondContact O-CG 3.29Å
331	S	75.1	Confident	78.2	Confident	31 Å²	31	39.9 Å²	39.9	22%	0.217	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-46.3	-44.5	175.1	-52.9	0	0	0	0	111.5	T280 A281 A333 L334	T280-S331 WeakPolarHBondContact CA-O 3.45Å; T280-S331 WeakPolarHBondContact CB-O 3.47Å; A281-S331 PolarHBondContact N-O 3.23Å; S331-A333 VanDerWaalsContact C-N 3.29Å; S331-A333 PolarHBondContact O-N 3.11Å; S331-L334 WeakPolarHBondContact O-CB 3.41Å; S331-L334 PolarHBondContact O-N 3.07Å; S331-L334 VanDerWaalsContact O-N 3.12Å
332	N	72.6	Confident	78.3	Confident	55 Å²	55	40.3 Å²	40.3	29%	0.294	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-56.2	-29.2	178	-72.8	40	0	0	0	115.6	C278 P279 T330 L334 E336	C278-N332 HydrophobicContact CB-CB 3.62Å; C278-N332 VanDerWaalsContact CB-ND2 3.34Å; C278-N332 WeakPolarHBondContact CB-ND2 3.45Å; P279-N332 CarbonylContact O-C 3.14Å; T330-N332 PolarHBondContact O-N 3.46Å; T330-N332 VanDerWaalsContact O-N 3.08Å; N332-L334 VanDerWaalsContact C-N 3.25Å; N332-L334 PolarHBondContact O-N 3.46Å; N332-E336 VanDerWaalsContact O-CD 3.24Å; N332-E336 WeakPolarHBondContact O-CG 3.21Å
333	A	75.9	Confident	78.6	Confident	26 Å²	26	41.1 Å²	41.1	22%	0.215	22%	0.217	C	C	.	.	G	3₁₀ helix	trans	-82.1	-1.3	179.4	0	0	0	0	0	113.3	L329 T330 S331 Q337	L329-A333 HydrophobicContact CB-CB 4.33Å; L329-A333 HydrophobicContact CD2-CB 4.33Å; L329-A333 HydrophobicContact CG-CB 4.48Å; T330-A333 PolarHBondContact O-N 3.12Å; S331-A333 VanDerWaalsContact C-N 3.29Å; S331-A333 PolarHBondContact O-N 3.11Å; A333-Q337 WeakPolarHBondContact O-CG 3.02Å
334	L	78.2	Confident	78.7	Confident	0 Å²	0	34.9 Å²	34.9	0%	0	19%	0.19	C	C	.	.	S	Bend	trans	-117.2	-14.8	-157.5	-67.4	158.8	0	0	0	115.7	A281 F282 H326 L329 T330 S331 N332 L338 W360	A281-L334 HydrophobicContact CB-CB 3.27Å; A281-L334 HydrophobicContact CB-CD1 3.65Å; A281-L334 HydrophobicContact CB-CG 4.09Å; F282-L334 HydrophobicContact CD1-CD1 3.91Å; F282-L334 HydrophobicContact CD2-CD1 4.43Å; F282-L334 HydrophobicContact CE1-CD1 3.37Å; F282-L334 HydrophobicContact CE1-CD2 4.25Å; F282-L334 HydrophobicContact CE1-CG 4.43Å; F282-L334 HydrophobicContact CE2-CD1 3.97Å; F282-L334 HydrophobicContact CG-CD1 4.4Å; F282-L334 HydrophobicContact CZ-CD1 3.41Å; F282-L334 VanDerWaalsContact CZ-CD1 3.41Å; H326-L334 HydrophobicContact CB-CD2 4.04Å; L329-L334 HydrophobicContact CB-CD1 3.83Å; L329-L334 HydrophobicContact CB-CD2 3.78Å; L329-L334 HydrophobicContact CB-CG 3.79Å; L329-L334 HydrophobicContact CD2-CD2 3.51Å; L329-L334 HydrophobicContact CD2-CG 4.14Å; L329-L334 HydrophobicContact CG-CD2 4.26Å; T330-L334 WeakPolarHBondContact O-CD1 3.46Å; T330-L334 WeakPolarHBondContact O-CG 3.29Å; S331-L334 WeakPolarHBondContact O-CB 3.41Å; S331-L334 PolarHBondContact O-N 3.07Å; S331-L334 VanDerWaalsContact O-N 3.12Å; N332-L334 VanDerWaalsContact C-N 3.25Å; N332-L334 PolarHBondContact O-N 3.46Å; L334-L338 WeakPolarHBondContact O-CD1 3.33Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.46Å; L334-W360 HydrophobicContact CD2-CZ2 4.28Å
335	L	82.3	Confident	78.1	Confident	0 Å²	0	35.7 Å²	35.7	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-87.9	-20.5	150.2	-97.5	27.5	0	0	0	109.7	P279 T280 A281 Q337 L338 F339 L392 A396	P279-L335 HydrophobicContact CB-CB 3.52Å; P279-L335 HydrophobicContact CB-CD2 3.91Å; P279-L335 HydrophobicContact CB-CG 4.28Å; P279-L335 HydrophobicContact CG-CB 3.87Å; P279-L335 WeakPolarHBondContact O-CB 3.33Å; P279-L335 PolarHBondContact O-N 2.79Å; P279-L335 VanDerWaalsContact O-N 3.07Å; T280-L335 WeakPolarHBondContact O-CD1 3.36Å; T280-L335 WeakPolarHBondContact O-CD2 3.33Å; A281-L335 WeakPolarHBondContact O-CD1 3.43Å; L335-Q337 PolarHBondContact O-N 2.83Å; L335-L338 HydrophobicContact CD1-CB 3.86Å; L335-L338 HydrophobicContact CD1-CD1 3.51Å; L335-L338 HydrophobicContact CD1-CG 4.3Å; L335-L338 HydrophobicContact CG-CB 4.4Å; L335-L338 PolarHBondContact O-N 3.11Å; L335-F339 HydrophobicContact CB-CD1 4.16Å; L335-F339 HydrophobicContact CB-CD2 4.05Å; L335-F339 HydrophobicContact CB-CE1 4.4Å; L335-F339 HydrophobicContact CB-CE2 4.31Å; L335-F339 HydrophobicContact CB-CG 3.98Å; L335-F339 HydrophobicContact CB-CZ 4.48Å; L335-F339 HydrophobicContact CD1-CE1 4.44Å; L335-F339 HydrophobicContact CD2-CD1 4.26Å; L335-F339 HydrophobicContact CD2-CD2 4.28Å; L335-F339 HydrophobicContact CD2-CE1 3.63Å; L335-F339 HydrophobicContact CD2-CE2 3.67Å; L335-F339 HydrophobicContact CD2-CZ 3.31Å; L335-F339 HydrophobicContact CG-CD1 3.66Å; L335-F339 HydrophobicContact CG-CD2 4.13Å; L335-F339 HydrophobicContact CG-CE1 3.51Å; L335-F339 HydrophobicContact CG-CE2 4.01Å; L335-F339 HydrophobicContact CG-CG 3.98Å; L335-F339 HydrophobicContact CG-CZ 3.7Å; L335-F339 WeakPolarHBondContact O-CA 3.3Å; L335-F339 VanDerWaalsContact O-CB 3.26Å; L335-F339 WeakPolarHBondContact O-CB 3.4Å; L335-F339 PolarHBondContact O-N 3.2Å; L335-L392 HydrophobicContact CD2-CD2 4.3Å; L335-L392 HydrophobicContact CD2-CG 4.34Å; L335-A396 HydrophobicContact CD1-CB 3.12Å; L335-A396 HydrophobicContact CD2-CB 4.07Å; L335-A396 HydrophobicContact CG-CB 3.81Å
336	E	80.5	Confident	77.7	Confident	90 Å²	90	38.5 Å²	38.5	42%	0.421	23%	0.227	S	C	.	.	H	α-helix	trans	-53.3	-28.6	167.1	-65.8	179.9	175.2	0	0	110.5	C278 P279 N332	C278-E336 PolarHBondContact SG-OE1 2.91Å; P279-E336 HydrophobicContact CG-CG 4.05Å; P279-E336 PolarHBondContact O-N 3.17Å; N332-E336 VanDerWaalsContact O-CD 3.24Å; N332-E336 WeakPolarHBondContact O-CG 3.21Å
337	Q	83.6	Confident	76.7	Confident	28 Å²	28	44.7 Å²	44.7	13%	0.131	27%	0.266	C	S	.	.	H	α-helix	trans	-87	-36.4	169.1	-66.6	179.8	-9.7	0	0	115.3	A333 L335 S340 I356 W360	A333-Q337 WeakPolarHBondContact O-CG 3.02Å; L335-Q337 PolarHBondContact O-N 2.83Å; Q337-S340 VanDerWaalsContact O-CB 3.27Å; Q337-S340 WeakPolarHBondContact O-CB 3.28Å; Q337-S340 PolarHBondContact O-OG 3.45Å; Q337-I356 HydrophobicContact CB-CG2 4.46Å; Q337-I356 HydrophobicContact CG-CD1 4.17Å; Q337-I356 HydrophobicContact CG-CG1 4.32Å; Q337-W360 HydrophobicContact CB-CZ2 3.77Å
338	L	84.3	Confident	75.8	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	29%	0.294	C	S	.	.	H	α-helix	trans	-82.3	-31.8	-179.8	-72.8	160.3	0	0	0	115.2	A281 L334 L335 S340 W344 W360 F367 A396 A397 R400 A425	A281-L338 WeakPolarHBondContact O-CD1 3.33Å; L334-L338 WeakPolarHBondContact O-CD1 3.33Å; L334-L338 WeakPolarHBondContact O-CG 3.46Å; L334-L338 PolarHBondContact O-N 3.46Å; L335-L338 HydrophobicContact CD1-CB 3.86Å; L335-L338 HydrophobicContact CD1-CD1 3.51Å; L335-L338 HydrophobicContact CD1-CG 4.3Å; L335-L338 HydrophobicContact CG-CB 4.4Å; L335-L338 PolarHBondContact O-N 3.11Å; L338-S340 PolarHBondContact O-N 3.38Å; L338-W344 HydrophobicContact CD2-CH2 3.81Å; L338-W344 HydrophobicContact CD2-CZ2 4.34Å; L338-W360 HydrophobicContact CD1-CH2 3.85Å; L338-W360 HydrophobicContact CD1-CZ3 4.32Å; L338-W360 HydrophobicContact CD2-CE3 4.34Å; L338-W360 HydrophobicContact CD2-CH2 3.72Å; L338-W360 HydrophobicContact CD2-CZ3 3.5Å; L338-W360 HydrophobicContact CG-CH2 3.51Å; L338-W360 HydrophobicContact CG-CZ2 4.33Å; L338-W360 HydrophobicContact CG-CZ3 3.88Å; L338-F367 HydrophobicContact CD1-CE1 4.38Å; L338-A396 HydrophobicContact CD1-CB 4.31Å; L338-A397 HydrophobicContact CD1-CB 4.48Å; L338-R400 HydrophobicContact CD2-CB 3.59Å; L338-R400 HydrophobicContact CD2-CG 3.71Å; L338-R400 WeakPolarHBondContact O-CD 3.2Å; L338-R400 PolarHBondContact O-NH1 3.48Å; L338-A425 WeakPolarHBondContact O-CB 3.49Å
339	F	86	Confident	74.7	Confident	36 Å²	36	52.3 Å²	52.3	16%	0.158	31%	0.314	C	S	.	.	S	Bend	trans	-82.6	6.5	171.4	-69.7	-3.8	0	0	0	112	P279 L335 N341 A396 A425 V426 A429 I446 T450	P279-F339 HydrophobicContact CB-CD2 3.85Å; P279-F339 HydrophobicContact CB-CE2 3.83Å; P279-F339 HydrophobicContact CG-CD2 3.97Å; P279-F339 HydrophobicContact CG-CE2 4.44Å; L335-F339 HydrophobicContact CB-CD1 4.16Å; L335-F339 HydrophobicContact CB-CD2 4.05Å; L335-F339 HydrophobicContact CB-CE1 4.4Å; L335-F339 HydrophobicContact CB-CE2 4.31Å; L335-F339 HydrophobicContact CB-CG 3.98Å; L335-F339 HydrophobicContact CB-CZ 4.48Å; L335-F339 HydrophobicContact CD1-CE1 4.44Å; L335-F339 HydrophobicContact CD2-CD1 4.26Å; L335-F339 HydrophobicContact CD2-CD2 4.28Å; L335-F339 HydrophobicContact CD2-CE1 3.63Å; L335-F339 HydrophobicContact CD2-CE2 3.67Å; L335-F339 HydrophobicContact CD2-CZ 3.31Å; L335-F339 HydrophobicContact CG-CD1 3.66Å; L335-F339 HydrophobicContact CG-CD2 4.13Å; L335-F339 HydrophobicContact CG-CE1 3.51Å; L335-F339 HydrophobicContact CG-CE2 4.01Å; L335-F339 HydrophobicContact CG-CG 3.98Å; L335-F339 HydrophobicContact CG-CZ 3.7Å; L335-F339 WeakPolarHBondContact O-CA 3.3Å; L335-F339 VanDerWaalsContact O-CB 3.26Å; L335-F339 WeakPolarHBondContact O-CB 3.4Å; L335-F339 PolarHBondContact O-N 3.2Å; F339-N341 PolarHBondContact O-N 3.18Å; F339-A396 HydrophobicContact CE1-CB 4.19Å; F339-A425 HydrophobicContact CD1-CB 3.8Å; F339-A425 HydrophobicContact CE1-CB 4.12Å; F339-V426 HydrophobicContact CD1-CG2 3.68Å; F339-V426 HydrophobicContact CD2-CG2 3.95Å; F339-V426 HydrophobicContact CE1-CB 4.19Å; F339-V426 HydrophobicContact CE1-CG2 3.61Å; F339-V426 HydrophobicContact CE2-CG2 3.88Å; F339-V426 HydrophobicContact CG-CG2 3.86Å; F339-V426 HydrophobicContact CZ-CB 4.3Å; F339-V426 HydrophobicContact CZ-CG2 3.7Å; F339-A429 HydrophobicContact CE1-CB 4.09Å; F339-A429 HydrophobicContact CZ-CB 4.01Å; F339-I446 HydrophobicContact CZ-CD1 4.34Å; F339-T450 HydrophobicContact CD2-CG2 4.43Å; F339-T450 HydrophobicContact CE2-CG2 4.18Å
340	S	83.2	Confident	74.2	Confident	10 Å²	10	52.4 Å²	52.4	7%	0.07	32%	0.32	C	S	.	.			trans	-51	138.3	172.3	53	0	0	0	0	111.5	Q337 L338 R400 G422	Q337-S340 VanDerWaalsContact O-CB 3.27Å; Q337-S340 WeakPolarHBondContact O-CB 3.28Å; Q337-S340 PolarHBondContact O-OG 3.45Å; L338-S340 PolarHBondContact O-N 3.38Å; S340-R400 PolarHBondContact O-NH1 2.89Å; S340-R400 PolarHBondContact OG-NH1 3.06Å; S340-R400 PolarHBondContact OG-NH2 3.21Å; S340-G422 WeakPolarHBondContact O-CA 3.47Å
341	N	80.1	Confident	73.4	Confident	128 Å²	128	55.3 Å²	55.3	68%	0.684	33%	0.332	S	S	*	.	S	Bend	trans	-87.2	-3.4	-169.5	62.8	-34	0	0	0	114.5	F339 I420	F339-N341 PolarHBondContact O-N 3.18Å; N341-I420 WeakPolarHBondContact O-CG2 3.37Å
342	F	77.2	Confident	73.1	Confident	34 Å²	34	60.7 Å²	60.7	15%	0.149	35%	0.349	C	S	.	.	S	Bend	trans	-97.9	160.6	172.3	57.9	-88	0	0	0	111.3	W344 D353 I356 V357 R400	F342-W344 AromaticContact CD2-CD1 3.93Å; F342-W344 AromaticContact CE2-CD1 3.5Å; F342-W344 AromaticContact CE2-NE1 3.89Å; F342-D353 HydrophobicContact CD1-CB 4.22Å; F342-D353 HydrophobicContact CD2-CB 4.43Å; F342-D353 HydrophobicContact CE1-CB 3.82Å; F342-D353 WeakPolarHBondContact CE1-OD1 3.41Å; F342-D353 HydrophobicContact CE2-CB 4.03Å; F342-D353 HydrophobicContact CZ-CB 3.72Å; F342-I356 HydrophobicContact CE2-CG2 4.47Å; F342-I356 HydrophobicContact CZ-CB 4.06Å; F342-I356 HydrophobicContact CZ-CD1 4.08Å; F342-I356 HydrophobicContact CZ-CG2 4.05Å; F342-V357 HydrophobicContact CD2-CG2 4.42Å; F342-V357 HydrophobicContact CE2-CG2 3.89Å; F342-R400 PolarHBondContact O-NH2 3.45Å
343	T	78.7	Confident	72.9	Confident	23 Å²	23	59.8 Å²	59.8	14%	0.141	34%	0.344	C	S	.	.			trans	-90.6	132.7	174.2	-57.6	0	0	0	0	109	G345 S346 E404 A407 V419 P421	T343-G345 PolarHBondContact O-N 2.69Å; T343-G345 VanDerWaalsContact O-N 3.08Å; T343-S346 PolarHBondContact O-N 3.16Å; T343-S346 PolarHBondContact O-OG 3.33Å; T343-E404 WeakPolarHBondContact CG2-OE2 3.22Å; T343-A407 HydrophobicContact CG2-CB 3.72Å; T343-V419 PolarHBondContact OG1-O 3.41Å; T343-P421 HydrophobicContact CG2-CG 3.98Å; T343-P421 WeakPolarHBondContact OG1-CD 3.48Å
344	W	76.6	Confident	72.3	Confident	15 Å²	15	61.4 Å²	61.4	6%	0.057	36%	0.357	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-9.3	-175.1	-64.8	-19.3	0	0	0	114.3	L338 F342 V357 W360 T361 A364 R400 E404	L338-W344 HydrophobicContact CD2-CH2 3.81Å; L338-W344 HydrophobicContact CD2-CZ2 4.34Å; F342-W344 AromaticContact CD2-CD1 3.93Å; F342-W344 AromaticContact CE2-CD1 3.5Å; F342-W344 AromaticContact CE2-NE1 3.89Å; W344-V357 HydrophobicContact CB-CG2 4.3Å; W344-V357 VanDerWaalsContact O-CG1 3.23Å; W344-V357 WeakPolarHBondContact O-CG1 3.25Å; W344-W360 HydrophobicContact CD2-CB 4.26Å; W344-W360 HydrophobicContact CE3-CB 4.04Å; W344-W360 HydrophobicContact CH2-CB 3.89Å; W344-W360 AromaticContact CH2-CD2 3.6Å; W344-W360 HydrophobicContact CH2-CD2 3.6Å; W344-W360 AromaticContact CH2-CE3 3.22Å; W344-W360 HydrophobicContact CH2-CE3 3.22Å; W344-W360 AromaticContact CH2-CG 3.93Å; W344-W360 HydrophobicContact CH2-CG 3.93Å; W344-W360 AromaticContact CH2-CZ3 3.8Å; W344-W360 HydrophobicContact CH2-CZ3 3.8Å; W344-W360 HydrophobicContact CZ2-CB 4.1Å; W344-W360 AromaticContact CZ2-CD2 3.91Å; W344-W360 HydrophobicContact CZ2-CD2 3.91Å; W344-W360 AromaticContact CZ2-CE3 3.98Å; W344-W360 HydrophobicContact CZ2-CE3 3.98Å; W344-W360 AromaticContact CZ2-CG 4Å; W344-W360 HydrophobicContact CZ2-CG 4Å; W344-W360 HydrophobicContact CZ3-CB 3.86Å; W344-W360 HydrophobicContact CZ3-CD2 4.32Å; W344-W360 AromaticContact CZ3-CE3 3.85Å; W344-W360 HydrophobicContact CZ3-CE3 3.85Å; W344-W360 HydrophobicContact CZ3-CG 4.39Å; W344-T361 HydrophobicContact CB-CG2 4.2Å; W344-A364 HydrophobicContact CZ3-CB 4.27Å; W344-R400 HydrophobicContact CH2-CG 3.73Å; W344-R400 HydrophobicContact CZ2-CG 4.13Å; W344-R400 HydrophobicContact CZ3-CG 4Å; W344-R400 VanDerWaalsContact NE1-NH2 3.13Å; W344-E404 HydrophobicContact CE3-CG 4.1Å; W344-E404 VanDerWaalsContact CG-OE1 3.32Å; W344-E404 PolarHBondContact N-OE1 3.16Å; W344-E404 PolarHBondContact N-OE2 3.34Å
345	G	66.7	Low	71.8	Confident	59 Å²	59	69.3 Å²	69.3	61%	0.608	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	-8.5	173.3	0	0	0	0	0	116.5	T343	T343-G345 PolarHBondContact O-N 2.69Å; T343-G345 VanDerWaalsContact O-N 3.08Å
346	S	66.3	Low	71.4	Confident	61 Å²	61	69.6 Å²	69.6	43%	0.427	39%	0.389	S	S	.	.			trans	-96.4	134.8	-175.9	70.1	0	0	0	0	112.9	T343 N348	T343-S346 PolarHBondContact O-N 3.16Å; T343-S346 PolarHBondContact O-OG 3.33Å; S346-N348 PolarHBondContact O-N 2.83Å
347	T	57	Low	70.9	Confident	143 Å²	143	67 Å²	67	88%	0.877	38%	0.379	S	S	*	.			trans	-82	29.1	-174	55.1	0	0	0	0	113.9
348	N	55	Low	70.1	Confident	123 Å²	123	73 Å²	73	66%	0.658	41%	0.407	S	S	*	.			trans	-104.1	113.8	-172.1	-79.9	-6.1	0	0	0	112.6	S346	S346-N348 PolarHBondContact O-N 2.83Å
349	S	55.3	Low	69.4	Low	103 Å²	103	75.8 Å²	75.8	72%	0.72	42%	0.424	S	S	*	.	S	Bend	trans	76.1	139.9	154.7	-54.1	0	0	0	0	118.9
350	S	63.8	Low	69	Low	64 Å²	64	74.1 Å²	74.1	45%	0.448	42%	0.417	S	S	.	.			trans	70.1	132	164.9	130.4	0	0	0	0	119.3	Y352 D353 A354	S350-Y352 PolarHBondContact O-N 2.9Å; S350-Y352 PolarHBondContact OG-N 3.42Å; S350-Y352 VanDerWaalsContact OG-N 3.16Å; S350-D353 WeakPolarHBondContact CB-OD2 3.47Å; S350-D353 PolarHBondContact O-N 2.88Å; S350-D353 PolarHBondContact OG-N 2.71Å; S350-D353 PolarHBondContact OG-OD2 2.91Å; S350-A354 PolarHBondContact O-N 2.85Å; S350-A354 VanDerWaalsContact O-N 3.15Å
351	D	63.4	Low	68.3	Low	130 Å²	130	77.2 Å²	77.2	70%	0.695	44%	0.436	S	S	*	.	H	α-helix	trans	-57.9	-23	170.7	-92.6	28.1	0	0	0	113.7	R355	D351-R355 VanDerWaalsContact O-CD 3.32Å; D351-R355 WeakPolarHBondContact O-CD 3.48Å; D351-R355 VanDerWaalsContact O-CG 3.24Å; D351-R355 WeakPolarHBondContact O-CG 3.26Å; D351-R355 PolarHBondContact O-NE 2.96Å
352	Y	67.9	Low	67.7	Low	144 Å²	144	76.2 Å²	76.2	57%	0.565	44%	0.436	S	S	*	.	H	α-helix	trans	-79.5	-45.3	-179.3	178	-98.1	0	0	0	110.8	S350 R355 I356	S350-Y352 PolarHBondContact O-N 2.9Å; S350-Y352 PolarHBondContact OG-N 3.42Å; S350-Y352 VanDerWaalsContact OG-N 3.16Å; Y352-R355 PolarHBondContact O-N 3.31Å; Y352-I356 HydrophobicContact CD1-CD1 4.14Å; Y352-I356 HydrophobicContact CE1-CD1 3.59Å; Y352-I356 PolarHBondContact O-N 3.48Å
353	D	69	Low	67.7	Low	37 Å²	37	75.3 Å²	75.3	20%	0.198	43%	0.433	C	S	.	.	H	α-helix	trans	-72.6	-38.8	-177	-54.2	-53.2	0	0	0	110.4	F342 S350 R355 I356 V357	F342-D353 HydrophobicContact CD1-CB 4.22Å; F342-D353 HydrophobicContact CD2-CB 4.43Å; F342-D353 HydrophobicContact CE1-CB 3.82Å; F342-D353 WeakPolarHBondContact CE1-OD1 3.41Å; F342-D353 HydrophobicContact CE2-CB 4.03Å; F342-D353 HydrophobicContact CZ-CB 3.72Å; S350-D353 WeakPolarHBondContact CB-OD2 3.47Å; S350-D353 PolarHBondContact O-N 2.88Å; S350-D353 PolarHBondContact OG-N 2.71Å; S350-D353 PolarHBondContact OG-OD2 2.91Å; D353-R355 VanDerWaalsContact C-N 3.3Å; D353-R355 PolarHBondContact O-N 2.87Å; D353-I356 WeakPolarHBondContact O-CB 3.4Å; D353-I356 PolarHBondContact O-N 2.88Å; D353-V357 WeakPolarHBondContact O-CG2 3.32Å; D353-V357 PolarHBondContact O-N 3.14Å
354	A	62.8	Low	67.5	Low	59 Å²	59	75.1 Å²	75.1	49%	0.488	43%	0.434	S	S	.	.	H	α-helix	trans	-54.2	-41.8	171.8	0	0	0	0	0	113.3	S350 I356 V357 E358	S350-A354 PolarHBondContact O-N 2.85Å; S350-A354 VanDerWaalsContact O-N 3.15Å; A354-I356 VanDerWaalsContact C-N 3.3Å; A354-I356 PolarHBondContact O-N 2.72Å; A354-V357 PolarHBondContact O-N 3.4Å; A354-E358 WeakPolarHBondContact O-CB 3.09Å; A354-E358 PolarHBondContact O-N 2.93Å
355	R	69	Low	67.6	Low	166 Å²	166	79.4 Å²	79.4	63%	0.626	46%	0.457	S	S	*	.	H	α-helix	trans	-66	-31.8	176.9	-71.9	169.5	-171.6	-155.1	2.6	112.8	D351 Y352 D353 T359	D351-R355 VanDerWaalsContact O-CD 3.32Å; D351-R355 WeakPolarHBondContact O-CD 3.48Å; D351-R355 VanDerWaalsContact O-CG 3.24Å; D351-R355 WeakPolarHBondContact O-CG 3.26Å; D351-R355 PolarHBondContact O-NE 2.96Å; Y352-R355 PolarHBondContact O-N 3.31Å; D353-R355 VanDerWaalsContact C-N 3.3Å; D353-R355 PolarHBondContact O-N 2.87Å; R355-T359 VanDerWaalsContact O-CB 3.26Å; R355-T359 WeakPolarHBondContact O-CB 3.25Å; R355-T359 PolarHBondContact O-N 3.4Å; R355-T359 PolarHBondContact O-OG1 3.37Å
356	I	72.4	Confident	68.2	Low	6 Å²	6	79 Å²	79	3%	0.031	45%	0.446	C	S	.	.	H	α-helix	trans	-71.3	-49	173.8	-64	171.8	0	0	0	108.9	Q337 F342 Y352 D353 A354 E358 T359 W360	Q337-I356 HydrophobicContact CB-CG2 4.46Å; Q337-I356 HydrophobicContact CG-CD1 4.17Å; Q337-I356 HydrophobicContact CG-CG1 4.32Å; F342-I356 HydrophobicContact CE2-CG2 4.47Å; F342-I356 HydrophobicContact CZ-CB 4.06Å; F342-I356 HydrophobicContact CZ-CD1 4.08Å; F342-I356 HydrophobicContact CZ-CG2 4.05Å; Y352-I356 HydrophobicContact CD1-CD1 4.14Å; Y352-I356 HydrophobicContact CE1-CD1 3.59Å; Y352-I356 PolarHBondContact O-N 3.48Å; D353-I356 WeakPolarHBondContact O-CB 3.4Å; D353-I356 PolarHBondContact O-N 2.88Å; A354-I356 VanDerWaalsContact C-N 3.3Å; A354-I356 PolarHBondContact O-N 2.72Å; I356-E358 PolarHBondContact O-N 3.09Å; I356-T359 PolarHBondContact O-N 2.62Å; I356-T359 VanDerWaalsContact O-N 3.13Å; I356-W360 HydrophobicContact CG2-CG 4.45Å; I356-W360 WeakPolarHBondContact O-CB 3.42Å; I356-W360 PolarHBondContact O-N 3.45Å
357	V	70.2	Confident	69	Low	36 Å²	36	76.2 Å²	76.2	22%	0.218	43%	0.425	C	S	.	.	H	α-helix	trans	-55.6	-49.1	178.6	173.6	0	0	0	0	112.3	F342 W344 D353 A354 T359 W360 T361	F342-V357 HydrophobicContact CD2-CG2 4.42Å; F342-V357 HydrophobicContact CE2-CG2 3.89Å; W344-V357 HydrophobicContact CB-CG2 4.3Å; W344-V357 VanDerWaalsContact O-CG1 3.23Å; W344-V357 WeakPolarHBondContact O-CG1 3.25Å; D353-V357 WeakPolarHBondContact O-CG2 3.32Å; D353-V357 PolarHBondContact O-N 3.14Å; A354-V357 PolarHBondContact O-N 3.4Å; V357-T359 VanDerWaalsContact C-N 3.31Å; V357-T359 PolarHBondContact O-N 3.05Å; V357-W360 PolarHBondContact O-N 3.12Å; V357-T361 HydrophobicContact CG1-CG2 3.83Å; V357-T361 WeakPolarHBondContact O-CB 3.25Å; V357-T361 WeakPolarHBondContact O-CG2 3.45Å; V357-T361 PolarHBondContact O-N 3.45Å; V357-T361 VanDerWaalsContact O-N 3.1Å; V357-T361 PolarHBondContact O-OG1 3.19Å
358	E	67.3	Low	70.2	Confident	153 Å²	153	71.4 Å²	71.4	72%	0.715	39%	0.392	S	S	*	.	H	α-helix	trans	-60.1	-40	177.7	-173.8	-174.3	-171.1	0	0	112.2	A354 I356	A354-E358 WeakPolarHBondContact O-CB 3.09Å; A354-E358 PolarHBondContact O-N 2.93Å; I356-E358 PolarHBondContact O-N 3.09Å
359	T	70.4	Confident	71.6	Confident	62 Å²	62	67.3 Å²	67.3	38%	0.38	37%	0.373	S	S	.	.	H	α-helix	trans	-69.8	-33	-177.9	-66.1	0	0	0	0	112.7	H326 R355 I356 V357	H326-T359 WeakPolarHBondContact CE1-CG2 3.17Å; H326-T359 PolarHBondContact CE1-O 2.82Å; R355-T359 VanDerWaalsContact O-CB 3.26Å; R355-T359 WeakPolarHBondContact O-CB 3.25Å; R355-T359 PolarHBondContact O-N 3.4Å; R355-T359 PolarHBondContact O-OG1 3.37Å; I356-T359 PolarHBondContact O-N 2.62Å; I356-T359 VanDerWaalsContact O-N 3.13Å; V357-T359 VanDerWaalsContact C-N 3.31Å; V357-T359 PolarHBondContact O-N 3.05Å
360	W	76.5	Confident	72.9	Confident	1 Å²	1	63.4 Å²	63.4	0%	0.004	34%	0.344	C	S	.	.	H	α-helix	trans	-107.3	-29.7	-164.1	-79.8	85.3	0	0	0	115.4	H326 L334 Q337 L338 W344 I356 V357 V363 A364 F367	H326-W360 AromaticContact CD2-CE2 3.95Å; H326-W360 AromaticContact CD2-CZ2 3.95Å; H326-W360 AromaticContact NE2-CD2 3.88Å; H326-W360 AromaticContact NE2-CE2 3.87Å; L334-W360 HydrophobicContact CD2-CZ2 4.28Å; Q337-W360 HydrophobicContact CB-CZ2 3.77Å; L338-W360 HydrophobicContact CD1-CH2 3.85Å; L338-W360 HydrophobicContact CD1-CZ3 4.32Å; L338-W360 HydrophobicContact CD2-CE3 4.34Å; L338-W360 HydrophobicContact CD2-CH2 3.72Å; L338-W360 HydrophobicContact CD2-CZ3 3.5Å; L338-W360 HydrophobicContact CG-CH2 3.51Å; L338-W360 HydrophobicContact CG-CZ2 4.33Å; L338-W360 HydrophobicContact CG-CZ3 3.88Å; W344-W360 HydrophobicContact CD2-CB 4.26Å; W344-W360 HydrophobicContact CE3-CB 4.04Å; W344-W360 HydrophobicContact CH2-CB 3.89Å; W344-W360 AromaticContact CH2-CD2 3.6Å; W344-W360 HydrophobicContact CH2-CD2 3.6Å; W344-W360 AromaticContact CH2-CE3 3.22Å; W344-W360 HydrophobicContact CH2-CE3 3.22Å; W344-W360 AromaticContact CH2-CG 3.93Å; W344-W360 HydrophobicContact CH2-CG 3.93Å; W344-W360 AromaticContact CH2-CZ3 3.8Å; W344-W360 HydrophobicContact CH2-CZ3 3.8Å; W344-W360 HydrophobicContact CZ2-CB 4.1Å; W344-W360 AromaticContact CZ2-CD2 3.91Å; W344-W360 HydrophobicContact CZ2-CD2 3.91Å; W344-W360 AromaticContact CZ2-CE3 3.98Å; W344-W360 HydrophobicContact CZ2-CE3 3.98Å; W344-W360 AromaticContact CZ2-CG 4Å; W344-W360 HydrophobicContact CZ2-CG 4Å; W344-W360 HydrophobicContact CZ3-CB 3.86Å; W344-W360 HydrophobicContact CZ3-CD2 4.32Å; W344-W360 AromaticContact CZ3-CE3 3.85Å; W344-W360 HydrophobicContact CZ3-CE3 3.85Å; W344-W360 HydrophobicContact CZ3-CG 4.39Å; I356-W360 HydrophobicContact CG2-CG 4.45Å; I356-W360 WeakPolarHBondContact O-CB 3.42Å; I356-W360 PolarHBondContact O-N 3.45Å; V357-W360 PolarHBondContact O-N 3.12Å; W360-V363 PolarHBondContact O-N 3.03Å; W360-A364 PolarHBondContact O-N 3.36Å; W360-F367 HydrophobicContact CE3-CE1 4.24Å; W360-F367 HydrophobicContact CE3-CZ 4.46Å; W360-F367 HydrophobicContact CH2-CD1 4.26Å; W360-F367 AromaticContact CH2-CE1 3.24Å; W360-F367 HydrophobicContact CH2-CE1 3.24Å; W360-F367 HydrophobicContact CH2-CE2 4.41Å; W360-F367 AromaticContact CH2-CZ 3.27Å; W360-F367 HydrophobicContact CH2-CZ 3.27Å; W360-F367 HydrophobicContact CZ2-CE1 4.45Å; W360-F367 HydrophobicContact CZ2-CZ 4.13Å; W360-F367 AromaticContact CZ3-CD1 3.67Å; W360-F367 HydrophobicContact CZ3-CD1 3.67Å; W360-F367 AromaticContact CZ3-CE1 3.09Å; W360-F367 HydrophobicContact CZ3-CE1 3.09Å; W360-F367 HydrophobicContact CZ3-CE2 4.42Å; W360-F367 AromaticContact CZ3-CZ 3.46Å; W360-F367 HydrophobicContact CZ3-CZ 3.46Å; W360-F367 VanDerWaalsContact CZ3-CZ 3.46Å
361	T	67.7	Low	73.9	Confident	75 Å²	75	60.6 Å²	60.6	46%	0.46	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-44.8	-169.6	37.3	0	0	0	0	115.9	W344 V357 V363	W344-T361 HydrophobicContact CB-CG2 4.2Å; V357-T361 HydrophobicContact CG1-CG2 3.83Å; V357-T361 WeakPolarHBondContact O-CB 3.25Å; V357-T361 WeakPolarHBondContact O-CG2 3.45Å; V357-T361 PolarHBondContact O-N 3.45Å; V357-T361 VanDerWaalsContact O-N 3.1Å; V357-T361 PolarHBondContact O-OG1 3.19Å; T361-V363 VanDerWaalsContact C-N 3.28Å; T361-V363 PolarHBondContact O-N 2.98Å
362	P	68	Low	75	Confident	107 Å²	107	58.6 Å²	58.6	70%	0.695	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-3.6	176.8	32.4	-33	0	0	0	113.5
363	V	78.4	Confident	75.9	Confident	15 Å²	15	54 Å²	54	9%	0.091	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	-34.9	-164.2	176.7	0	0	0	0	113.1	V324 W360 T361 L365 S366 F367	V324-V363 HydrophobicContact CB-CG1 4.35Å; V324-V363 HydrophobicContact CG1-CG1 4.16Å; W360-V363 PolarHBondContact O-N 3.03Å; T361-V363 VanDerWaalsContact C-N 3.28Å; T361-V363 PolarHBondContact O-N 2.98Å; V363-L365 VanDerWaalsContact C-N 3.28Å; V363-L365 PolarHBondContact O-N 3.09Å; V363-S366 CarbonylContact O-C 3.57Å; V363-S366 WeakPolarHBondContact O-CA 3.31Å; V363-S366 PolarHBondContact O-N 3.37Å; V363-S366 PolarHBondContact O-OG 2.95Å; V363-F367 HydrophobicContact CG1-CB 4.06Å; V363-F367 HydrophobicContact CG1-CD2 4.26Å; V363-F367 WeakPolarHBondContact O-CB 3.31Å; V363-F367 PolarHBondContact O-N 3.36Å
364	A	74.1	Confident	76.6	Confident	18 Å²	18	52.5 Å²	52.5	15%	0.149	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.7	-30.9	-163.3	0	0	0	0	0	118.2	W344 W360 F367 L401	W344-A364 HydrophobicContact CZ3-CB 4.27Å; W360-A364 PolarHBondContact O-N 3.36Å; A364-F367 CarbonylContact O-C 3.45Å; A364-F367 WeakPolarHBondContact O-CB 3.22Å; A364-L401 HydrophobicContact CB-CD1 4.26Å
365	L	77.6	Confident	77.6	Confident	106 Å²	106	50 Å²	50	56%	0.555	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-28.1	176.4	179.7	58.4	0	0	0	114.3	V363 F367 Y368 L401	V363-L365 VanDerWaalsContact C-N 3.28Å; V363-L365 PolarHBondContact O-N 3.09Å; L365-F367 PolarHBondContact O-N 3.2Å; L365-F367 VanDerWaalsContact O-N 3.08Å; L365-Y368 PolarHBondContact O-N 2.96Å; L365-L401 HydrophobicContact CB-CD2 4.5Å; L365-L401 HydrophobicContact CD1-CD2 3.99Å
366	S	80.4	Confident	78.4	Confident	51 Å²	51	44.3 Å²	44.3	36%	0.357	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	0.5	156.6	69.6	0	0	0	0	112.4	F284 V324 V363	F284-S366 CarbonylContact O-C 3.52Å; F284-S366 WeakPolarHBondContact O-CA 3.45Å; V324-S366 WeakPolarHBondContact CG1-O 3.28Å; V363-S366 CarbonylContact O-C 3.57Å; V363-S366 WeakPolarHBondContact O-CA 3.31Å; V363-S366 PolarHBondContact O-N 3.37Å; V363-S366 PolarHBondContact O-OG 2.95Å
367	F	83	Confident	78.9	Confident	1 Å²	1	46.5 Å²	46.5	0%	0.004	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	29.2	169.5	-158.5	-100.9	0	0	0	110.2	F282 S283 F284 V324 H326 L338 W360 V363 A364 L365 A397	F282-F367 VanDerWaalsContact CA-CZ 3.41Å; F282-F367 HydrophobicContact CB-CZ 4.38Å; F282-F367 AromaticContact CD1-CE2 3.65Å; F282-F367 HydrophobicContact CD1-CE2 3.65Å; F282-F367 AromaticContact CD1-CZ 3.64Å; F282-F367 HydrophobicContact CD1-CZ 3.64Å; F282-F367 HydrophobicContact CE1-CE2 4.36Å; F282-F367 HydrophobicContact CG-CZ 4.47Å; S283-F367 VanDerWaalsContact C-CA 3.44Å; S283-F367 CarbonylContact C-O 3.4Å; S283-F367 WeakPolarHBondContact CA-O 3.42Å; S283-F367 WeakPolarHBondContact CB-O 3.44Å; F284-F367 VanDerWaalsContact N-CA 3.34Å; F284-F367 PolarHBondContact N-O 2.7Å; F284-F367 PolarHBondContact O-N 3.45Å; V324-F367 WeakPolarHBondContact O-CD2 3.46Å; V324-F367 WeakPolarHBondContact O-CE2 3.48Å; H326-F367 AromaticContact CD2-CE2 3.61Å; H326-F367 AromaticContact CD2-CZ 3.88Å; L338-F367 HydrophobicContact CD1-CE1 4.38Å; W360-F367 HydrophobicContact CE3-CE1 4.24Å; W360-F367 HydrophobicContact CE3-CZ 4.46Å; W360-F367 HydrophobicContact CH2-CD1 4.26Å; W360-F367 AromaticContact CH2-CE1 3.24Å; W360-F367 HydrophobicContact CH2-CE1 3.24Å; W360-F367 HydrophobicContact CH2-CE2 4.41Å; W360-F367 AromaticContact CH2-CZ 3.27Å; W360-F367 HydrophobicContact CH2-CZ 3.27Å; W360-F367 HydrophobicContact CZ2-CE1 4.45Å; W360-F367 HydrophobicContact CZ2-CZ 4.13Å; W360-F367 AromaticContact CZ3-CD1 3.67Å; W360-F367 HydrophobicContact CZ3-CD1 3.67Å; W360-F367 AromaticContact CZ3-CE1 3.09Å; W360-F367 HydrophobicContact CZ3-CE1 3.09Å; W360-F367 HydrophobicContact CZ3-CE2 4.42Å; W360-F367 AromaticContact CZ3-CZ 3.46Å; W360-F367 HydrophobicContact CZ3-CZ 3.46Å; W360-F367 VanDerWaalsContact CZ3-CZ 3.46Å; V363-F367 HydrophobicContact CG1-CB 4.06Å; V363-F367 HydrophobicContact CG1-CD2 4.26Å; V363-F367 WeakPolarHBondContact O-CB 3.31Å; V363-F367 PolarHBondContact O-N 3.36Å; A364-F367 CarbonylContact O-C 3.45Å; A364-F367 WeakPolarHBondContact O-CB 3.22Å; L365-F367 PolarHBondContact O-N 3.2Å; L365-F367 VanDerWaalsContact O-N 3.08Å; F367-A397 HydrophobicContact CD1-CB 4.05Å; F367-A397 HydrophobicContact CE1-CB 4.37Å
368	Y	82.6	Confident	79.5	Confident	43 Å²	43	44.8 Å²	44.8	17%	0.169	25%	0.253	C	S	.	.	S	Bend	trans	-143.5	14.6	166.1	-161.3	-99.3	0	0	0	119.5	F284 L365 A394 A397 L398	F284-Y368 WeakPolarHBondContact CD1-O 3.29Å; F284-Y368 AromaticContact CD2-CD2 3.68Å; F284-Y368 HydrophobicContact CD2-CD2 3.68Å; F284-Y368 AromaticContact CD2-CE2 3.68Å; F284-Y368 HydrophobicContact CD2-CE2 3.68Å; F284-Y368 HydrophobicContact CD2-CG 4.14Å; F284-Y368 WeakPolarHBondContact CD2-O 3.38Å; F284-Y368 HydrophobicContact CE2-CD1 4.43Å; F284-Y368 AromaticContact CE2-CD2 3.59Å; F284-Y368 HydrophobicContact CE2-CD2 3.59Å; F284-Y368 AromaticContact CE2-CE1 3.98Å; F284-Y368 HydrophobicContact CE2-CE1 3.98Å; F284-Y368 AromaticContact CE2-CE2 3.06Å; F284-Y368 HydrophobicContact CE2-CE2 3.06Å; F284-Y368 HydrophobicContact CE2-CG 4.2Å; F284-Y368 AromaticContact CE2-CZ 3.23Å; F284-Y368 WeakPolarHBondContact CE2-O 3.36Å; F284-Y368 WeakPolarHBondContact CE2-OH 3.32Å; F284-Y368 WeakPolarHBondContact CG-O 3.34Å; F284-Y368 HydrophobicContact CZ-CE1 4.09Å; F284-Y368 AromaticContact CZ-CE2 3.89Å; F284-Y368 HydrophobicContact CZ-CE2 3.89Å; F284-Y368 AromaticContact CZ-CZ 3.54Å; F284-Y368 WeakPolarHBondContact CZ-OH 3.24Å; F284-Y368 VanDerWaalsContact N-CA 3.34Å; F284-Y368 PolarHBondContact O-N 2.81Å; L365-Y368 PolarHBondContact O-N 2.96Å; Y368-A394 WeakPolarHBondContact CE2-O 3.28Å; Y368-A397 HydrophobicContact CD2-CB 4.32Å; Y368-L398 HydrophobicContact CD1-CD1 3.97Å; Y368-L398 HydrophobicContact CD2-CB 3.9Å; Y368-L398 HydrophobicContact CE1-CB 4.45Å; Y368-L398 HydrophobicContact CE1-CD1 3.69Å; Y368-L398 HydrophobicContact CE1-CD2 4.41Å; Y368-L398 HydrophobicContact CE1-CG 4.39Å; Y368-L398 HydrophobicContact CE2-CB 3.47Å; Y368-L398 VanDerWaalsContact CE2-CB 3.47Å; Y368-L398 HydrophobicContact CE2-CD1 4.27Å; Y368-L398 HydrophobicContact CE2-CD2 4.35Å; Y368-L398 HydrophobicContact CE2-CG 4.22Å; Y368-L398 HydrophobicContact CG-CD1 4.48Å
369	S	84.5	Confident	80.3	Confident	37 Å²	37	41.4 Å²	41.4	26%	0.259	24%	0.238	S	C	.	.	B	Isolated β-bridge	trans	-123.5	0	167.5	39.1	0	0	0	0	132.9	F284 D285 F373	F284-S369 WeakPolarHBondContact CD1-O 3.26Å; F284-S369 WeakPolarHBondContact O-CA 3.29Å; F284-S369 PolarHBondContact O-N 3.06Å; D285-S369 VanDerWaalsContact CA-CB 3.46Å; D285-S369 WeakPolarHBondContact CA-O 3.15Å; D285-S369 WeakPolarHBondContact CA-OG 3.44Å; D285-S369 VanDerWaalsContact CB-OG 3.22Å; D285-S369 WeakPolarHBondContact CB-OG 3.27Å; D285-S369 PolarHBondContact N-OG 3.19Å; D285-S369 WeakPolarHBondContact OD1-CB 3.43Å; S369-F373 WeakPolarHBondContact O-CD2 3.49Å; S369-F373 WeakPolarHBondContact O-CE2 3.45Å
370	T	82.3	Confident	80.9	Confident	21 Å²	21	42.6 Å²	42.6	13%	0.129	25%	0.246	C	C	.	.	S	Bend		0	-102.1	0	-106.2	0	0	0	0	125.2	F284 D285 F372 F373 L374	F284-T370 VanDerWaalsContact CA-CB 3.48Å; D285-T370 VanDerWaalsContact C-CA 3.5Å; D285-T370 VanDerWaalsContact C-OG1 3.26Å; D285-T370 VanDerWaalsContact CA-CA 3.45Å; D285-T370 VanDerWaalsContact CA-CB 3.42Å; D285-T370 WeakPolarHBondContact O-CB 3.5Å; D285-T370 PolarHBondContact O-OG1 3.27Å; T370-F372 CarbonylContact O-C 3.05Å; T370-F372 PolarHBondContact O-N 3.26Å; T370-F372 VanDerWaalsContact O-N 3.16Å; T370-F373 VanDerWaalsContact N-CD2 3.33Å; T370-F373 CarbonylContact O-C 3.38Å; T370-F373 VanDerWaalsContact O-C 3.24Å; T370-F373 WeakPolarHBondContact O-CA 3.25Å; T370-F373 WeakPolarHBondContact O-CB 3.39Å; T370-F373 PolarHBondContact O-N 2.91Å; T370-L374 HydrophobicContact CG2-CD1 4.25Å; T370-L374 PolarHBondContact O-N 3.26Å
371	L	85	Confident	81.2	Confident	4 Å²	4	42.8 Å²	42.8	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-64	-20.1	-176.1	-176.7	141.6	0	0	0	113.5	P173 F282 S283 F373 L374 T375 L393	P173-L371 HydrophobicContact CB-CD1 3.73Å; P173-L371 HydrophobicContact CB-CD2 3.9Å; P173-L371 HydrophobicContact CB-CG 3.74Å; P173-L371 HydrophobicContact CG-CD1 4.24Å; P173-L371 HydrophobicContact CG-CG 4.12Å; F282-L371 HydrophobicContact CB-CD1 3.77Å; F282-L371 HydrophobicContact CB-CD2 3.94Å; F282-L371 HydrophobicContact CB-CG 4.42Å; F282-L371 HydrophobicContact CD2-CD1 3.55Å; F282-L371 HydrophobicContact CE2-CD1 4.25Å; F282-L371 HydrophobicContact CG-CD1 3.75Å; S283-L371 WeakPolarHBondContact O-CB 3.31Å; S283-L371 PolarHBondContact O-N 3.43Å; L371-F373 VanDerWaalsContact C-N 3.33Å; L371-L374 HydrophobicContact CB-CB 4.48Å; L371-L374 HydrophobicContact CB-CD1 4.09Å; L371-L374 HydrophobicContact CD1-CD1 4.36Å; L371-L374 HydrophobicContact CG-CB 4.41Å; L371-L374 HydrophobicContact CG-CD1 4.34Å; L371-L374 CarbonylContact O-C 3.37Å; L371-L374 PolarHBondContact O-N 2.75Å; L371-T375 WeakPolarHBondContact O-CA 3.43Å; L371-T375 WeakPolarHBondContact O-CB 3.46Å; L371-T375 PolarHBondContact O-N 3.32Å; L371-T375 PolarHBondContact O-OG1 3.32Å; L371-L393 HydrophobicContact CD2-CD1 4.14Å
372	F	84.9	Confident	82	Confident	88 Å²	88	41 Å²	41	39%	0.386	24%	0.236	S	C	.	.	H	α-helix	trans	-60.2	-39	157.9	171.2	-94.8	0	0	0	112.6	F284 T370 A376 F432	F284-F372 HydrophobicContact CB-CB 3.84Å; F284-F372 HydrophobicContact CD1-CB 3.05Å; F284-F372 AromaticContact CD1-CD1 3.6Å; F284-F372 HydrophobicContact CD1-CD1 3.6Å; F284-F372 HydrophobicContact CD1-CD2 4.43Å; F284-F372 AromaticContact CD1-CG 3.52Å; F284-F372 HydrophobicContact CD1-CG 3.52Å; F284-F372 HydrophobicContact CD2-CB 3.6Å; F284-F372 HydrophobicContact CD2-CG 4.45Å; F284-F372 HydrophobicContact CE1-CB 3.32Å; F284-F372 AromaticContact CE1-CD1 3.29Å; F284-F372 HydrophobicContact CE1-CD1 3.29Å; F284-F372 AromaticContact CE1-CD2 3.8Å; F284-F372 HydrophobicContact CE1-CD2 3.8Å; F284-F372 AromaticContact CE1-CE1 3.9Å; F284-F372 HydrophobicContact CE1-CE1 3.9Å; F284-F372 HydrophobicContact CE1-CE2 4.34Å; F284-F372 AromaticContact CE1-CG 3.23Å; F284-F372 HydrophobicContact CE1-CG 3.23Å; F284-F372 HydrophobicContact CE1-CZ 4.37Å; F284-F372 HydrophobicContact CE2-CB 3.67Å; F284-F372 HydrophobicContact CE2-CD2 4.18Å; F284-F372 HydrophobicContact CE2-CG 4.08Å; F284-F372 HydrophobicContact CG-CB 3.35Å; F284-F372 HydrophobicContact CG-CG 4.26Å; F284-F372 HydrophobicContact CZ-CB 3.62Å; F284-F372 HydrophobicContact CZ-CD1 4.03Å; F284-F372 AromaticContact CZ-CD2 3.64Å; F284-F372 HydrophobicContact CZ-CD2 3.64Å; F284-F372 HydrophobicContact CZ-CE2 4.19Å; F284-F372 AromaticContact CZ-CG 3.54Å; F284-F372 HydrophobicContact CZ-CG 3.54Å; T370-F372 CarbonylContact O-C 3.05Å; T370-F372 PolarHBondContact O-N 3.26Å; T370-F372 VanDerWaalsContact O-N 3.16Å; F372-A376 WeakPolarHBondContact O-CB 3.44Å; F372-A376 PolarHBondContact O-N 3.18Å; F372-F432 HydrophobicContact CD2-CZ 4.37Å; F372-F432 HydrophobicContact CE2-CZ 4.3Å
373	F	87	Confident	82.9	Confident	47 Å²	47	35.9 Å²	35.9	21%	0.206	20%	0.203	C	C	.	.	H	α-helix	trans	-70.1	-44.1	165.4	-59.5	-46.7	0	0	0	113.1	T286 P287 S369 T370 L371 T375 A376 I377	T286-F373 VanDerWaalsContact C-CE2 3.41Å; T286-F373 VanDerWaalsContact CA-CE2 3.41Å; T286-F373 WeakPolarHBondContact O-CD2 3.37Å; P287-F373 HydrophobicContact CB-CD1 4.16Å; P287-F373 HydrophobicContact CB-CD2 4.39Å; P287-F373 HydrophobicContact CB-CE1 3.89Å; P287-F373 HydrophobicContact CB-CE2 4.13Å; P287-F373 HydrophobicContact CB-CG 4.44Å; P287-F373 HydrophobicContact CB-CZ 3.91Å; P287-F373 HydrophobicContact CG-CE1 3.91Å; P287-F373 HydrophobicContact CG-CE2 3.87Å; P287-F373 HydrophobicContact CG-CZ 3.51Å; S369-F373 WeakPolarHBondContact O-CD2 3.49Å; S369-F373 WeakPolarHBondContact O-CE2 3.45Å; T370-F373 VanDerWaalsContact N-CD2 3.33Å; T370-F373 CarbonylContact O-C 3.38Å; T370-F373 VanDerWaalsContact O-C 3.24Å; T370-F373 WeakPolarHBondContact O-CA 3.25Å; T370-F373 WeakPolarHBondContact O-CB 3.39Å; T370-F373 PolarHBondContact O-N 2.91Å; L371-F373 VanDerWaalsContact C-N 3.33Å; F373-T375 PolarHBondContact O-N 3.04Å; F373-A376 PolarHBondContact O-N 2.87Å; F373-I377 WeakPolarHBondContact O-CB 3.43Å; F373-I377 WeakPolarHBondContact O-CD1 3.44Å; F373-I377 WeakPolarHBondContact O-CG1 3.23Å; F373-I377 PolarHBondContact O-N 2.94Å
374	L	84.1	Confident	83.4	Confident	6 Å²	6	35.2 Å²	35.2	3%	0.031	20%	0.199	C	C	.	.	H	α-helix	trans	-58.8	-35.9	172.8	-58.1	170.8	0	0	0	110.7	P173 V312 V315 T325 T370 L371 C378	P173-L374 HydrophobicContact CG-CB 3.87Å; V312-L374 HydrophobicContact CG2-CD2 4.09Å; V315-L374 HydrophobicContact CB-CD2 4.19Å; V315-L374 HydrophobicContact CG1-CD1 4.03Å; V315-L374 HydrophobicContact CG1-CD2 4.08Å; V315-L374 HydrophobicContact CG2-CD2 4.38Å; T325-L374 HydrophobicContact CG2-CD1 4.47Å; T370-L374 HydrophobicContact CG2-CD1 4.25Å; T370-L374 PolarHBondContact O-N 3.26Å; L371-L374 HydrophobicContact CB-CB 4.48Å; L371-L374 HydrophobicContact CB-CD1 4.09Å; L371-L374 HydrophobicContact CD1-CD1 4.36Å; L371-L374 HydrophobicContact CG-CB 4.41Å; L371-L374 HydrophobicContact CG-CD1 4.34Å; L371-L374 CarbonylContact O-C 3.37Å; L371-L374 PolarHBondContact O-N 2.75Å; L374-C378 WeakPolarHBondContact O-CB 3.4Å; L374-C378 PolarHBondContact O-N 2.83Å; L374-C378 PolarHBondContact O-SG 2.94Å
375	T	84.4	Confident	84	Confident	8 Å²	8	34.8 Å²	34.8	5%	0.049	20%	0.195	C	C	.	.	H	α-helix	trans	-70.4	-51.7	174.3	-70.8	0	0	0	0	110.3	L371 F373 I377 C378 I379 L387 P390	L371-T375 WeakPolarHBondContact O-CA 3.43Å; L371-T375 WeakPolarHBondContact O-CB 3.46Å; L371-T375 PolarHBondContact O-N 3.32Å; L371-T375 PolarHBondContact O-OG1 3.32Å; F373-T375 PolarHBondContact O-N 3.04Å; T375-I377 PolarHBondContact O-N 3.4Å; T375-C378 CarbonylContact O-C 3.41Å; T375-C378 PolarHBondContact O-N 2.92Å; T375-I379 HydrophobicContact CG2-CD1 3.83Å; T375-I379 HydrophobicContact CG2-CG1 4.34Å; T375-I379 WeakPolarHBondContact O-CD1 3.3Å; T375-I379 WeakPolarHBondContact O-CG1 3.46Å; T375-I379 PolarHBondContact O-N 3.11Å; T375-L387 HydrophobicContact CG2-CD1 4.03Å; T375-P390 HydrophobicContact CG2-CB 3.65Å; T375-P390 HydrophobicContact CG2-CG 4.11Å; T375-P390 WeakPolarHBondContact OG1-CB 3.49Å
376	A	84.8	Confident	84.5	Confident	45 Å²	45	30 Å²	30	37%	0.372	17%	0.171	S	C	.	.	H	α-helix	trans	-54.8	-44.6	175.6	0	0	0	0	0	110.9	F372 F373 T380	F372-A376 WeakPolarHBondContact O-CB 3.44Å; F372-A376 PolarHBondContact O-N 3.18Å; F373-A376 PolarHBondContact O-N 2.87Å; A376-T380 WeakPolarHBondContact O-CG2 3.2Å; A376-T380 PolarHBondContact O-N 3.05Å
377	I	82.7	Confident	84.9	Confident	53 Å²	53	28.3 Å²	28.3	27%	0.272	16%	0.158	S	C	.	.	H	α-helix	trans	-62.2	-49.3	172.4	-72.2	163.1	0	0	0	110.6	V308 F373 T375 I379 T380	V308-I377 HydrophobicContact CB-CG2 4.27Å; V308-I377 HydrophobicContact CG1-CG2 3.28Å; V308-I377 HydrophobicContact CG2-CG2 4.04Å; F373-I377 WeakPolarHBondContact O-CB 3.43Å; F373-I377 WeakPolarHBondContact O-CD1 3.44Å; F373-I377 WeakPolarHBondContact O-CG1 3.23Å; F373-I377 PolarHBondContact O-N 2.94Å; T375-I377 PolarHBondContact O-N 3.4Å; I377-I379 VanDerWaalsContact C-N 3.32Å; I377-I379 PolarHBondContact O-N 3.08Å; I377-T380 WeakPolarHBondContact O-CB 3.49Å; I377-T380 PolarHBondContact O-N 3.44Å; I377-T380 PolarHBondContact O-OG1 3.01Å
378	C	83.4	Confident	85.3	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-67.7	-25.7	-179.4	-75	0	0	0	0	114.1	I174 L374 T375 T380 L381	I174-C378 HydrophobicContact CG2-CB 3.88Å; L374-C378 WeakPolarHBondContact O-CB 3.4Å; L374-C378 PolarHBondContact O-N 2.83Å; L374-C378 PolarHBondContact O-SG 2.94Å; T375-C378 CarbonylContact O-C 3.41Å; T375-C378 PolarHBondContact O-N 2.92Å; C378-T380 VanDerWaalsContact C-N 3.27Å; C378-T380 PolarHBondContact O-N 3.37Å; C378-L381 HydrophobicContact CB-CD1 4.18Å; C378-L381 VanDerWaalsContact O-CB 3.31Å; C378-L381 WeakPolarHBondContact O-CB 3.36Å; C378-L381 PolarHBondContact O-N 3.46Å
379	I	83.9	Confident	85.6	Confident	81 Å²	81	27 Å²	27	42%	0.415	15%	0.154	S	C	.	.	H	α-helix	trans	-67.9	-29.9	171.3	-63.8	156.9	0	0	0	110.7	T375 I377 L381 L387	T375-I379 HydrophobicContact CG2-CD1 3.83Å; T375-I379 HydrophobicContact CG2-CG1 4.34Å; T375-I379 WeakPolarHBondContact O-CD1 3.3Å; T375-I379 WeakPolarHBondContact O-CG1 3.46Å; T375-I379 PolarHBondContact O-N 3.11Å; I377-I379 VanDerWaalsContact C-N 3.32Å; I377-I379 PolarHBondContact O-N 3.08Å; I379-L381 PolarHBondContact O-N 3.08Å; I379-L387 HydrophobicContact CD1-CD1 3.37Å; I379-L387 HydrophobicContact CG1-CD1 4Å
380	T	83.6	Confident	85.8	Confident	87 Å²	87	25.4 Å²	25.4	53%	0.534	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-12.3	175.6	74.2	0	0	0	0	113.7	A376 I377 C378	A376-T380 WeakPolarHBondContact O-CG2 3.2Å; A376-T380 PolarHBondContact O-N 3.05Å; I377-T380 WeakPolarHBondContact O-CB 3.49Å; I377-T380 PolarHBondContact O-N 3.44Å; I377-T380 PolarHBondContact O-OG1 3.01Å; C378-T380 VanDerWaalsContact C-N 3.27Å; C378-T380 PolarHBondContact O-N 3.37Å
381	L	82.2	Confident	86.2	Confident	5 Å²	5	24.9 Å²	24.9	3%	0.026	14%	0.14	C	C	.	.	S	Bend	trans	-69.1	135.1	179.9	-68.5	172.8	0	0	0	111.5	L172 P305 V308 C378 I379 I383	L172-L381 HydrophobicContact CD1-CD1 3.48Å; L172-L381 VanDerWaalsContact CD1-CD1 3.48Å; P305-L381 HydrophobicContact CB-CD2 4.2Å; V308-L381 HydrophobicContact CB-CD2 3.81Å; V308-L381 HydrophobicContact CG1-CD1 4.06Å; V308-L381 HydrophobicContact CG1-CD2 3.59Å; V308-L381 HydrophobicContact CG1-CG 3.97Å; V308-L381 HydrophobicContact CG2-CD2 4.49Å; C378-L381 HydrophobicContact CB-CD1 4.18Å; C378-L381 VanDerWaalsContact O-CB 3.31Å; C378-L381 WeakPolarHBondContact O-CB 3.36Å; C378-L381 PolarHBondContact O-N 3.46Å; I379-L381 PolarHBondContact O-N 3.08Å; L381-I383 HydrophobicContact CB-CD1 3.78Å; L381-I383 HydrophobicContact CB-CG1 3.73Å; L381-I383 HydrophobicContact CD1-CD1 3.73Å; L381-I383 HydrophobicContact CG-CD1 4.41Å; L381-I383 PolarHBondContact O-N 3.3Å
382	P	84.9	Confident	86.6	Confident	37 Å²	37	24.9 Å²	24.9	24%	0.24	14%	0.14	C	C	.	.	S	Bend	trans	-77.4	52.4	175.4	34.3	-37.2	0	0	0	112.2	V121 I132 P305	V121-P382 HydrophobicContact CG1-CG 4.47Å; V121-P382 HydrophobicContact CG2-CG 4.26Å; I132-P382 HydrophobicContact CD1-CB 4.43Å; I132-P382 HydrophobicContact CG2-CB 4.15Å; P305-P382 HydrophobicContact CG-CG 3.73Å
383	I	87.3	Confident	86.8	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.005	12%	0.122	C	C	.	.	S	Bend	trans	-120.4	158.7	176.6	61.5	-174.7	0	0	0	109.7	V121 G133 L172 I174 L381 S385	V121-I383 HydrophobicContact CG2-CG2 3.44Å; V121-I383 VanDerWaalsContact CG2-CG2 3.44Å; G133-I383 VanDerWaalsContact CA-O 3.31Å; G133-I383 WeakPolarHBondContact CA-O 3.33Å; G133-I383 PolarHBondContact N-O 3.11Å; L172-I383 HydrophobicContact CD1-CD1 3.72Å; I174-I383 HydrophobicContact CD1-CD1 4.1Å; L381-I383 HydrophobicContact CB-CD1 3.78Å; L381-I383 HydrophobicContact CB-CG1 3.73Å; L381-I383 HydrophobicContact CD1-CD1 3.73Å; L381-I383 HydrophobicContact CG-CD1 4.41Å; L381-I383 PolarHBondContact O-N 3.3Å; I383-S385 PolarHBondContact O-N 2.91Å
384	P	89.1	Confident	86.9	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.114	C	C	.	.			trans	-65.3	119.3	163.5	27.7	-35.4	0	0	0	109.9	S124 K160 L164 S167	S124-P384 WeakPolarHBondContact OG-CD 3.46Å; K160-P384 HydrophobicContact CG-CB 3.96Å; L164-P384 HydrophobicContact CB-CB 4.23Å; L164-P384 HydrophobicContact CB-CG 4.13Å; L164-P384 HydrophobicContact CD1-CB 4.41Å; L164-P384 VanDerWaalsContact N-CG 3.28Å; S167-P384 PolarHBondContact OG-O 3.23Å; S167-P384 VanDerWaalsContact OG-O 3.08Å
385	S	86.6	Confident	87.3	Confident	10 Å²	10	18.4 Å²	18.4	7%	0.07	11%	0.112	C	C	.	.			trans	-148	139.3	-177	54.9	0	0	0	0	111.1	G133 S134 P179 I383	G133-S385 CarbonylContact C-O 3.57Å; S134-S385 WeakPolarHBondContact CA-O 3.21Å; S134-S385 PolarHBondContact N-O 3.3Å; P179-S385 VanDerWaalsContact CG-C 3.46Å; I383-S385 PolarHBondContact O-N 2.91Å
386	G	86.9	Confident	87.6	Confident	4 Å²	4	18 Å²	18	4%	0.041	11%	0.11	C	C	.	.	B	Isolated β-bridge	trans	-103.2	147.9	171.8	0	0	0	0	0	111.8	G175 P179	G175-G386 PolarHBondContact N-O 3.01Å; G175-G386 VanDerWaalsContact O-CA 3.26Å; G175-G386 WeakPolarHBondContact O-CA 3.19Å; G175-G386 PolarHBondContact O-N 2.71Å; P179-G386 VanDerWaalsContact CD-CA 3.47Å
387	L	89.5	Confident	87.7	Confident	17 Å²	17	16.1 Å²	16.1	9%	0.089	9%	0.094	C	C	.	.	S	Bend	trans	-96.4	-28.2	-177.4	-178.5	56.9	0	0	0	114	T375 I379 T389 P390 V391 V436 V477	T375-L387 HydrophobicContact CG2-CD1 4.03Å; I379-L387 HydrophobicContact CD1-CD1 3.37Å; I379-L387 HydrophobicContact CG1-CD1 4Å; L387-T389 PolarHBondContact O-N 3.3Å; L387-P390 HydrophobicContact CD1-CG 4.41Å; L387-P390 WeakPolarHBondContact O-CD 3.45Å; L387-P390 VanDerWaalsContact O-CG 3.27Å; L387-P390 WeakPolarHBondContact O-CG 3.34Å; L387-V391 HydrophobicContact CD1-CG2 3.51Å; L387-V391 HydrophobicContact CD2-CG2 4.44Å; L387-V391 HydrophobicContact CG-CG2 3.7Å; L387-V391 WeakPolarHBondContact O-CG2 3.43Å; L387-V391 PolarHBondContact O-N 3.27Å; L387-V391 VanDerWaalsContact O-N 3.15Å; L387-V436 HydrophobicContact CD2-CG1 4.3Å; L387-V477 HydrophobicContact CD2-CB 3.89Å; L387-V477 HydrophobicContact CD2-CG1 3.45Å; L387-V477 VanDerWaalsContact CD2-CG1 3.45Å; L387-V477 HydrophobicContact CD2-CG2 4.35Å
388	F	90.9	Very high	88.1	Confident	1 Å²	1	15.8 Å²	15.8	0%	0.004	9%	0.092	C	C	.	.	H	α-helix	trans	-60.1	-48.9	-169.7	-171.5	-68.9	0	0	0	111.7	E177 F224 F233 V391 L392 T433 T442 I445	E177-F388 HydrophobicContact CB-CB 3.98Å; E177-F388 HydrophobicContact CG-CB 3.78Å; E177-F388 HydrophobicContact CG-CD1 4.42Å; E177-F388 HydrophobicContact CG-CG 4.33Å; F224-F388 AromaticContact CE1-CD1 3.63Å; F224-F388 HydrophobicContact CE1-CD1 3.63Å; F224-F388 AromaticContact CE1-CE1 3.49Å; F224-F388 HydrophobicContact CE1-CE1 3.49Å; F224-F388 VanDerWaalsContact CE1-CE1 3.49Å; F224-F388 HydrophobicContact CE1-CG 4.44Å; F224-F388 HydrophobicContact CE1-CZ 4.19Å; F224-F388 HydrophobicContact CE2-CE1 4.23Å; F224-F388 HydrophobicContact CE2-CE2 4.36Å; F224-F388 HydrophobicContact CE2-CZ 4.14Å; F224-F388 AromaticContact CZ-CD1 3.35Å; F224-F388 HydrophobicContact CZ-CD1 3.35Å; F224-F388 HydrophobicContact CZ-CD2 4.06Å; F224-F388 AromaticContact CZ-CE1 3.28Å; F224-F388 HydrophobicContact CZ-CE1 3.28Å; F224-F388 AromaticContact CZ-CE2 3.98Å; F224-F388 HydrophobicContact CZ-CE2 3.98Å; F224-F388 AromaticContact CZ-CG 3.75Å; F224-F388 HydrophobicContact CZ-CG 3.75Å; F224-F388 AromaticContact CZ-CZ 3.6Å; F224-F388 HydrophobicContact CZ-CZ 3.6Å; F233-F388 HydrophobicContact CD2-CE2 4.04Å; F233-F388 HydrophobicContact CE1-CD2 4.33Å; F233-F388 AromaticContact CE2-CD2 3.77Å; F233-F388 HydrophobicContact CE2-CD2 3.77Å; F233-F388 AromaticContact CE2-CE2 3.58Å; F233-F388 HydrophobicContact CE2-CE2 3.58Å; F233-F388 AromaticContact CZ-CD2 3.6Å; F233-F388 HydrophobicContact CZ-CD2 3.6Å; F233-F388 AromaticContact CZ-CE2 3.87Å; F233-F388 HydrophobicContact CZ-CE2 3.87Å; F388-V391 PolarHBondContact O-N 3.02Å; F388-L392 HydrophobicContact CD1-CB 4.46Å; F388-L392 HydrophobicContact CE1-CB 4.5Å; F388-L392 HydrophobicContact CE1-CD1 4.42Å; F388-L392 HydrophobicContact CE1-CD2 4.32Å; F388-L392 WeakPolarHBondContact O-CB 3.34Å; F388-L392 PolarHBondContact O-N 3.36Å; F388-T433 HydrophobicContact CD1-CG2 4.08Å; F388-T433 HydrophobicContact CD2-CG2 3.81Å; F388-T433 HydrophobicContact CE1-CG2 3.94Å; F388-T433 HydrophobicContact CE2-CG2 3.68Å; F388-T433 HydrophobicContact CG-CG2 4.02Å; F388-T433 HydrophobicContact CZ-CG2 3.75Å; F388-T442 HydrophobicContact CE2-CG2 3.7Å; F388-T442 HydrophobicContact CZ-CG2 3.91Å; F388-I445 HydrophobicContact CE2-CD1 4.07Å; F388-I445 HydrophobicContact CZ-CD1 3.92Å; F388-I445 HydrophobicContact CZ-CG2 4.3Å
389	T	89	Confident	88.5	Confident	14 Å²	14	16 Å²	16	9%	0.086	9%	0.094	C	C	.	.	H	α-helix	trans	-53	-65.5	176.1	-40.5	0	0	0	0	110.9	G175 E177 T280 L387 V391 L392 L393	G175-T389 WeakPolarHBondContact CA-OG1 3.26Å; E177-T389 WeakPolarHBondContact CG-OG1 3.37Å; E177-T389 PolarHBondContact OE1-OG1 3.08Å; T280-T389 HydrophobicContact CG2-CG2 4.06Å; L387-T389 PolarHBondContact O-N 3.3Å; T389-V391 PolarHBondContact O-N 3.36Å; T389-L392 WeakPolarHBondContact O-CB 3.23Å; T389-L392 PolarHBondContact O-N 2.93Å; T389-L393 HydrophobicContact CG2-CD2 4.01Å; T389-L393 WeakPolarHBondContact O-CD2 3.49Å; T389-L393 WeakPolarHBondContact O-CG 3.4Å; T389-L393 PolarHBondContact O-N 3.03Å; T389-L393 VanDerWaalsContact O-N 3.07Å
390	P	88.8	Confident	88.7	Confident	4 Å²	4	12.2 Å²	12.2	3%	0.026	8%	0.075	C	C	.	.	H	α-helix	trans	-52.4	-27	179.6	17.7	-30	0	0	0	116.3	T375 L387 L393 A394	T375-P390 HydrophobicContact CG2-CB 3.65Å; T375-P390 HydrophobicContact CG2-CG 4.11Å; T375-P390 WeakPolarHBondContact OG1-CB 3.49Å; L387-P390 HydrophobicContact CD1-CG 4.41Å; L387-P390 WeakPolarHBondContact O-CD 3.45Å; L387-P390 VanDerWaalsContact O-CG 3.27Å; L387-P390 WeakPolarHBondContact O-CG 3.34Å; P390-L393 VanDerWaalsContact CA-CG 3.46Å; P390-L393 HydrophobicContact CB-CD1 4.34Å; P390-L393 WeakPolarHBondContact O-CB 3.3Å; P390-A394 PolarHBondContact O-N 3.47Å
391	V	92	Very high	88.8	Confident	11 Å²	11	9.9 Å²	9.9	7%	0.067	6%	0.059	C	C	.	.	H	α-helix	trans	-82.6	-39.9	176.6	168.6	0	0	0	0	112.1	L387 F388 T389 L393 A394 G395 F432 T433 V436	L387-V391 HydrophobicContact CD1-CG2 3.51Å; L387-V391 HydrophobicContact CD2-CG2 4.44Å; L387-V391 HydrophobicContact CG-CG2 3.7Å; L387-V391 WeakPolarHBondContact O-CG2 3.43Å; L387-V391 PolarHBondContact O-N 3.27Å; L387-V391 VanDerWaalsContact O-N 3.15Å; F388-V391 PolarHBondContact O-N 3.02Å; T389-V391 PolarHBondContact O-N 3.36Å; V391-L393 PolarHBondContact O-N 3.31Å; V391-A394 PolarHBondContact O-N 2.97Å; V391-A394 VanDerWaalsContact O-N 3.17Å; V391-G395 PolarHBondContact O-N 2.89Å; V391-F432 HydrophobicContact CG1-CD1 3.65Å; V391-F432 HydrophobicContact CG1-CE1 3.86Å; V391-F432 WeakPolarHBondContact O-CD1 3.21Å; V391-T433 HydrophobicContact CG1-CG2 4.26Å; V391-V436 HydrophobicContact CG1-CB 3.85Å; V391-V436 HydrophobicContact CG1-CG1 4.06Å; V391-V436 HydrophobicContact CG1-CG2 3.91Å; V391-V436 HydrophobicContact CG2-CG1 4.04Å
392	L	92.3	Very high	89.1	Confident	4 Å²	4	14.6 Å²	14.6	2%	0.021	8%	0.083	C	C	.	.	H	α-helix	trans	-56.4	-37.5	170.9	-169.3	71.6	0	0	0	110.7	L335 F388 T389 G395 A396 A429 T433 I446	L335-L392 HydrophobicContact CD2-CD2 4.3Å; L335-L392 HydrophobicContact CD2-CG 4.34Å; F388-L392 HydrophobicContact CD1-CB 4.46Å; F388-L392 HydrophobicContact CE1-CB 4.5Å; F388-L392 HydrophobicContact CE1-CD1 4.42Å; F388-L392 HydrophobicContact CE1-CD2 4.32Å; F388-L392 WeakPolarHBondContact O-CB 3.34Å; F388-L392 PolarHBondContact O-N 3.36Å; T389-L392 WeakPolarHBondContact O-CB 3.23Å; T389-L392 PolarHBondContact O-N 2.93Å; L392-G395 PolarHBondContact O-N 3.45Å; L392-A396 WeakPolarHBondContact O-CB 3.3Å; L392-A396 PolarHBondContact O-N 3.34Å; L392-A396 VanDerWaalsContact O-N 3.09Å; L392-A429 HydrophobicContact CD1-CB 3.72Å; L392-A429 HydrophobicContact CG-CB 4.36Å; L392-T433 VanDerWaalsContact CA-OG1 3.27Å; L392-T433 WeakPolarHBondContact CA-OG1 3.29Å; L392-T433 WeakPolarHBondContact CD1-OG1 3.43Å; L392-T433 PolarHBondContact N-OG1 3.26Å; L392-I446 HydrophobicContact CD1-CD1 3.73Å; L392-I446 HydrophobicContact CD1-CG1 4.28Å; L392-I446 HydrophobicContact CD2-CD1 4.32Å
393	L	88.9	Confident	89.3	Confident	2 Å²	2	12.8 Å²	12.8	1%	0.01	7%	0.072	C	C	.	.	H	α-helix	trans	-57	-52.5	176.1	-44.7	-172.5	0	0	0	111.5	T280 A281 F282 L371 T389 P390 V391 A396 A397	T280-L393 WeakPolarHBondContact O-CD2 3.11Å; T280-L393 WeakPolarHBondContact OG1-CD2 3.36Å; A281-L393 VanDerWaalsContact C-CA 3.47Å; A281-L393 VanDerWaalsContact C-CB 3.45Å; A281-L393 CarbonylContact C-O 3.48Å; A281-L393 HydrophobicContact CB-CB 4.26Å; A281-L393 HydrophobicContact CB-CD1 3.97Å; A281-L393 HydrophobicContact CB-CD2 3.72Å; A281-L393 HydrophobicContact CB-CG 4.09Å; A281-L393 CarbonylContact O-C 3.08Å; A281-L393 WeakPolarHBondContact O-CA 3.26Å; F282-L393 HydrophobicContact CB-CB 3.89Å; F282-L393 HydrophobicContact CB-CD1 3.76Å; F282-L393 HydrophobicContact CB-CG 4.31Å; F282-L393 HydrophobicContact CD2-CD1 3.82Å; F282-L393 HydrophobicContact CG-CD1 4.26Å; F282-L393 VanDerWaalsContact N-CB 3.32Å; F282-L393 PolarHBondContact N-O 3.34Å; F282-L393 CarbonylContact O-C 3.5Å; F282-L393 WeakPolarHBondContact O-CB 3.35Å; L371-L393 HydrophobicContact CD2-CD1 4.14Å; T389-L393 HydrophobicContact CG2-CD2 4.01Å; T389-L393 WeakPolarHBondContact O-CD2 3.49Å; T389-L393 WeakPolarHBondContact O-CG 3.4Å; T389-L393 PolarHBondContact O-N 3.03Å; T389-L393 VanDerWaalsContact O-N 3.07Å; P390-L393 VanDerWaalsContact CA-CG 3.46Å; P390-L393 HydrophobicContact CB-CD1 4.34Å; P390-L393 WeakPolarHBondContact O-CB 3.3Å; V391-L393 PolarHBondContact O-N 3.31Å; L393-A396 PolarHBondContact O-N 2.83Å; L393-A397 PolarHBondContact O-N 2.64Å; L393-A397 VanDerWaalsContact O-N 3.09Å
394	A	89.1	Confident	89.2	Confident	3 Å²	3	13.4 Å²	13.4	3%	0.025	8%	0.075	C	C	.	.	H	α-helix	trans	-66.3	-41	-177.8	0	0	0	0	0	112.3	S283 F284 Y368 P390 V391 A396 A397 L398 F432	S283-A394 VanDerWaalsContact OG-CA 3.26Å; S283-A394 WeakPolarHBondContact OG-CA 3.15Å; S283-A394 WeakPolarHBondContact OG-CB 3.28Å; F284-A394 HydrophobicContact CE2-CB 4.14Å; Y368-A394 WeakPolarHBondContact CE2-O 3.28Å; P390-A394 PolarHBondContact O-N 3.47Å; V391-A394 PolarHBondContact O-N 2.97Å; V391-A394 VanDerWaalsContact O-N 3.17Å; A394-A396 VanDerWaalsContact C-N 3.35Å; A394-A396 PolarHBondContact O-N 2.72Å; A394-A397 PolarHBondContact O-N 2.92Å; A394-L398 PolarHBondContact O-N 3.33Å; A394-F432 HydrophobicContact CB-CD1 4.19Å; A394-F432 HydrophobicContact CB-CE1 3.68Å; A394-F432 HydrophobicContact CB-CZ 4.28Å
395	G	92.2	Very high	89	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.8	-42.5	176.8	0	0	0	0	0	113.3	V391 L392 L398 G399 G428 A429 F432	V391-G395 PolarHBondContact O-N 2.89Å; L392-G395 PolarHBondContact O-N 3.45Å; G395-L398 PolarHBondContact O-N 3.09Å; G395-G399 PolarHBondContact O-N 3.08Å; G395-G428 CarbonylContact C-O 3.58Å; G395-G428 WeakPolarHBondContact CA-O 3.31Å; G395-G428 CarbonylContact O-C 3.56Å; G395-G428 WeakPolarHBondContact O-CA 3.43Å; G395-A429 PolarHBondContact O-N 3.36Å; G395-F432 VanDerWaalsContact CA-CB 3.42Å
396	A	90.8	Very high	89	Confident	0 Å²	0	18.2 Å²	18.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-73.1	-38.1	-179.3	0	0	0	0	0	112.8	L335 L338 F339 L392 L393 A394 L398 G399 R400 A429	L335-A396 HydrophobicContact CD1-CB 3.12Å; L335-A396 HydrophobicContact CD2-CB 4.07Å; L335-A396 HydrophobicContact CG-CB 3.81Å; L338-A396 HydrophobicContact CD1-CB 4.31Å; F339-A396 HydrophobicContact CE1-CB 4.19Å; L392-A396 WeakPolarHBondContact O-CB 3.3Å; L392-A396 PolarHBondContact O-N 3.34Å; L392-A396 VanDerWaalsContact O-N 3.09Å; L393-A396 PolarHBondContact O-N 2.83Å; A394-A396 VanDerWaalsContact C-N 3.35Å; A394-A396 PolarHBondContact O-N 2.72Å; A396-L398 VanDerWaalsContact C-N 3.34Å; A396-G399 PolarHBondContact O-N 3.06Å; A396-R400 WeakPolarHBondContact O-CB 3.42Å; A396-R400 PolarHBondContact O-N 2.85Å; A396-A429 HydrophobicContact CB-CB 3.77Å
397	A	88.8	Confident	88.8	Confident	4 Å²	4	18.7 Å²	18.7	3%	0.033	11%	0.107	C	C	.	.	H	α-helix	trans	-60	-43.7	172.5	0	0	0	0	0	111.4	L338 F367 Y368 L393 A394 R400 L401	L338-A397 HydrophobicContact CD1-CB 4.48Å; F367-A397 HydrophobicContact CD1-CB 4.05Å; F367-A397 HydrophobicContact CE1-CB 4.37Å; Y368-A397 HydrophobicContact CD2-CB 4.32Å; L393-A397 PolarHBondContact O-N 2.64Å; L393-A397 VanDerWaalsContact O-N 3.09Å; A394-A397 PolarHBondContact O-N 2.92Å; A397-R400 PolarHBondContact O-N 3.2Å; A397-L401 WeakPolarHBondContact O-CB 3.22Å; A397-L401 PolarHBondContact O-N 2.89Å
398	L	90.1	Very high	88.4	Confident	47 Å²	47	24.8 Å²	24.8	25%	0.246	14%	0.135	C	C	.	.	H	α-helix	trans	-61.3	-49.6	173	-177.5	54.7	0	0	0	112.2	Y368 A394 G395 A396 R400 L401 L402	Y368-L398 HydrophobicContact CD1-CD1 3.97Å; Y368-L398 HydrophobicContact CD2-CB 3.9Å; Y368-L398 HydrophobicContact CE1-CB 4.45Å; Y368-L398 HydrophobicContact CE1-CD1 3.69Å; Y368-L398 HydrophobicContact CE1-CD2 4.41Å; Y368-L398 HydrophobicContact CE1-CG 4.39Å; Y368-L398 HydrophobicContact CE2-CB 3.47Å; Y368-L398 VanDerWaalsContact CE2-CB 3.47Å; Y368-L398 HydrophobicContact CE2-CD1 4.27Å; Y368-L398 HydrophobicContact CE2-CD2 4.35Å; Y368-L398 HydrophobicContact CE2-CG 4.22Å; Y368-L398 HydrophobicContact CG-CD1 4.48Å; A394-L398 PolarHBondContact O-N 3.33Å; G395-L398 PolarHBondContact O-N 3.09Å; A396-L398 VanDerWaalsContact C-N 3.34Å; L398-R400 VanDerWaalsContact C-N 3.3Å; L398-R400 PolarHBondContact O-N 3.02Å; L398-L401 PolarHBondContact O-N 3.26Å; L398-L402 HydrophobicContact CD1-CD1 4.06Å; L398-L402 HydrophobicContact CD1-CG 4.23Å; L398-L402 HydrophobicContact CG-CD1 4.04Å; L398-L402 WeakPolarHBondContact O-CG 3.44Å; L398-L402 PolarHBondContact O-N 3.28Å
399	G	90.9	Very high	88	Confident	4 Å²	4	34.1 Å²	34.1	4%	0.041	17%	0.171	C	C	.	.	H	α-helix	trans	-60.7	-40.2	-179.6	0	0	0	0	0	112.2	G395 A396 G403 Y424	G395-G399 PolarHBondContact O-N 3.08Å; A396-G399 PolarHBondContact O-N 3.06Å; G399-G403 PolarHBondContact O-N 3.46Å; G399-Y424 CarbonylContact C-O 3.58Å; G399-Y424 VanDerWaalsContact CA-O 3.23Å; G399-Y424 WeakPolarHBondContact CA-O 3.47Å; G399-Y424 CarbonylContact O-C 3.52Å; G399-Y424 WeakPolarHBondContact O-CB 3.28Å
400	R	88.6	Confident	87.6	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.008	18%	0.181	C	C	.	.	H	α-helix	trans	-66.2	-47.3	175.8	-174.6	58.2	175.5	-138.2	15.4	111.7	L338 S340 F342 W344 A396 A397 L398 L402 G403 E404 A425	L338-R400 HydrophobicContact CD2-CB 3.59Å; L338-R400 HydrophobicContact CD2-CG 3.71Å; L338-R400 WeakPolarHBondContact O-CD 3.2Å; L338-R400 PolarHBondContact O-NH1 3.48Å; S340-R400 PolarHBondContact O-NH1 2.89Å; S340-R400 PolarHBondContact OG-NH1 3.06Å; S340-R400 PolarHBondContact OG-NH2 3.21Å; F342-R400 PolarHBondContact O-NH2 3.45Å; W344-R400 HydrophobicContact CH2-CG 3.73Å; W344-R400 HydrophobicContact CZ2-CG 4.13Å; W344-R400 HydrophobicContact CZ3-CG 4Å; W344-R400 VanDerWaalsContact NE1-NH2 3.13Å; A396-R400 WeakPolarHBondContact O-CB 3.42Å; A396-R400 PolarHBondContact O-N 2.85Å; A397-R400 PolarHBondContact O-N 3.2Å; L398-R400 VanDerWaalsContact C-N 3.3Å; L398-R400 PolarHBondContact O-N 3.02Å; R400-L402 VanDerWaalsContact C-N 3.31Å; R400-L402 PolarHBondContact O-N 3.38Å; R400-G403 PolarHBondContact O-N 3.19Å; R400-G403 VanDerWaalsContact O-N 3.09Å; R400-E404 HydrophobicContact CG-CG 4.33Å; R400-E404 IonicContact CZ-OE1 3.63Å; R400-E404 IonicContact NE-OE1 2.69Å; R400-E404 PolarHBondContact NE-OE1 2.96Å; R400-E404 IonicContact NH2-OE1 3.67Å; R400-E404 PolarHBondContact NH2-OE1 3.01Å; R400-E404 WeakPolarHBondContact O-CG 3.22Å; R400-E404 PolarHBondContact O-N 3.27Å; R400-A425 HydrophobicContact CB-CB 3.88Å
401	L	87.1	Confident	86.7	Confident	38 Å²	38	40.9 Å²	40.9	20%	0.199	21%	0.211	C	C	.	.	H	α-helix	trans	-55.6	-46.9	177.3	-179.8	67.3	0	0	0	111.1	A364 L365 A397 L398 G403 E404 C405	A364-L401 HydrophobicContact CB-CD1 4.26Å; L365-L401 HydrophobicContact CB-CD2 4.5Å; L365-L401 HydrophobicContact CD1-CD2 3.99Å; A397-L401 WeakPolarHBondContact O-CB 3.22Å; A397-L401 PolarHBondContact O-N 2.89Å; L398-L401 PolarHBondContact O-N 3.26Å; L401-G403 PolarHBondContact O-N 3.42Å; L401-E404 PolarHBondContact O-N 3.34Å; L401-C405 WeakPolarHBondContact O-CB 3.33Å; L401-C405 PolarHBondContact O-N 2.65Å; L401-C405 PolarHBondContact O-SG 3.5Å
402	L	88.5	Confident	85.5	Confident	103 Å²	103	45.2 Å²	45.2	54%	0.539	24%	0.238	S	C	.	.	H	α-helix	trans	-63.7	-38.8	175.8	-69	170.9	0	0	0	112.5	L398 R400 L406	L398-L402 HydrophobicContact CD1-CD1 4.06Å; L398-L402 HydrophobicContact CD1-CG 4.23Å; L398-L402 HydrophobicContact CG-CD1 4.04Å; L398-L402 WeakPolarHBondContact O-CG 3.44Å; L398-L402 PolarHBondContact O-N 3.28Å; R400-L402 VanDerWaalsContact C-N 3.31Å; R400-L402 PolarHBondContact O-N 3.38Å; L402-L406 WeakPolarHBondContact O-CB 3.48Å; L402-L406 PolarHBondContact O-N 2.89Å
403	G	87.4	Confident	83.8	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-65.3	-43.2	176.1	0	0	0	0	0	113.7	G399 R400 L401 L406 A407	G399-G403 PolarHBondContact O-N 3.46Å; R400-G403 PolarHBondContact O-N 3.19Å; R400-G403 VanDerWaalsContact O-N 3.09Å; L401-G403 PolarHBondContact O-N 3.42Å; G403-L406 PolarHBondContact O-N 2.84Å; G403-A407 WeakPolarHBondContact O-CB 3.35Å; G403-A407 PolarHBondContact O-N 2.86Å
404	E	85.3	Confident	82.2	Confident	14 Å²	14	53.4 Å²	53.4	7%	0.065	28%	0.284	C	S	.	.	H	α-helix	trans	-66.9	-43.6	176	-66.3	-68.2	166.2	0	0	111.1	T343 W344 R400 L401 L406 A407 Q408 P421	T343-E404 WeakPolarHBondContact CG2-OE2 3.22Å; W344-E404 HydrophobicContact CE3-CG 4.1Å; W344-E404 VanDerWaalsContact CG-OE1 3.32Å; W344-E404 PolarHBondContact N-OE1 3.16Å; W344-E404 PolarHBondContact N-OE2 3.34Å; R400-E404 HydrophobicContact CG-CG 4.33Å; R400-E404 IonicContact CZ-OE1 3.63Å; R400-E404 IonicContact NE-OE1 2.69Å; R400-E404 PolarHBondContact NE-OE1 2.96Å; R400-E404 IonicContact NH2-OE1 3.67Å; R400-E404 PolarHBondContact NH2-OE1 3.01Å; R400-E404 WeakPolarHBondContact O-CG 3.22Å; R400-E404 PolarHBondContact O-N 3.27Å; L401-E404 PolarHBondContact O-N 3.34Å; E404-L406 VanDerWaalsContact C-N 3.28Å; E404-L406 PolarHBondContact O-N 3.37Å; E404-A407 PolarHBondContact O-N 3.5Å; E404-Q408 WeakPolarHBondContact O-CG 3.47Å; E404-Q408 PolarHBondContact O-N 3.01Å; E404-P421 HydrophobicContact CG-CB 4.09Å; E404-P421 HydrophobicContact CG-CG 4.29Å
405	C	85.9	Confident	80.7	Confident	66 Å²	66	60.5 Å²	60.5	45%	0.446	32%	0.321	S	S	.	.	H	α-helix	trans	-60.5	-37.5	173.4	-70.3	0	0	0	0	112.3	L401 W409	L401-C405 WeakPolarHBondContact O-CB 3.33Å; L401-C405 PolarHBondContact O-N 2.65Å; L401-C405 PolarHBondContact O-SG 3.5Å; C405-W409 WeakPolarHBondContact O-CB 3.46Å; C405-W409 PolarHBondContact O-N 3.27Å
406	L	85.9	Confident	79.3	Confident	45 Å²	45	67.9 Å²	67.9	24%	0.236	36%	0.361	C	S	.	.	H	α-helix	trans	-69.8	-41.5	176.4	-170.6	66.5	0	0	0	111.9	L402 G403 E404 Q408 W409 L410 V419 Y424	L402-L406 WeakPolarHBondContact O-CB 3.48Å; L402-L406 PolarHBondContact O-N 2.89Å; G403-L406 PolarHBondContact O-N 2.84Å; E404-L406 VanDerWaalsContact C-N 3.28Å; E404-L406 PolarHBondContact O-N 3.37Å; L406-Q408 VanDerWaalsContact C-N 3.3Å; L406-Q408 PolarHBondContact O-N 3.33Å; L406-W409 HydrophobicContact CD1-CE3 4.19Å; L406-W409 PolarHBondContact O-N 3.34Å; L406-L410 HydrophobicContact CD1-CD1 3.66Å; L406-L410 HydrophobicContact CD1-CG 4.24Å; L406-L410 HydrophobicContact CG-CD1 4.27Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 3.04Å; L406-V419 HydrophobicContact CB-CG1 4.39Å; L406-V419 HydrophobicContact CD2-CG1 4.14Å; L406-V419 HydrophobicContact CG-CG1 4.26Å; L406-Y424 HydrophobicContact CD2-CE1 3.63Å; L406-Y424 HydrophobicContact CD2-CE2 4.25Å; L406-Y424 VanDerWaalsContact CD2-CZ 3.47Å; L406-Y424 VanDerWaalsContact CD2-OH 3.29Å; L406-Y424 WeakPolarHBondContact CD2-OH 3.49Å
407	A	82.8	Confident	78	Confident	14 Å²	14	72.8 Å²	72.8	12%	0.116	39%	0.386	C	S	.	.	H	α-helix	trans	-66	-31.1	176	0	0	0	0	0	112.8	T343 G403 E404 V419 P421	T343-A407 HydrophobicContact CG2-CB 3.72Å; G403-A407 WeakPolarHBondContact O-CB 3.35Å; G403-A407 PolarHBondContact O-N 2.86Å; E404-A407 PolarHBondContact O-N 3.5Å; A407-V419 HydrophobicContact CB-CB 4.16Å; A407-V419 HydrophobicContact CB-CG1 4.08Å; A407-P421 HydrophobicContact CB-CG 4.22Å
408	Q	82.2	Confident	77.1	Confident	144 Å²	144	77.8 Å²	77.8	67%	0.673	42%	0.416	S	S	*	.	H	α-helix	trans	-72	-35.1	171.3	-72.3	174.9	3.3	0	0	112.8	E404 L406	E404-Q408 WeakPolarHBondContact O-CG 3.47Å; E404-Q408 PolarHBondContact O-N 3.01Å; L406-Q408 VanDerWaalsContact C-N 3.3Å; L406-Q408 PolarHBondContact O-N 3.33Å
409	W	82.3	Confident	76.5	Confident	198 Å²	198	76.6 Å²	76.6	75%	0.75	41%	0.41	S	S	*	.	H	α-helix	trans	-82.5	-29.3	-179.2	-171.2	56	0	0	0	113.4	C405 L406 P411	C405-W409 WeakPolarHBondContact O-CB 3.46Å; C405-W409 PolarHBondContact O-N 3.27Å; L406-W409 HydrophobicContact CD1-CE3 4.19Å; L406-W409 PolarHBondContact O-N 3.34Å; W409-P411 VanDerWaalsContact C-CD 3.44Å; W409-P411 WeakPolarHBondContact O-CD 3.26Å
410	L	80.5	Confident	76.2	Confident	57 Å²	57	80 Å²	80	30%	0.298	43%	0.427	S	S	.	.			trans	-124	68.2	-179.2	-63.2	-179.6	0	0	0	110.6	L406 T412 V413	L406-L410 HydrophobicContact CD1-CD1 3.66Å; L406-L410 HydrophobicContact CD1-CG 4.24Å; L406-L410 HydrophobicContact CG-CD1 4.27Å; L406-L410 WeakPolarHBondContact O-CB 3.41Å; L406-L410 PolarHBondContact O-N 3.04Å; L410-T412 VanDerWaalsContact C-N 3.31Å; L410-T412 PolarHBondContact O-N 2.89Å; L410-V413 HydrophobicContact CB-CG2 3.73Å; L410-V413 HydrophobicContact CD1-CG2 4.3Å; L410-V413 HydrophobicContact CD2-CG2 4.04Å; L410-V413 HydrophobicContact CG-CG2 4.23Å
411	P	69.1	Low	76	Confident	102 Å²	102	80 Å²	80	66%	0.662	43%	0.427	S	S	*	.	S	Bend	trans	-66.7	-28.8	-175.5	26.6	-35.3	0	0	0	113.7	W409	W409-P411 VanDerWaalsContact C-CD 3.44Å; W409-P411 WeakPolarHBondContact O-CD 3.26Å
412	T	66	Low	75.9	Confident	103 Å²	103	78.4 Å²	78.4	63%	0.632	42%	0.42	S	S	*	.			trans	-146.7	121.8	174.4	45.7	0	0	0	0	110.1	L410	L410-T412 VanDerWaalsContact C-N 3.31Å; L410-T412 PolarHBondContact O-N 2.89Å
413	V	57.3	Low	75.8	Confident	59 Å²	59	74.4 Å²	74.4	36%	0.358	40%	0.401	S	S	.	.	S	Bend	trans	-130	74.9	177.6	-175.1	0	0	0	0	108.6	L410 I417	L410-V413 HydrophobicContact CB-CG2 3.73Å; L410-V413 HydrophobicContact CD1-CG2 4.3Å; L410-V413 HydrophobicContact CD2-CG2 4.04Å; L410-V413 HydrophobicContact CG-CG2 4.23Å; V413-I417 WeakPolarHBondContact O-CB 3.32Å
414	N	54.6	Low	75.9	Confident	118 Å²	118	78.8 Å²	78.8	63%	0.631	42%	0.418	S	S	*	.	S	Bend	trans	64.8	145.2	-155.3	-41.3	-40.4	0	0	0	111.2	D416 I417	N414-D416 PolarHBondContact O-N 2.74Å; N414-I417 PolarHBondContact O-N 2.75Å
415	D	58.7	Low	76.1	Confident	153 Å²	153	78.1 Å²	78.1	82%	0.818	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-10.3	-170.8	-59.9	-62.8	0	0	0	114.3
416	D	61.7	Low	76.3	Confident	155 Å²	155	75.6 Å²	75.6	83%	0.829	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.8	-20.8	177	-58.6	-54.7	0	0	0	114.7	N414	N414-D416 PolarHBondContact O-N 2.74Å
417	I	63.7	Low	76.6	Confident	102 Å²	102	75 Å²	75	52%	0.523	40%	0.396	S	S	.	.			trans	-110.9	84.7	-167	-47.2	-177.7	0	0	0	111.8	V413 N414	V413-I417 WeakPolarHBondContact O-CB 3.32Å; N414-I417 PolarHBondContact O-N 2.75Å
418	V	71.1	Confident	77.1	Confident	110 Å²	110	75 Å²	75	67%	0.667	40%	0.397	S	S	*	.			trans	-81.3	123.7	171.7	-178.3	0	0	0	0	110.7	I420	V418-I420 PolarHBondContact O-N 2.75Å
419	V	77.7	Confident	77.5	Confident	21 Å²	21	68.1 Å²	68.1	13%	0.127	37%	0.365	C	S	.	.			trans	-71.6	116.5	171.8	-179.8	0	0	0	0	109.3	T343 L406 A407 P421 Y424	T343-V419 PolarHBondContact OG1-O 3.41Å; L406-V419 HydrophobicContact CB-CG1 4.39Å; L406-V419 HydrophobicContact CD2-CG1 4.14Å; L406-V419 HydrophobicContact CG-CG1 4.26Å; A407-V419 HydrophobicContact CB-CB 4.16Å; A407-V419 HydrophobicContact CB-CG1 4.08Å; V419-P421 WeakPolarHBondContact O-CD 3.49Å; V419-Y424 HydrophobicContact CG1-CD2 4.46Å; V419-Y424 HydrophobicContact CG1-CE2 3.8Å
420	I	83.2	Confident	78.1	Confident	77 Å²	77	58.7 Å²	58.7	40%	0.395	33%	0.329	S	S	.	.			trans	-102.1	105.5	178.1	-61.3	173.2	0	0	0	109.9	N341 V418 G422 S423	N341-I420 WeakPolarHBondContact O-CG2 3.37Å; V418-I420 PolarHBondContact O-N 2.75Å; I420-G422 VanDerWaalsContact C-N 3.26Å; I420-G422 PolarHBondContact O-N 3.22Å; I420-S423 PolarHBondContact O-N 2.92Å; I420-S423 PolarHBondContact O-OG 3.5Å
421	P	84.9	Confident	78.8	Confident	0 Å²	0	56.6 Å²	56.6	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-62.2	-26.4	-173.8	-27.4	37.8	0	0	0	114.9	T343 E404 A407 V419 S423 Y424 A425	T343-P421 HydrophobicContact CG2-CG 3.98Å; T343-P421 WeakPolarHBondContact OG1-CD 3.48Å; E404-P421 HydrophobicContact CG-CB 4.09Å; E404-P421 HydrophobicContact CG-CG 4.29Å; A407-P421 HydrophobicContact CB-CG 4.22Å; V419-P421 WeakPolarHBondContact O-CD 3.49Å; P421-S423 PolarHBondContact O-N 3.39Å; P421-Y424 PolarHBondContact O-N 3.4Å; P421-Y424 VanDerWaalsContact O-N 3.13Å; P421-A425 PolarHBondContact O-N 3.47Å
422	G	84.2	Confident	80	Confident	5 Å²	5	53.7 Å²	53.7	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-58	-33.2	173.7	0	0	0	0	0	113.4	S340 I420 A425 V426	S340-G422 WeakPolarHBondContact O-CA 3.47Å; I420-G422 VanDerWaalsContact C-N 3.26Å; I420-G422 PolarHBondContact O-N 3.22Å; G422-A425 WeakPolarHBondContact O-CB 3.41Å; G422-A425 PolarHBondContact O-N 3.01Å; G422-V426 WeakPolarHBondContact O-CG2 3.07Å; G422-V426 PolarHBondContact O-N 3.11Å
423	S	86.9	Confident	81.3	Confident	20 Å²	20	48.8 Å²	48.8	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-68.2	-37.2	175.9	68.7	0	0	0	0	112.5	I420 P421 V426 V427 H455	I420-S423 PolarHBondContact O-N 2.92Å; I420-S423 PolarHBondContact O-OG 3.5Å; P421-S423 PolarHBondContact O-N 3.39Å; S423-V426 WeakPolarHBondContact O-CB 3.42Å; S423-V426 PolarHBondContact O-N 3.01Å; S423-V427 WeakPolarHBondContact O-CG2 3.45Å; S423-V427 PolarHBondContact O-N 3.17Å; S423-H455 WeakPolarHBondContact CB-NE2 3.42Å
424	Y	90.2	Very high	83	Confident	92 Å²	92	46 Å²	46	36%	0.361	25%	0.25	S	C	.	.	H	α-helix	trans	-70.7	-35.1	174.7	-66.7	-97.4	0	0	0	111.4	G399 L406 V419 P421 V427 G428	G399-Y424 CarbonylContact C-O 3.58Å; G399-Y424 VanDerWaalsContact CA-O 3.23Å; G399-Y424 WeakPolarHBondContact CA-O 3.47Å; G399-Y424 CarbonylContact O-C 3.52Å; G399-Y424 WeakPolarHBondContact O-CB 3.28Å; L406-Y424 HydrophobicContact CD2-CE1 3.63Å; L406-Y424 HydrophobicContact CD2-CE2 4.25Å; L406-Y424 VanDerWaalsContact CD2-CZ 3.47Å; L406-Y424 VanDerWaalsContact CD2-OH 3.29Å; L406-Y424 WeakPolarHBondContact CD2-OH 3.49Å; V419-Y424 HydrophobicContact CG1-CD2 4.46Å; V419-Y424 HydrophobicContact CG1-CE2 3.8Å; P421-Y424 PolarHBondContact O-N 3.4Å; P421-Y424 VanDerWaalsContact O-N 3.13Å; Y424-V427 PolarHBondContact O-N 2.9Å; Y424-G428 PolarHBondContact O-N 2.86Å
425	A	90.1	Very high	84.9	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-59.1	-45.3	169.9	0	0	0	0	0	111.7	L338 F339 R400 P421 G422 G428 A429	L338-A425 WeakPolarHBondContact O-CB 3.49Å; F339-A425 HydrophobicContact CD1-CB 3.8Å; F339-A425 HydrophobicContact CE1-CB 4.12Å; R400-A425 HydrophobicContact CB-CB 3.88Å; P421-A425 PolarHBondContact O-N 3.47Å; G422-A425 WeakPolarHBondContact O-CB 3.41Å; G422-A425 PolarHBondContact O-N 3.01Å; A425-G428 PolarHBondContact O-N 3.36Å; A425-A429 VanDerWaalsContact O-CB 3.28Å; A425-A429 WeakPolarHBondContact O-CB 3.38Å; A425-A429 PolarHBondContact O-N 3.43Å
426	V	89.7	Confident	86.6	Confident	13 Å²	13	35.6 Å²	35.6	8%	0.079	20%	0.198	C	C	.	.	H	α-helix	trans	-60.1	-45.6	175.6	171.2	0	0	0	0	111.8	F339 G422 S423 A430 I446 T450 V459	F339-V426 HydrophobicContact CD1-CG2 3.68Å; F339-V426 HydrophobicContact CD2-CG2 3.95Å; F339-V426 HydrophobicContact CE1-CB 4.19Å; F339-V426 HydrophobicContact CE1-CG2 3.61Å; F339-V426 HydrophobicContact CE2-CG2 3.88Å; F339-V426 HydrophobicContact CG-CG2 3.86Å; F339-V426 HydrophobicContact CZ-CB 4.3Å; F339-V426 HydrophobicContact CZ-CG2 3.7Å; G422-V426 WeakPolarHBondContact O-CG2 3.07Å; G422-V426 PolarHBondContact O-N 3.11Å; S423-V426 WeakPolarHBondContact O-CB 3.42Å; S423-V426 PolarHBondContact O-N 3.01Å; V426-A430 PolarHBondContact O-N 2.99Å; V426-I446 HydrophobicContact CG1-CG2 3.58Å; V426-T450 HydrophobicContact CG1-CG2 4.24Å; V426-T450 HydrophobicContact CG2-CG2 4.04Å; V426-V459 HydrophobicContact CG1-CG2 4.12Å
427	V	91.9	Very high	88.1	Confident	33 Å²	33	28.4 Å²	28.4	20%	0.2	16%	0.16	C	C	.	.	H	α-helix	trans	-62.7	-47.4	176.2	174.4	0	0	0	0	111.4	S423 Y424 A429 A430 A431 P458 V459	S423-V427 WeakPolarHBondContact O-CG2 3.45Å; S423-V427 PolarHBondContact O-N 3.17Å; Y424-V427 PolarHBondContact O-N 2.9Å; V427-A429 PolarHBondContact O-N 3.23Å; V427-A430 PolarHBondContact O-N 3Å; V427-A431 WeakPolarHBondContact O-CB 3.41Å; V427-A431 PolarHBondContact O-N 3.31Å; V427-P458 HydrophobicContact CG2-CB 4.19Å; V427-V459 HydrophobicContact CB-CG2 4.47Å; V427-V459 HydrophobicContact CG2-CG2 3.67Å
428	G	92.4	Very high	89.4	Confident	13 Å²	13	26.2 Å²	26.2	13%	0.134	15%	0.147	C	C	.	.	H	α-helix	trans	-62.3	-42	179.4	0	0	0	0	0	112.9	G395 Y424 A425 A431 F432	G395-G428 CarbonylContact C-O 3.58Å; G395-G428 WeakPolarHBondContact CA-O 3.31Å; G395-G428 CarbonylContact O-C 3.56Å; G395-G428 WeakPolarHBondContact O-CA 3.43Å; Y424-G428 PolarHBondContact O-N 2.86Å; A425-G428 PolarHBondContact O-N 3.36Å; G428-A431 PolarHBondContact O-N 3.38Å; G428-F432 VanDerWaalsContact O-CB 3.3Å; G428-F432 WeakPolarHBondContact O-CB 3.31Å; G428-F432 PolarHBondContact O-N 2.98Å
429	A	92	Very high	90.5	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-57	-52.6	176.3	0	0	0	0	0	111.4	F339 L392 G395 A396 A425 V427 T433 I446	F339-A429 HydrophobicContact CE1-CB 4.09Å; F339-A429 HydrophobicContact CZ-CB 4.01Å; L392-A429 HydrophobicContact CD1-CB 3.72Å; L392-A429 HydrophobicContact CG-CB 4.36Å; G395-A429 PolarHBondContact O-N 3.36Å; A396-A429 HydrophobicContact CB-CB 3.77Å; A425-A429 VanDerWaalsContact O-CB 3.28Å; A425-A429 WeakPolarHBondContact O-CB 3.38Å; A425-A429 PolarHBondContact O-N 3.43Å; V427-A429 PolarHBondContact O-N 3.23Å; A429-T433 VanDerWaalsContact O-CB 3.31Å; A429-T433 WeakPolarHBondContact O-CB 3.26Å; A429-T433 PolarHBondContact O-N 3.45Å; A429-T433 PolarHBondContact O-OG1 3.02Å; A429-I446 HydrophobicContact CB-CD1 4.46Å
430	A	93.4	Very high	91.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-64.5	-46.8	179.3	0	0	0	0	0	112.1	V426 V427 G434 T442 I446 V459 V463	V426-A430 PolarHBondContact O-N 2.99Å; V427-A430 PolarHBondContact O-N 3Å; A430-G434 PolarHBondContact O-N 3.32Å; A430-T442 PolarHBondContact O-OG1 3.49Å; A430-I446 HydrophobicContact CB-CB 4.34Å; A430-I446 HydrophobicContact CB-CG1 4.16Å; A430-I446 HydrophobicContact CB-CG2 4.42Å; A430-V459 HydrophobicContact CB-CG1 3.66Å; A430-V463 HydrophobicContact CB-CG2 3.73Å
431	A	95.6	Very high	91.9	Very high	13 Å²	13	19.7 Å²	19.7	11%	0.107	11%	0.111	C	C	.	.	H	α-helix	trans	-68.3	-45.9	-173.8	0	0	0	0	0	113.2	V427 G428 G434 A435 V463 A466	V427-A431 WeakPolarHBondContact O-CB 3.41Å; V427-A431 PolarHBondContact O-N 3.31Å; G428-A431 PolarHBondContact O-N 3.38Å; A431-G434 PolarHBondContact O-N 3.14Å; A431-A435 WeakPolarHBondContact O-CB 3.31Å; A431-A435 PolarHBondContact O-N 3.47Å; A431-V463 HydrophobicContact CB-CG2 4.37Å; A431-A466 HydrophobicContact CB-CB 4.07Å; A431-A466 WeakPolarHBondContact O-CB 3.38Å
432	F	94.2	Very high	92.3	Very high	41 Å²	41	19.7 Å²	19.7	18%	0.18	11%	0.111	C	C	.	.	H	α-helix	trans	-68	-40.2	178.2	-170.8	-98.4	0	0	0	111.5	F372 V391 A394 G395 G428 A435 V436	F372-F432 HydrophobicContact CD2-CZ 4.37Å; F372-F432 HydrophobicContact CE2-CZ 4.3Å; V391-F432 HydrophobicContact CG1-CD1 3.65Å; V391-F432 HydrophobicContact CG1-CE1 3.86Å; V391-F432 WeakPolarHBondContact O-CD1 3.21Å; A394-F432 HydrophobicContact CB-CD1 4.19Å; A394-F432 HydrophobicContact CB-CE1 3.68Å; A394-F432 HydrophobicContact CB-CZ 4.28Å; G395-F432 VanDerWaalsContact CA-CB 3.42Å; G428-F432 VanDerWaalsContact O-CB 3.3Å; G428-F432 WeakPolarHBondContact O-CB 3.31Å; G428-F432 PolarHBondContact O-N 2.98Å; F432-A435 PolarHBondContact O-N 2.66Å; F432-V436 HydrophobicContact CD1-CG2 4.4Å; F432-V436 HydrophobicContact CE1-CG2 4.21Å; F432-V436 HydrophobicContact CZ-CG2 4.46Å; F432-V436 WeakPolarHBondContact O-CG2 3.34Å; F432-V436 PolarHBondContact O-N 3.48Å; F432-V436 VanDerWaalsContact O-N 3.11Å
433	T	93.8	Very high	92.7	Very high	0 Å²	0	19.5 Å²	19.5	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-65.9	-42.8	175.7	-48.9	0	0	0	0	111.7	F388 V391 L392 A429 V436 T437 T442	F388-T433 HydrophobicContact CD1-CG2 4.08Å; F388-T433 HydrophobicContact CD2-CG2 3.81Å; F388-T433 HydrophobicContact CE1-CG2 3.94Å; F388-T433 HydrophobicContact CE2-CG2 3.68Å; F388-T433 HydrophobicContact CG-CG2 4.02Å; F388-T433 HydrophobicContact CZ-CG2 3.75Å; V391-T433 HydrophobicContact CG1-CG2 4.26Å; L392-T433 VanDerWaalsContact CA-OG1 3.27Å; L392-T433 WeakPolarHBondContact CA-OG1 3.29Å; L392-T433 WeakPolarHBondContact CD1-OG1 3.43Å; L392-T433 PolarHBondContact N-OG1 3.26Å; A429-T433 VanDerWaalsContact O-CB 3.31Å; A429-T433 WeakPolarHBondContact O-CB 3.26Å; A429-T433 PolarHBondContact O-N 3.45Å; A429-T433 PolarHBondContact O-OG1 3.02Å; T433-V436 PolarHBondContact O-N 3.41Å; T433-T437 PolarHBondContact O-N 3.27Å; T433-T437 VanDerWaalsContact O-N 3.09Å; T433-T437 PolarHBondContact O-OG1 2.73Å; T433-T442 HydrophobicContact CG2-CG2 3.76Å
434	G	93.4	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-55.3	-52.2	173	0	0	0	0	0	111.2	A430 A431 V436 T437 Q438 T439 T442 N467	A430-G434 PolarHBondContact O-N 3.32Å; A431-G434 PolarHBondContact O-N 3.14Å; G434-V436 PolarHBondContact O-N 2.89Å; G434-T437 CarbonylContact O-C 2.87Å; G434-T437 PolarHBondContact O-N 3.43Å; G434-Q438 VanDerWaalsContact O-CA 3.23Å; G434-Q438 WeakPolarHBondContact O-CA 3.32Å; G434-Q438 PolarHBondContact O-N 2.98Å; G434-T439 VanDerWaalsContact CA-O 3.32Å; G434-T439 WeakPolarHBondContact CA-O 3.34Å; G434-T439 PolarHBondContact O-N 3.11Å; G434-T442 WeakPolarHBondContact CA-OG1 3.17Å; G434-N467 WeakPolarHBondContact CA-OD1 3.38Å; G434-N467 PolarHBondContact O-OD1 3.16Å; G434-N467 VanDerWaalsContact O-OD1 3.09Å
435	A	95.1	Very high	93.2	Very high	19 Å²	19	16.6 Å²	16.6	16%	0.157	10%	0.097	C	C	.	.	H	α-helix	trans	-57.3	-45.6	-178.9	0	0	0	0	0	113.2	A431 F432 A466 N467 A470	A431-A435 WeakPolarHBondContact O-CB 3.31Å; A431-A435 PolarHBondContact O-N 3.47Å; F432-A435 PolarHBondContact O-N 2.66Å; A435-A466 HydrophobicContact CB-CB 4.03Å; A435-N467 WeakPolarHBondContact CA-OD1 3.49Å; A435-N467 PolarHBondContact N-OD1 2.93Å; A435-A470 HydrophobicContact CB-CB 3.8Å; A435-A470 WeakPolarHBondContact O-CB 3.32Å
436	V	93.1	Very high	93.3	Very high	33 Å²	33	16.7 Å²	16.7	20%	0.2	10%	0.098	C	C	.	.	H	α-helix	trans	-71	-31.2	-177.8	172.5	0	0	0	0	112.6	L387 V391 F432 T433 G434 V477	L387-V436 HydrophobicContact CD2-CG1 4.3Å; V391-V436 HydrophobicContact CG1-CB 3.85Å; V391-V436 HydrophobicContact CG1-CG1 4.06Å; V391-V436 HydrophobicContact CG1-CG2 3.91Å; V391-V436 HydrophobicContact CG2-CG1 4.04Å; F432-V436 HydrophobicContact CD1-CG2 4.4Å; F432-V436 HydrophobicContact CE1-CG2 4.21Å; F432-V436 HydrophobicContact CZ-CG2 4.46Å; F432-V436 WeakPolarHBondContact O-CG2 3.34Å; F432-V436 PolarHBondContact O-N 3.48Å; F432-V436 VanDerWaalsContact O-N 3.11Å; T433-V436 PolarHBondContact O-N 3.41Å; G434-V436 PolarHBondContact O-N 2.89Å; V436-V477 HydrophobicContact CG1-CB 4.39Å; V436-V477 HydrophobicContact CG1-CG2 3.67Å; V436-V477 PolarHBondContact O-N 3.27Å
437	T	92.9	Very high	93.3	Very high	5 Å²	5	16.6 Å²	16.6	3%	0.031	10%	0.096	C	C	.	.	H	α-helix	trans	-99.5	-12.7	-178.8	56	0	0	0	0	114.3	F233 T433 G434 T439 Y478	F233-T437 HydrophobicContact CE2-CG2 4.42Å; F233-T437 HydrophobicContact CZ-CG2 4.49Å; T433-T437 PolarHBondContact O-N 3.27Å; T433-T437 VanDerWaalsContact O-N 3.09Å; T433-T437 PolarHBondContact O-OG1 2.73Å; G434-T437 CarbonylContact O-C 2.87Å; G434-T437 PolarHBondContact O-N 3.43Å; T437-T439 PolarHBondContact OG1-OG1 3.45Å; T437-Y478 HydrophobicContact CG2-CE2 3.67Å
438	Q	92.7	Very high	93.2	Very high	55 Å²	55	16.9 Å²	16.9	26%	0.257	10%	0.095	S	C	.	.	T	Hydrogen-bonded Turn	trans	59	49.5	-173.3	-64.5	179.9	-19.2	0	0	113.5	G434 Y474 S476	G434-Q438 VanDerWaalsContact O-CA 3.23Å; G434-Q438 WeakPolarHBondContact O-CA 3.32Å; G434-Q438 PolarHBondContact O-N 2.98Å; Q438-Y474 PolarHBondContact NE2-O 3.31Å; Q438-S476 VanDerWaalsContact CD-N 3.26Å
439	T	93.7	Very high	92.9	Very high	2 Å²	2	16.9 Å²	16.9	1%	0.012	9%	0.092	C	C	.	.			trans	-130	144.4	-175.7	58.8	0	0	0	0	112.3	F233 E236 V237 G434 T437 T442 N467	F233-T439 HydrophobicContact CD2-CG2 3.8Å; F233-T439 HydrophobicContact CE2-CG2 3.78Å; E236-T439 HydrophobicContact CB-CG2 4.09Å; E236-T439 WeakPolarHBondContact OE2-CA 3.34Å; E236-T439 WeakPolarHBondContact OE2-CB 3.44Å; V237-T439 HydrophobicContact CG2-CG2 3.43Å; V237-T439 VanDerWaalsContact CG2-CG2 3.43Å; G434-T439 VanDerWaalsContact CA-O 3.32Å; G434-T439 WeakPolarHBondContact CA-O 3.34Å; G434-T439 PolarHBondContact O-N 3.11Å; T437-T439 PolarHBondContact OG1-OG1 3.45Å; T439-T442 PolarHBondContact O-OG1 3.06Å; T439-T442 VanDerWaalsContact OG1-CG2 3.27Å; T439-T442 WeakPolarHBondContact OG1-CG2 3.2Å; T439-N467 PolarHBondContact O-ND2 3Å
440	V	94.6	Very high	92.5	Very high	66 Å²	66	19 Å²	19	40%	0.4	11%	0.105	S	C	.	.	S	Bend	trans	-94.6	-28.9	171.6	-179	0	0	0	0	110.9	E236 T442 A443 L460 V463	E236-V440 PolarHBondContact OE2-N 3.03Å; V440-T442 PolarHBondContact O-N 3.33Å; V440-A443 WeakPolarHBondContact O-CB 3.48Å; V440-A443 PolarHBondContact O-N 3.01Å; V440-L460 HydrophobicContact CG1-CD2 4.05Å; V440-V463 HydrophobicContact CB-CG1 4.42Å; V440-V463 HydrophobicContact CG1-CG1 4.31Å
441	S	94.8	Very high	92	Very high	3 Å²	3	22 Å²	22	2%	0.021	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	-19	174.2	53.7	0	0	0	0	116.3	F233 E236 A443 M444 I445	F233-S441 WeakPolarHBondContact CA-OG 3.05Å; F233-S441 WeakPolarHBondContact CB-OG 3.23Å; F233-S441 PolarHBondContact N-OG 2.68Å; E236-S441 VanDerWaalsContact CD-OG 3.28Å; E236-S441 WeakPolarHBondContact OE1-CB 3.16Å; E236-S441 PolarHBondContact OE1-N 3.44Å; E236-S441 VanDerWaalsContact OE2-CB 3.31Å; E236-S441 WeakPolarHBondContact OE2-CB 3.4Å; E236-S441 PolarHBondContact OE2-N 3.4Å; E236-S441 PolarHBondContact OE2-OG 3.28Å; S441-A443 PolarHBondContact O-N 2.92Å; S441-M444 PolarHBondContact O-N 2.95Å; S441-I445 PolarHBondContact O-N 3.14Å
442	T	93.6	Very high	91.3	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.006	16%	0.157	C	C	.	.	H	α-helix	trans	-58.1	-32.7	170.5	44.4	0	0	0	0	112.7	F233 F388 A430 T433 G434 T439 V440 I446	F233-T442 HydrophobicContact CE2-CG2 4.47Å; F388-T442 HydrophobicContact CE2-CG2 3.7Å; F388-T442 HydrophobicContact CZ-CG2 3.91Å; A430-T442 PolarHBondContact O-OG1 3.49Å; T433-T442 HydrophobicContact CG2-CG2 3.76Å; G434-T442 WeakPolarHBondContact CA-OG1 3.17Å; T439-T442 PolarHBondContact O-OG1 3.06Å; T439-T442 VanDerWaalsContact OG1-CG2 3.27Å; T439-T442 WeakPolarHBondContact OG1-CG2 3.2Å; V440-T442 PolarHBondContact O-N 3.33Å; T442-I446 WeakPolarHBondContact O-CB 3.48Å; T442-I446 WeakPolarHBondContact O-CG1 3.46Å; T442-I446 PolarHBondContact O-N 3.21Å
443	A	93.9	Very high	90.8	Very high	1 Å²	1	30.4 Å²	30.4	1%	0.008	18%	0.176	C	C	.	.	H	α-helix	trans	-60.6	-45.9	171.4	0	0	0	0	0	111.5	V440 S441 I446 F447 V459 L460 V463	V440-A443 WeakPolarHBondContact O-CB 3.48Å; V440-A443 PolarHBondContact O-N 3.01Å; S441-A443 PolarHBondContact O-N 2.92Å; A443-I446 PolarHBondContact O-N 3.1Å; A443-I446 VanDerWaalsContact O-N 3.17Å; A443-F447 HydrophobicContact CB-CE2 3.94Å; A443-F447 HydrophobicContact CB-CZ 4.05Å; A443-F447 WeakPolarHBondContact O-CD2 3.34Å; A443-F447 VanDerWaalsContact O-CG 3.24Å; A443-F447 WeakPolarHBondContact O-CG 3.3Å; A443-F447 PolarHBondContact O-N 3.49Å; A443-V459 HydrophobicContact CB-CG1 3.77Å; A443-L460 HydrophobicContact CB-CD2 3.57Å; A443-L460 HydrophobicContact CB-CG 4.33Å; A443-V463 HydrophobicContact CB-CG2 4.3Å
444	M	94	Very high	90.4	Very high	51 Å²	51	35.9 Å²	35.9	25%	0.251	21%	0.21	S	C	.	.	H	α-helix	trans	-68.2	-42.4	-178.5	-170	64.8	-155.1	0	0	112.3	I228 L232 S441 I446 F447 E448	I228-M444 HydrophobicContact CB-CE 3.94Å; I228-M444 HydrophobicContact CB-CG 4.36Å; I228-M444 HydrophobicContact CD1-CE 3.88Å; I228-M444 HydrophobicContact CG2-CE 3.96Å; I228-M444 HydrophobicContact CG2-CG 4.04Å; L232-M444 HydrophobicContact CD1-CB 4.41Å; L232-M444 HydrophobicContact CD1-CG 4.26Å; S441-M444 PolarHBondContact O-N 2.95Å; M444-I446 PolarHBondContact O-N 3.28Å; M444-F447 PolarHBondContact O-N 2.99Å; M444-F447 HydrophobicContact SD-CD2 4.16Å; M444-E448 HydrophobicContact CE-CG 4.05Å; M444-E448 PolarHBondContact O-N 2.94Å
445	I	92.6	Very high	89.8	Confident	0 Å²	0	39 Å²	39	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-54.4	-43.5	171	-67.2	167.6	0	0	0	109.8	F224 F233 F388 S441 E448 L449	F224-I445 HydrophobicContact CB-CG2 4.13Å; F224-I445 HydrophobicContact CD1-CG2 4.02Å; F224-I445 HydrophobicContact CD2-CD1 4.01Å; F224-I445 HydrophobicContact CD2-CG1 4.27Å; F224-I445 HydrophobicContact CD2-CG2 3.73Å; F224-I445 HydrophobicContact CE1-CG2 4.38Å; F224-I445 HydrophobicContact CE2-CD1 3.76Å; F224-I445 HydrophobicContact CE2-CG1 4.49Å; F224-I445 HydrophobicContact CE2-CG2 4.1Å; F224-I445 HydrophobicContact CG-CG2 3.69Å; F224-I445 HydrophobicContact CZ-CG2 4.43Å; F233-I445 HydrophobicContact CB-CD1 3.77Å; F233-I445 HydrophobicContact CD2-CD1 4.19Å; F233-I445 HydrophobicContact CG-CD1 4Å; F388-I445 HydrophobicContact CE2-CD1 4.07Å; F388-I445 HydrophobicContact CZ-CD1 3.92Å; F388-I445 HydrophobicContact CZ-CG2 4.3Å; S441-I445 PolarHBondContact O-N 3.14Å; I445-E448 PolarHBondContact O-N 3.4Å; I445-L449 HydrophobicContact CG2-CD1 3.78Å; I445-L449 HydrophobicContact CG2-CG 4.31Å; I445-L449 WeakPolarHBondContact O-CB 3.44Å; I445-L449 VanDerWaalsContact O-CG 3.27Å; I445-L449 WeakPolarHBondContact O-CG 3.15Å; I445-L449 PolarHBondContact O-N 3.03Å
446	I	91.2	Very high	89.5	Confident	1 Å²	1	42.4 Å²	42.4	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-69.8	-36.8	-179.7	-74.6	-71.4	0	0	0	112.9	F339 L392 V426 A429 A430 T442 A443 M444 E448 L449 T450	F339-I446 HydrophobicContact CZ-CD1 4.34Å; L392-I446 HydrophobicContact CD1-CD1 3.73Å; L392-I446 HydrophobicContact CD1-CG1 4.28Å; L392-I446 HydrophobicContact CD2-CD1 4.32Å; V426-I446 HydrophobicContact CG1-CG2 3.58Å; A429-I446 HydrophobicContact CB-CD1 4.46Å; A430-I446 HydrophobicContact CB-CB 4.34Å; A430-I446 HydrophobicContact CB-CG1 4.16Å; A430-I446 HydrophobicContact CB-CG2 4.42Å; T442-I446 WeakPolarHBondContact O-CB 3.48Å; T442-I446 WeakPolarHBondContact O-CG1 3.46Å; T442-I446 PolarHBondContact O-N 3.21Å; A443-I446 PolarHBondContact O-N 3.1Å; A443-I446 VanDerWaalsContact O-N 3.17Å; M444-I446 PolarHBondContact O-N 3.28Å; I446-E448 VanDerWaalsContact C-N 3.34Å; I446-E448 PolarHBondContact O-N 3.46Å; I446-L449 HydrophobicContact CD1-CD1 4.04Å; I446-L449 PolarHBondContact O-N 3.3Å; I446-T450 HydrophobicContact CG2-CG2 4.43Å; I446-T450 WeakPolarHBondContact O-CG2 3.43Å; I446-T450 PolarHBondContact O-N 3.37Å; I446-T450 PolarHBondContact O-OG1 3.4Å; I446-T450 VanDerWaalsContact O-OG1 3.14Å
447	F	89.9	Confident	89.4	Confident	11 Å²	11	46.1 Å²	46.1	5%	0.048	26%	0.26	C	S	.	.	H	α-helix	trans	-65.5	-34.6	173.1	-55.4	-39.9	0	0	0	113.1	A443 M444 T450 G451 Q452 I453 M456 V459 L460	A443-F447 HydrophobicContact CB-CE2 3.94Å; A443-F447 HydrophobicContact CB-CZ 4.05Å; A443-F447 WeakPolarHBondContact O-CD2 3.34Å; A443-F447 VanDerWaalsContact O-CG 3.24Å; A443-F447 WeakPolarHBondContact O-CG 3.3Å; A443-F447 PolarHBondContact O-N 3.49Å; M444-F447 PolarHBondContact O-N 2.99Å; M444-F447 HydrophobicContact SD-CD2 4.16Å; F447-T450 PolarHBondContact O-OG1 2.98Å; F447-G451 WeakPolarHBondContact O-CA 3.17Å; F447-G451 PolarHBondContact O-N 3.37Å; F447-Q452 PolarHBondContact O-N 2.99Å; F447-I453 HydrophobicContact CB-CG2 4.14Å; F447-I453 HydrophobicContact CG-CG2 4.42Å; F447-M456 HydrophobicContact CE1-CB 4.44Å; F447-M456 HydrophobicContact CE2-CB 4.5Å; F447-M456 HydrophobicContact CE2-CG 4.08Å; F447-M456 HydrophobicContact CZ-CB 4.11Å; F447-M456 HydrophobicContact CZ-CG 4.07Å; F447-V459 HydrophobicContact CE1-CB 3.69Å; F447-V459 HydrophobicContact CE1-CG1 3.71Å; F447-V459 HydrophobicContact CE1-CG2 3.96Å; F447-V459 HydrophobicContact CZ-CB 3.76Å; F447-V459 HydrophobicContact CZ-CG1 3.66Å; F447-L460 HydrophobicContact CE2-CG 4.36Å; F447-L460 HydrophobicContact CZ-CG 4.3Å
448	E	89.8	Confident	89.2	Confident	39 Å²	39	49.2 Å²	49.2	18%	0.182	28%	0.28	C	S	.	.	H	α-helix	trans	-72.5	-34.7	172.8	-81.3	167.4	-75.6	0	0	112.3	A226 P227 I228 G229 M444 I445 I446	A226-E448 VanDerWaalsContact C-OE2 3.22Å; A226-E448 WeakPolarHBondContact CA-OE2 3.35Å; A226-E448 HydrophobicContact CB-CB 3.55Å; A226-E448 HydrophobicContact CB-CG 4.19Å; P227-E448 WeakPolarHBondContact CD-OE2 3.42Å; P227-E448 VanDerWaalsContact N-OE2 3.09Å; I228-E448 PolarHBondContact N-OE2 3.48Å; G229-E448 WeakPolarHBondContact CA-OE1 3.48Å; G229-E448 PolarHBondContact N-OE1 3.37Å; M444-E448 HydrophobicContact CE-CG 4.05Å; M444-E448 PolarHBondContact O-N 2.94Å; I445-E448 PolarHBondContact O-N 3.4Å; I446-E448 VanDerWaalsContact C-N 3.34Å; I446-E448 PolarHBondContact O-N 3.46Å
449	L	86.2	Confident	89.1	Confident	14 Å²	14	46.6 Å²	46.6	7%	0.073	27%	0.268	C	S	.	.	H	α-helix	trans	-71.7	-36.8	175.7	-73.6	171.7	0	0	0	113.4	F224 Y277 I445 I446	F224-L449 HydrophobicContact CB-CD2 4.31Å; F224-L449 HydrophobicContact CD1-CD1 4.33Å; F224-L449 VanDerWaalsContact O-CD2 3.3Å; F224-L449 WeakPolarHBondContact O-CD2 3.28Å; Y277-L449 WeakPolarHBondContact O-CD2 3.42Å; I445-L449 HydrophobicContact CG2-CD1 3.78Å; I445-L449 HydrophobicContact CG2-CG 4.31Å; I445-L449 WeakPolarHBondContact O-CB 3.44Å; I445-L449 VanDerWaalsContact O-CG 3.27Å; I445-L449 WeakPolarHBondContact O-CG 3.15Å; I445-L449 PolarHBondContact O-N 3.03Å; I446-L449 HydrophobicContact CD1-CD1 4.04Å; I446-L449 PolarHBondContact O-N 3.3Å
450	T	84.8	Confident	89.1	Confident	43 Å²	43	49.1 Å²	49.1	26%	0.264	28%	0.281	S	S	.	.	H	α-helix	trans	-81.3	-20.2	174.3	60.5	0	0	0	0	112.9	F339 V426 I446 F447 Q452	F339-T450 HydrophobicContact CD2-CG2 4.43Å; F339-T450 HydrophobicContact CE2-CG2 4.18Å; V426-T450 HydrophobicContact CG1-CG2 4.24Å; V426-T450 HydrophobicContact CG2-CG2 4.04Å; I446-T450 HydrophobicContact CG2-CG2 4.43Å; I446-T450 WeakPolarHBondContact O-CG2 3.43Å; I446-T450 PolarHBondContact O-N 3.37Å; I446-T450 PolarHBondContact O-OG1 3.4Å; I446-T450 VanDerWaalsContact O-OG1 3.14Å; F447-T450 PolarHBondContact O-OG1 2.98Å; T450-Q452 PolarHBondContact O-N 2.64Å; T450-Q452 PolarHBondContact OG1-N 3.45Å; T450-Q452 PolarHBondContact OG1-O 2.94Å
451	G	82.9	Confident	89	Confident	63 Å²	63	50.9 Å²	50.9	65%	0.649	29%	0.288	S	S	*	.	S	Bend	trans	65.5	11.9	-168.9	0	0	0	0	0	114	F447	F447-G451 WeakPolarHBondContact O-CA 3.17Å; F447-G451 PolarHBondContact O-N 3.37Å
452	Q	79.3	Confident	88.9	Confident	116 Å²	116	51.8 Å²	51.8	54%	0.542	30%	0.297	S	S	.	.			trans	-135	121.3	-171	-66.3	-174.4	8.1	0	0	112.5	F447 T450	F447-Q452 PolarHBondContact O-N 2.99Å; T450-Q452 PolarHBondContact O-N 2.64Å; T450-Q452 PolarHBondContact OG1-N 3.45Å; T450-Q452 PolarHBondContact OG1-O 2.94Å
453	I	85.5	Confident	89	Confident	116 Å²	116	51.7 Å²	51.7	60%	0.595	30%	0.297	S	S	*	.			trans	-92.7	5.6	176.8	60.1	172.8	0	0	0	113.9	F447 H455 M456	F447-I453 HydrophobicContact CB-CG2 4.14Å; F447-I453 HydrophobicContact CG-CG2 4.42Å; I453-H455 VanDerWaalsContact C-N 3.26Å; I453-H455 PolarHBondContact O-N 2.84Å; I453-M456 WeakPolarHBondContact O-CB 3.5Å; I453-M456 PolarHBondContact O-N 3.39Å
454	V	84.1	Confident	89	Confident	115 Å²	115	54 Å²	54	70%	0.697	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-38.4	-175.8	-177.9	0	0	0	0	112	M456	V454-M456 VanDerWaalsContact C-N 3.3Å; V454-M456 PolarHBondContact O-N 3.3Å
455	H	80.2	Confident	89.1	Confident	66 Å²	66	55.9 Å²	55.9	31%	0.306	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.7	21.5	178.7	-56.9	-54	0	0	0	113.9	S423 I453 V457 P458 V459	S423-H455 WeakPolarHBondContact CB-NE2 3.42Å; I453-H455 VanDerWaalsContact C-N 3.26Å; I453-H455 PolarHBondContact O-N 2.84Å; H455-V457 PolarHBondContact O-N 3.03Å; H455-P458 WeakPolarHBondContact O-CD 3.14Å; H455-V459 HydrophobicContact CB-CG2 4.08Å; H455-V459 WeakPolarHBondContact O-CB 3.14Å; H455-V459 VanDerWaalsContact O-CG2 3.25Å; H455-V459 WeakPolarHBondContact O-CG2 3.09Å; H455-V459 PolarHBondContact O-N 2.98Å
456	M	89.3	Confident	89.2	Confident	90 Å²	90	57.1 Å²	57.1	44%	0.443	34%	0.337	S	S	.	.	H	α-helix	trans	-55.5	-47.3	-173.2	179.6	176.3	-176.2	0	0	113.8	F447 I453 V454 L460	F447-M456 HydrophobicContact CE1-CB 4.44Å; F447-M456 HydrophobicContact CE2-CB 4.5Å; F447-M456 HydrophobicContact CE2-CG 4.08Å; F447-M456 HydrophobicContact CZ-CB 4.11Å; F447-M456 HydrophobicContact CZ-CG 4.07Å; I453-M456 WeakPolarHBondContact O-CB 3.5Å; I453-M456 PolarHBondContact O-N 3.39Å; V454-M456 VanDerWaalsContact C-N 3.3Å; V454-M456 PolarHBondContact O-N 3.3Å; M456-L460 HydrophobicContact CE-CD1 3.68Å; M456-L460 HydrophobicContact CG-CD1 3.69Å; M456-L460 HydrophobicContact CG-CG 4.46Å; M456-L460 WeakPolarHBondContact O-CB 3.22Å; M456-L460 WeakPolarHBondContact O-CG 3.39Å; M456-L460 PolarHBondContact O-N 3.29Å
457	V	90.9	Very high	89.3	Confident	110 Å²	110	57.8 Å²	57.8	67%	0.667	34%	0.34	S	S	*	.	H	α-helix	trans	-69.2	-50.3	-177.3	177	0	0	0	0	112.2	H455 V459 L460 L461	H455-V457 PolarHBondContact O-N 3.03Å; V457-V459 PolarHBondContact O-N 3.03Å; V457-L460 PolarHBondContact O-N 2.84Å; V457-L461 VanDerWaalsContact O-CB 3.32Å; V457-L461 WeakPolarHBondContact O-CB 3.35Å; V457-L461 PolarHBondContact O-N 3.06Å
458	P	89.2	Confident	89.5	Confident	70 Å²	70	63.1 Å²	63.1	46%	0.455	37%	0.369	S	S	.	.	H	α-helix	trans	-57.4	-42.8	174.1	-27.6	35.2	0	0	0	114.2	V427 H455 G462	V427-P458 HydrophobicContact CG2-CB 4.19Å; H455-P458 WeakPolarHBondContact O-CD 3.14Å; P458-G462 PolarHBondContact O-N 3Å
459	V	90.3	Very high	89.7	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-65.5	-48	179.8	171.3	0	0	0	0	111	V426 V427 A430 A443 F447 H455 V457 L461 G462 V463	V426-V459 HydrophobicContact CG1-CG2 4.12Å; V427-V459 HydrophobicContact CB-CG2 4.47Å; V427-V459 HydrophobicContact CG2-CG2 3.67Å; A430-V459 HydrophobicContact CB-CG1 3.66Å; A443-V459 HydrophobicContact CB-CG1 3.77Å; F447-V459 HydrophobicContact CE1-CB 3.69Å; F447-V459 HydrophobicContact CE1-CG1 3.71Å; F447-V459 HydrophobicContact CE1-CG2 3.96Å; F447-V459 HydrophobicContact CZ-CB 3.76Å; F447-V459 HydrophobicContact CZ-CG1 3.66Å; H455-V459 HydrophobicContact CB-CG2 4.08Å; H455-V459 WeakPolarHBondContact O-CB 3.14Å; H455-V459 VanDerWaalsContact O-CG2 3.25Å; H455-V459 WeakPolarHBondContact O-CG2 3.09Å; H455-V459 PolarHBondContact O-N 2.98Å; V457-V459 PolarHBondContact O-N 3.03Å; V459-L461 PolarHBondContact O-N 3.29Å; V459-G462 PolarHBondContact O-N 3.46Å; V459-V463 HydrophobicContact CG1-CG2 4.43Å; V459-V463 WeakPolarHBondContact O-CB 3.16Å; V459-V463 VanDerWaalsContact O-CG2 3.23Å; V459-V463 WeakPolarHBondContact O-CG2 3.28Å; V459-V463 PolarHBondContact O-N 2.92Å
460	L	93.8	Very high	90	Very high	56 Å²	56	66.5 Å²	66.5	29%	0.293	39%	0.389	S	S	.	.	H	α-helix	trans	-65.5	-38.2	179	-74.2	171.6	0	0	0	112.5	V440 A443 F447 M456 V457 A464	V440-L460 HydrophobicContact CG1-CD2 4.05Å; A443-L460 HydrophobicContact CB-CD2 3.57Å; A443-L460 HydrophobicContact CB-CG 4.33Å; F447-L460 HydrophobicContact CE2-CG 4.36Å; F447-L460 HydrophobicContact CZ-CG 4.3Å; M456-L460 HydrophobicContact CE-CD1 3.68Å; M456-L460 HydrophobicContact CG-CD1 3.69Å; M456-L460 HydrophobicContact CG-CG 4.46Å; M456-L460 WeakPolarHBondContact O-CB 3.22Å; M456-L460 WeakPolarHBondContact O-CG 3.39Å; M456-L460 PolarHBondContact O-N 3.29Å; V457-L460 PolarHBondContact O-N 2.84Å; L460-A464 VanDerWaalsContact O-CB 3.25Å; L460-A464 WeakPolarHBondContact O-CB 3.32Å; L460-A464 PolarHBondContact O-N 2.9Å
461	L	93.6	Very high	90.2	Very high	103 Å²	103	68.5 Å²	68.5	54%	0.539	40%	0.402	S	S	.	.	H	α-helix	trans	-65.7	-46	175.8	-179.3	60.5	0	0	0	111.5	V457 V459 A464 L465	V457-L461 VanDerWaalsContact O-CB 3.32Å; V457-L461 WeakPolarHBondContact O-CB 3.35Å; V457-L461 PolarHBondContact O-N 3.06Å; V459-L461 PolarHBondContact O-N 3.29Å; L461-A464 PolarHBondContact O-N 3.4Å; L461-L465 HydrophobicContact CD1-CD1 3.97Å; L461-L465 HydrophobicContact CD1-CG 4.16Å; L461-L465 HydrophobicContact CG-CD1 4.03Å; L461-L465 WeakPolarHBondContact O-CB 3.22Å; L461-L465 WeakPolarHBondContact O-CG 3.41Å; L461-L465 PolarHBondContact O-N 2.69Å
462	G	92	Very high	90.5	Very high	21 Å²	21	75.3 Å²	75.3	22%	0.216	41%	0.409	C	S	.	.	H	α-helix	trans	-60.1	-45.3	176.1	0	0	0	0	0	112.4	P458 V459 A466	P458-G462 PolarHBondContact O-N 3Å; V459-G462 PolarHBondContact O-N 3.46Å; G462-A466 WeakPolarHBondContact O-CB 3.43Å; G462-A466 PolarHBondContact O-N 3.46Å
463	V	94.8	Very high	91	Very high	0 Å²	0	74.6 Å²	74.6	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-62.7	-45.6	174.8	170.9	0	0	0	0	111.6	A430 A431 V440 A443 V459 L465 A466 N467	A430-V463 HydrophobicContact CB-CG2 3.73Å; A431-V463 HydrophobicContact CB-CG2 4.37Å; V440-V463 HydrophobicContact CB-CG1 4.42Å; V440-V463 HydrophobicContact CG1-CG1 4.31Å; A443-V463 HydrophobicContact CB-CG2 4.3Å; V459-V463 HydrophobicContact CG1-CG2 4.43Å; V459-V463 WeakPolarHBondContact O-CB 3.16Å; V459-V463 VanDerWaalsContact O-CG2 3.23Å; V459-V463 WeakPolarHBondContact O-CG2 3.28Å; V459-V463 PolarHBondContact O-N 2.92Å; V463-L465 PolarHBondContact O-N 3.47Å; V463-A466 PolarHBondContact O-N 2.91Å; V463-N467 WeakPolarHBondContact O-CB 3.43Å; V463-N467 PolarHBondContact O-N 2.69Å; V463-N467 PolarHBondContact O-ND2 3.47Å; V463-N467 PolarHBondContact O-OD1 3.16Å
464	A	94.6	Very high	91	Very high	50 Å²	50	77.1 Å²	77.1	41%	0.413	41%	0.412	S	S	.	.	H	α-helix	trans	-62.7	-44.4	180	0	0	0	0	0	112.5	L460 L461 L468	L460-A464 VanDerWaalsContact O-CB 3.25Å; L460-A464 WeakPolarHBondContact O-CB 3.32Å; L460-A464 PolarHBondContact O-N 2.9Å; L461-A464 PolarHBondContact O-N 3.4Å; A464-L468 WeakPolarHBondContact O-CB 3.32Å; A464-L468 PolarHBondContact O-N 3.02Å
465	L	95.2	Very high	91.1	Very high	90 Å²	90	75 Å²	75	47%	0.471	40%	0.4	S	S	.	.	H	α-helix	trans	-66.8	-44.9	177.3	-69.3	171.8	0	0	0	111.8	L461 V463 N467 L468 I469	L461-L465 HydrophobicContact CD1-CD1 3.97Å; L461-L465 HydrophobicContact CD1-CG 4.16Å; L461-L465 HydrophobicContact CG-CD1 4.03Å; L461-L465 WeakPolarHBondContact O-CB 3.22Å; L461-L465 WeakPolarHBondContact O-CG 3.41Å; L461-L465 PolarHBondContact O-N 2.69Å; V463-L465 PolarHBondContact O-N 3.47Å; L465-N467 VanDerWaalsContact C-N 3.35Å; L465-N467 PolarHBondContact O-N 2.81Å; L465-L468 PolarHBondContact O-N 3.1Å; L465-I469 WeakPolarHBondContact O-CG1 3.22Å; L465-I469 PolarHBondContact O-N 2.99Å
466	A	95.3	Very high	91.6	Very high	26 Å²	26	72 Å²	72	22%	0.215	39%	0.387	C	S	.	.	H	α-helix	trans	-63.9	-40.2	178	0	0	0	0	0	111.7	A431 A435 G462 V463 A470	A431-A466 HydrophobicContact CB-CB 4.07Å; A431-A466 WeakPolarHBondContact O-CB 3.38Å; A435-A466 HydrophobicContact CB-CB 4.03Å; G462-A466 WeakPolarHBondContact O-CB 3.43Å; G462-A466 PolarHBondContact O-N 3.46Å; V463-A466 PolarHBondContact O-N 2.91Å; A466-A470 WeakPolarHBondContact O-CB 3.34Å; A466-A470 PolarHBondContact O-N 3.19Å
467	N	93.7	Very high	91.6	Very high	14 Å²	14	70.1 Å²	70.1	8%	0.075	38%	0.381	C	S	.	.	H	α-helix	trans	-64.6	-41.4	174.5	-71.4	-1.7	0	0	0	112.4	G434 A435 T439 V463 L465 A470 T471	G434-N467 WeakPolarHBondContact CA-OD1 3.38Å; G434-N467 PolarHBondContact O-OD1 3.16Å; G434-N467 VanDerWaalsContact O-OD1 3.09Å; A435-N467 WeakPolarHBondContact CA-OD1 3.49Å; A435-N467 PolarHBondContact N-OD1 2.93Å; T439-N467 PolarHBondContact O-ND2 3Å; V463-N467 WeakPolarHBondContact O-CB 3.43Å; V463-N467 PolarHBondContact O-N 2.69Å; V463-N467 PolarHBondContact O-ND2 3.47Å; V463-N467 PolarHBondContact O-OD1 3.16Å; L465-N467 VanDerWaalsContact C-N 3.35Å; L465-N467 PolarHBondContact O-N 2.81Å; N467-A470 PolarHBondContact O-N 3.38Å; N467-T471 VanDerWaalsContact O-CB 3.24Å; N467-T471 WeakPolarHBondContact O-CB 3.16Å; N467-T471 PolarHBondContact O-N 3.48Å; N467-T471 PolarHBondContact O-OG1 3.49Å
468	L	94	Very high	91.5	Very high	124 Å²	124	65.3 Å²	65.3	65%	0.649	35%	0.35	S	S	*	.	H	α-helix	trans	-62.1	-48.8	178.1	179.4	63.1	0	0	0	111.3	A464 L465 Y472	A464-L468 WeakPolarHBondContact O-CB 3.32Å; A464-L468 PolarHBondContact O-N 3.02Å; L465-L468 PolarHBondContact O-N 3.1Å; L468-Y472 PolarHBondContact O-N 2.69Å
469	I	94.7	Very high	91.4	Very high	105 Å²	105	63.1 Å²	63.1	54%	0.538	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-46.7	177.7	-65.3	165.1	0	0	0	110.5	L465 T471 Y472 L473	L465-I469 WeakPolarHBondContact O-CG1 3.22Å; L465-I469 PolarHBondContact O-N 2.99Å; I469-T471 PolarHBondContact O-N 3.45Å; I469-Y472 PolarHBondContact O-N 3.4Å; I469-L473 HydrophobicContact CG2-CD1 3.86Å; I469-L473 WeakPolarHBondContact O-CG 3.27Å; I469-L473 PolarHBondContact O-N 3.48Å
470	A	92.3	Very high	91.3	Very high	18 Å²	18	66.2 Å²	66.2	15%	0.149	35%	0.351	C	S	.	.	H	α-helix	trans	-62	-43.8	179.6	0	0	0	0	0	112.3	A435 A466 N467 Y472 L473 Y474	A435-A470 HydrophobicContact CB-CB 3.8Å; A435-A470 WeakPolarHBondContact O-CB 3.32Å; A466-A470 WeakPolarHBondContact O-CB 3.34Å; A466-A470 PolarHBondContact O-N 3.19Å; N467-A470 PolarHBondContact O-N 3.38Å; A470-Y472 VanDerWaalsContact C-N 3.26Å; A470-Y472 PolarHBondContact O-N 2.95Å; A470-L473 PolarHBondContact O-N 3.39Å; A470-Y474 PolarHBondContact O-N 3.11Å
471	T	88.8	Confident	90.7	Very high	86 Å²	86	64.5 Å²	64.5	53%	0.528	35%	0.346	S	S	.	.	H	α-helix	trans	-66.3	-27.2	-180	-54.6	0	0	0	0	112.8	N467 I469	N467-T471 VanDerWaalsContact O-CB 3.24Å; N467-T471 WeakPolarHBondContact O-CB 3.16Å; N467-T471 PolarHBondContact O-N 3.48Å; N467-T471 PolarHBondContact O-OG1 3.49Å; I469-T471 PolarHBondContact O-N 3.45Å
472	Y	89.1	Confident	90.2	Very high	205 Å²	205	59.7 Å²	59.7	80%	0.804	32%	0.321	S	S	*	.	H	α-helix	trans	-74.3	-38	172.6	-178.5	-100	0	0	0	112.7	L468 I469 A470	L468-Y472 PolarHBondContact O-N 2.69Å; I469-Y472 PolarHBondContact O-N 3.4Å; A470-Y472 VanDerWaalsContact C-N 3.26Å; A470-Y472 PolarHBondContact O-N 2.95Å
473	L	88.7	Confident	89.6	Confident	101 Å²	101	63.5 Å²	63.5	53%	0.529	33%	0.333	S	S	.	.	H	α-helix	trans	-88.7	-40	-173.3	-64.7	173.9	0	0	0	114.2	I469 A470	I469-L473 HydrophobicContact CG2-CD1 3.86Å; I469-L473 WeakPolarHBondContact O-CG 3.27Å; I469-L473 PolarHBondContact O-N 3.48Å; A470-L473 PolarHBondContact O-N 3.39Å
474	Y	87.2	Confident	88.9	Confident	170 Å²	170	68.4 Å²	68.4	67%	0.667	37%	0.366	S	S	*	.			trans	-146.2	153.5	-171	-60.4	-73.3	0	0	0	112.1	Q438 A470	Q438-Y474 PolarHBondContact NE2-O 3.31Å; A470-Y474 PolarHBondContact O-N 3.11Å
475	P	85.5	Confident	88.1	Confident	69 Å²	69	70.2 Å²	70.2	45%	0.448	37%	0.365	S	S	.	.			trans	-77	157.9	167	31.1	-32.5	0	0	0	111.8	D479 I480	P475-D479 HydrophobicContact CB-CB 4.48Å; P475-I480 HydrophobicContact CG-CD1 4.3Å; P475-I480 HydrophobicContact CG-CG1 3.8Å
476	S	89.8	Confident	87.3	Confident	3 Å²	3	73.1 Å²	73.1	2%	0.021	37%	0.374	C	S	.	.			trans	-53.4	147	177.3	86.2	0	0	0	0	112.2	Q438 Y478 D479 I480	Q438-S476 VanDerWaalsContact CD-N 3.26Å; S476-Y478 PolarHBondContact O-N 3.5Å; S476-Y478 VanDerWaalsContact O-N 3.09Å; S476-Y478 PolarHBondContact OG-N 3.37Å; S476-D479 PolarHBondContact O-N 3.42Å; S476-D479 PolarHBondContact OG-N 3.11Å; S476-D479 VanDerWaalsContact OG-N 3.12Å; S476-D479 PolarHBondContact OG-OD2 3.4Å; S476-I480 WeakPolarHBondContact O-CG1 3.39Å; S476-I480 PolarHBondContact O-N 3.04Å
477	V	89.4	Confident	86.5	Confident	52 Å²	52	72.8 Å²	72.8	32%	0.315	37%	0.368	S	S	.	.	H	α-helix	trans	-62.4	-23	179.5	-179.7	0	0	0	0	112.3	L387 V436 G481	L387-V477 HydrophobicContact CD2-CB 3.89Å; L387-V477 HydrophobicContact CD2-CG1 3.45Å; L387-V477 VanDerWaalsContact CD2-CG1 3.45Å; L387-V477 HydrophobicContact CD2-CG2 4.35Å; V436-V477 HydrophobicContact CG1-CB 4.39Å; V436-V477 HydrophobicContact CG1-CG2 3.67Å; V436-V477 PolarHBondContact O-N 3.27Å; V477-G481 PolarHBondContact O-N 3.46Å
478	Y	90.1	Very high	85.5	Confident	8 Å²	8	74.3 Å²	74.3	3%	0.031	38%	0.379	C	S	.	.	H	α-helix	trans	-71.9	-37.7	172.1	-58.7	-54.8	0	0	0	112.8	I136 F233 V237 T437 S476 G481 I482	I136-Y478 HydrophobicContact CB-CD1 3.93Å; I136-Y478 HydrophobicContact CB-CE1 3.98Å; I136-Y478 HydrophobicContact CD1-CD1 4.48Å; I136-Y478 HydrophobicContact CD1-CE1 3.72Å; I136-Y478 HydrophobicContact CD1-CE2 4.46Å; I136-Y478 HydrophobicContact CG1-CE1 4.43Å; I136-Y478 HydrophobicContact CG2-CD1 3.53Å; I136-Y478 HydrophobicContact CG2-CD2 4.14Å; I136-Y478 HydrophobicContact CG2-CE1 3.84Å; I136-Y478 HydrophobicContact CG2-CE2 4.39Å; I136-Y478 HydrophobicContact CG2-CG 3.69Å; F233-Y478 HydrophobicContact CZ-CE2 4.28Å; V237-Y478 HydrophobicContact CG1-CD2 3.54Å; V237-Y478 HydrophobicContact CG1-CE2 3.79Å; V237-Y478 HydrophobicContact CG1-CG 4.19Å; V237-Y478 HydrophobicContact CG2-CD2 4.42Å; V237-Y478 HydrophobicContact CG2-CE2 4.19Å; T437-Y478 HydrophobicContact CG2-CE2 3.67Å; S476-Y478 PolarHBondContact O-N 3.5Å; S476-Y478 VanDerWaalsContact O-N 3.09Å; S476-Y478 PolarHBondContact OG-N 3.37Å; Y478-G481 PolarHBondContact O-N 3.42Å; Y478-I482 WeakPolarHBondContact O-CG1 3.12Å; Y478-I482 PolarHBondContact O-N 2.88Å
479	D	87.1	Confident	84.5	Confident	24 Å²	24	68.8 Å²	68.8	13%	0.128	35%	0.349	C	S	.	.	H	α-helix	trans	-72.9	-34.4	173.4	-65.4	-65.9	0	0	0	111.8	K140 P475 S476 G481 I482 H483 Y489	K140-D479 IonicContact NZ-OD1 2.63Å; K140-D479 PolarHBondContact NZ-OD1 2.93Å; K140-D479 IonicContact NZ-OD2 2.84Å; K140-D479 PolarHBondContact NZ-OD2 2.9Å; P475-D479 HydrophobicContact CB-CB 4.48Å; S476-D479 PolarHBondContact O-N 3.42Å; S476-D479 PolarHBondContact OG-N 3.11Å; S476-D479 VanDerWaalsContact OG-N 3.12Å; S476-D479 PolarHBondContact OG-OD2 3.4Å; D479-G481 VanDerWaalsContact C-N 3.32Å; D479-I482 WeakPolarHBondContact O-CB 3.29Å; D479-I482 PolarHBondContact O-N 3.25Å; D479-H483 PolarHBondContact O-CD2 3.49Å; D479-H483 PolarHBondContact O-N 3Å; D479-Y489 WeakPolarHBondContact OD1-CE1 3.48Å; D479-Y489 VanDerWaalsContact OD1-CZ 3.3Å; D479-Y489 PolarHBondContact OD1-OH 3.41Å
480	I	86.8	Confident	83.6	Confident	66 Å²	66	64.2 Å²	64.2	34%	0.338	33%	0.326	S	S	.	.	H	α-helix	trans	-58.2	-47.2	166.9	-62.6	174.8	0	0	0	109.8	P475 S476 I482 H483 C484	P475-I480 HydrophobicContact CG-CD1 4.3Å; P475-I480 HydrophobicContact CG-CG1 3.8Å; S476-I480 WeakPolarHBondContact O-CG1 3.39Å; S476-I480 PolarHBondContact O-N 3.04Å; I480-I482 VanDerWaalsContact C-N 3.3Å; I480-I482 PolarHBondContact O-N 3.04Å; I480-H483 PolarHBondContact O-N 3.14Å; I480-H483 VanDerWaalsContact O-N 3.11Å; I480-C484 WeakPolarHBondContact O-CB 3.23Å; I480-C484 PolarHBondContact O-N 3.29Å; I480-C484 PolarHBondContact O-SG 3.2Å; I480-C484 VanDerWaalsContact O-SG 3.36Å
481	G	82.4	Confident	82.6	Confident	19 Å²	19	63.6 Å²	63.6	20%	0.196	32%	0.32	C	S	.	.	H	α-helix	trans	-58.7	-37	176.5	0	0	0	0	0	113.8	V477 Y478 D479 K485	V477-G481 PolarHBondContact O-N 3.46Å; Y478-G481 PolarHBondContact O-N 3.42Å; D479-G481 VanDerWaalsContact C-N 3.32Å; G481-K485 WeakPolarHBondContact O-CB 3.3Å; G481-K485 WeakPolarHBondContact O-CG 3.48Å; G481-K485 PolarHBondContact O-N 3.42Å; G481-K485 VanDerWaalsContact O-N 3.1Å
482	I	83.6	Confident	81.7	Confident	2 Å²	2	63.2 Å²	63.2	1%	0.01	32%	0.315	C	S	.	.	H	α-helix	trans	-63	-49	172	-73.4	177.3	0	0	0	111	P137 K140 T141 Y478 D479 I480 K485 K486 L487 Y489	P137-I482 HydrophobicContact CB-CG1 3.73Å; K140-I482 HydrophobicContact CB-CD1 4.26Å; K140-I482 HydrophobicContact CD-CD1 3.93Å; K140-I482 HydrophobicContact CG-CD1 4.3Å; T141-I482 HydrophobicContact CG2-CD1 4.14Å; T141-I482 HydrophobicContact CG2-CG1 4.34Å; Y478-I482 WeakPolarHBondContact O-CG1 3.12Å; Y478-I482 PolarHBondContact O-N 2.88Å; D479-I482 WeakPolarHBondContact O-CB 3.29Å; D479-I482 PolarHBondContact O-N 3.25Å; I480-I482 VanDerWaalsContact C-N 3.3Å; I480-I482 PolarHBondContact O-N 3.04Å; I482-K485 PolarHBondContact O-N 3.12Å; I482-K486 PolarHBondContact O-N 3.44Å; I482-K486 VanDerWaalsContact O-N 3.12Å; I482-L487 HydrophobicContact CG1-CD1 4.39Å; I482-L487 HydrophobicContact CG2-CB 4.23Å; I482-L487 PolarHBondContact O-N 3.35Å; I482-Y489 HydrophobicContact CD1-CD1 4.13Å; I482-Y489 HydrophobicContact CD1-CD2 3.74Å; I482-Y489 HydrophobicContact CD1-CE1 3.99Å; I482-Y489 HydrophobicContact CD1-CE2 3.6Å; I482-Y489 HydrophobicContact CD1-CG 3.97Å; I482-Y489 VanDerWaalsContact CG2-CB 3.48Å; I482-Y489 HydrophobicContact CG2-CD1 3.63Å; I482-Y489 HydrophobicContact CG2-CD2 4.45Å; I482-Y489 HydrophobicContact CG2-CE1 4.31Å; I482-Y489 HydrophobicContact CG2-CG 3.68Å
483	H	79	Confident	80.8	Confident	101 Å²	101	54.4 Å²	54.4	47%	0.468	28%	0.282	S	S	.	.	H	α-helix	trans	-65.4	-44.7	-179.3	-75.3	-57.4	0	0	0	112.3	D479 I480 K485 K486	D479-H483 PolarHBondContact O-CD2 3.49Å; D479-H483 PolarHBondContact O-N 3Å; I480-H483 PolarHBondContact O-N 3.14Å; I480-H483 VanDerWaalsContact O-N 3.11Å; H483-K485 VanDerWaalsContact C-N 3.33Å; H483-K485 PolarHBondContact O-N 3.02Å; H483-K486 PolarHBondContact O-N 3.27Å
484	C	79.4	Confident	79.7	Confident	103 Å²	103	55.7 Å²	55.7	70%	0.696	29%	0.288	S	S	*	.	H	α-helix	trans	-62.5	-36.8	176.2	-68	0	0	0	0	112.9	I480 K486	I480-C484 WeakPolarHBondContact O-CB 3.23Å; I480-C484 PolarHBondContact O-N 3.29Å; I480-C484 PolarHBondContact O-SG 3.2Å; I480-C484 VanDerWaalsContact O-SG 3.36Å; C484-K486 VanDerWaalsContact C-N 3.27Å; C484-K486 PolarHBondContact O-N 2.96Å
485	K	78.6	Confident	78.5	Confident	89 Å²	89	51.4 Å²	51.4	39%	0.387	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.5	174.6	-70.7	-177.8	172.5	-174.1	0	113.8	E138 G481 I482 H483 L487	E138-K485 VanDerWaalsContact CD-NZ 3.34Å; E138-K485 IonicContact OE1-NZ 3.12Å; E138-K485 PolarHBondContact OE1-NZ 2.99Å; E138-K485 IonicContact OE2-NZ 2.65Å; E138-K485 PolarHBondContact OE2-NZ 3.23Å; G481-K485 WeakPolarHBondContact O-CB 3.3Å; G481-K485 WeakPolarHBondContact O-CG 3.48Å; G481-K485 PolarHBondContact O-N 3.42Å; G481-K485 VanDerWaalsContact O-N 3.1Å; I482-K485 PolarHBondContact O-N 3.12Å; H483-K485 VanDerWaalsContact C-N 3.33Å; H483-K485 PolarHBondContact O-N 3.02Å; K485-L487 HydrophobicContact CB-CD1 4.07Å; K485-L487 HydrophobicContact CB-CD2 4.39Å; K485-L487 HydrophobicContact CB-CG 3.7Å; K485-L487 HydrophobicContact CD-CD1 4.18Å; K485-L487 PolarHBondContact O-N 3.25Å; K485-L487 VanDerWaalsContact O-N 3.14Å
486	K	77.3	Confident	77.4	Confident	151 Å²	151	53.8 Å²	53.8	66%	0.657	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	36.7	-171.8	-64.6	-175.9	171	-174.8	0	112.9	I482 H483 C484 Y782	I482-K486 PolarHBondContact O-N 3.44Å; I482-K486 VanDerWaalsContact O-N 3.12Å; H483-K486 PolarHBondContact O-N 3.27Å; C484-K486 VanDerWaalsContact C-N 3.27Å; C484-K486 PolarHBondContact O-N 2.96Å; K486-Y782 HydrophobicContact CD-CE1 4.38Å; K486-Y782 PolarHBondContact NZ-OH 3.35Å
487	L	79.3	Confident	76.2	Confident	19 Å²	19	55.6 Å²	55.6	10%	0.099	31%	0.308	C	S	.	.			trans	-68.5	142.3	-173.9	-71.9	170.9	0	0	0	110.8	P137 E138 T141 L148 I482 K485 Y489	P137-L487 HydrophobicContact CB-CD1 4.01Å; E138-L487 HydrophobicContact CG-CD1 3.84Å; E138-L487 HydrophobicContact CG-CD2 4.36Å; T141-L487 HydrophobicContact CG2-CB 3.87Å; T141-L487 HydrophobicContact CG2-CD1 4.26Å; L148-L487 HydrophobicContact CD1-CD2 4.24Å; I482-L487 HydrophobicContact CG1-CD1 4.39Å; I482-L487 HydrophobicContact CG2-CB 4.23Å; I482-L487 PolarHBondContact O-N 3.35Å; K485-L487 HydrophobicContact CB-CD1 4.07Å; K485-L487 HydrophobicContact CB-CD2 4.39Å; K485-L487 HydrophobicContact CB-CG 3.7Å; K485-L487 HydrophobicContact CD-CD1 4.18Å; K485-L487 PolarHBondContact O-N 3.25Å; K485-L487 VanDerWaalsContact O-N 3.14Å; L487-Y489 VanDerWaalsContact C-N 3.28Å; L487-Y489 PolarHBondContact O-N 3.45Å
488	P	73.3	Confident	75.2	Confident	45 Å²	45	57.1 Å²	57.1	29%	0.292	32%	0.321	S	S	.	.			trans	-68.1	83.1	178.8	28.2	-36.1	0	0	0	111.4	V146 L148 R750	V146-P488 HydrophobicContact CG1-CB 4.07Å; V146-P488 HydrophobicContact CG1-CG 3.73Å; V146-P488 WeakPolarHBondContact CG2-O 3.41Å; L148-P488 HydrophobicContact CD2-CG 4.33Å; P488-R750 VanDerWaalsContact C-CZ 3.43Å; P488-R750 PolarHBondContact O-NH2 3.31Å
489	Y	72.8	Confident	74.4	Confident	9 Å²	9	58.3 Å²	58.3	4%	0.035	33%	0.332	C	S	.	.			trans	-113.2	138.5	-176.7	-178.9	-125.5	0	0	0	109.9	K140 T141 R144 D479 I482 L487 P491 R750	K140-Y489 HydrophobicContact CD-CE2 4.35Å; K140-Y489 WeakPolarHBondContact CE-OH 3.45Å; K140-Y489 HydrophobicContact CG-CE2 4.13Å; K140-Y489 PolarHBondContact NZ-OH 3.33Å; T141-Y489 HydrophobicContact CG2-CD2 4Å; T141-Y489 HydrophobicContact CG2-CG 4.42Å; R144-Y489 VanDerWaalsContact CZ-CE2 3.5Å; R144-Y489 PolarHBondContact NH2-OH 3.45Å; D479-Y489 WeakPolarHBondContact OD1-CE1 3.48Å; D479-Y489 VanDerWaalsContact OD1-CZ 3.3Å; D479-Y489 PolarHBondContact OD1-OH 3.41Å; I482-Y489 HydrophobicContact CD1-CD1 4.13Å; I482-Y489 HydrophobicContact CD1-CD2 3.74Å; I482-Y489 HydrophobicContact CD1-CE1 3.99Å; I482-Y489 HydrophobicContact CD1-CE2 3.6Å; I482-Y489 HydrophobicContact CD1-CG 3.97Å; I482-Y489 VanDerWaalsContact CG2-CB 3.48Å; I482-Y489 HydrophobicContact CG2-CD1 3.63Å; I482-Y489 HydrophobicContact CG2-CD2 4.45Å; I482-Y489 HydrophobicContact CG2-CE1 4.31Å; I482-Y489 HydrophobicContact CG2-CG 3.68Å; L487-Y489 VanDerWaalsContact C-N 3.28Å; L487-Y489 PolarHBondContact O-N 3.45Å; Y489-P491 HydrophobicContact CD1-CB 3.77Å; Y489-P491 HydrophobicContact CE1-CB 3.85Å; Y489-P491 WeakPolarHBondContact O-CD 3.33Å; Y489-R750 VanDerWaalsContact C-NE 3.33Å; Y489-R750 VanDerWaalsContact O-CD 3.24Å; Y489-R750 WeakPolarHBondContact O-CD 3.34Å; Y489-R750 WeakPolarHBondContact O-CG 3.35Å; Y489-R750 PolarHBondContact O-NE 2.69Å
490	L	74.6	Confident	73.9	Confident	9 Å²	9	57.3 Å²	57.3	5%	0.047	33%	0.327	C	S	.	.			trans	-93.5	106.2	166.6	-173.6	72.3	0	0	0	106.4	R144 L746 L749 R750 V753	R144-L490 PolarHBondContact NH1-O 2.86Å; L490-L746 HydrophobicContact CB-CD1 4.31Å; L490-L746 HydrophobicContact CD2-CD1 3.88Å; L490-L749 HydrophobicContact CD1-CD2 4.29Å; L490-L749 HydrophobicContact CD1-CG 4.06Å; L490-L749 HydrophobicContact CD2-CD2 3.83Å; L490-L749 HydrophobicContact CD2-CG 4.47Å; L490-R750 HydrophobicContact CD1-CB 4.17Å; L490-V753 HydrophobicContact CD1-CG2 4.36Å
491	P	71.8	Confident	73.7	Confident	5 Å²	5	58 Å²	58	3%	0.032	33%	0.329	C	S	.	.	P	Polyproline II helix	trans	-85.3	150.4	-169.9	35.8	-36.8	0	0	0	111.3	Y489 L493 H721 V753	Y489-P491 HydrophobicContact CD1-CB 3.77Å; Y489-P491 HydrophobicContact CE1-CB 3.85Å; Y489-P491 WeakPolarHBondContact O-CD 3.33Å; P491-L493 PolarHBondContact O-N 2.93Å; P491-H721 PolarHBondContact O-NE2 3.35Å; P491-V753 HydrophobicContact CG-CG1 3.7Å
492	N	71	Confident	73.8	Confident	77 Å²	77	66.9 Å²	66.9	41%	0.412	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-57.5	134.8	-179.7	-67.7	12.9	0	0	0	111.2	R144 R757	R144-N492 VanDerWaalsContact CZ-OD1 3.27Å; R144-N492 PolarHBondContact NH1-OD1 3.01Å; R144-N492 PolarHBondContact NH2-OD1 2.64Å; N492-R757 PolarHBondContact O-NH2 3Å
493	L	69.9	Low	73.9	Confident	20 Å²	20	68.5 Å²	68.5	11%	0.105	36%	0.364	C	S	.	.	P	Polyproline II helix	trans	-96.9	119.1	172.1	-63.2	172.4	0	0	0	108.3	P491 V500 F718 H721 V753	P491-L493 PolarHBondContact O-N 2.93Å; L493-V500 HydrophobicContact CB-CG1 4.42Å; L493-V500 HydrophobicContact CD1-CG1 3.64Å; L493-V500 HydrophobicContact CD2-CG1 4.37Å; L493-V500 HydrophobicContact CD2-CG2 4.12Å; L493-V500 HydrophobicContact CG-CG1 4.36Å; L493-F718 HydrophobicContact CB-CD2 4.18Å; L493-F718 HydrophobicContact CB-CE2 4.37Å; L493-H721 HydrophobicContact CD1-CB 3.52Å; L493-V753 HydrophobicContact CD1-CG2 3.8Å; L493-V753 HydrophobicContact CD2-CB 4.49Å; L493-V753 HydrophobicContact CD2-CG1 3.76Å; L493-V753 HydrophobicContact CD2-CG2 4.06Å; L493-V753 HydrophobicContact CG-CG2 4.32Å
494	L	66	Low	74.6	Confident	128 Å²	128	65.3 Å²	65.3	67%	0.67	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-69.1	130.9	169.2	-72.7	132	0	0	0	108.4	T496 S497	L494-T496 PolarHBondContact O-N 3.17Å; L494-T496 VanDerWaalsContact O-N 3.08Å; L494-S497 PolarHBondContact O-N 3.37Å
495	P	61.5	Low	75.2	Confident	81 Å²	81	60.4 Å²	60.4	53%	0.526	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-18.3	-177.6	26.2	-34.8	0	0	0	113	S497 H501 F718	P495-S497 VanDerWaalsContact C-N 3.27Å; P495-S497 PolarHBondContact O-N 2.81Å; P495-H501 PolarHBondContact O-NE2 2.99Å; P495-F718 HydrophobicContact CB-CE2 3.98Å; P495-F718 HydrophobicContact CB-CZ 3.92Å
496	T	61.8	Low	75.9	Confident	119 Å²	119	62.4 Å²	62.4	73%	0.73	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-15.7	178.7	-25	0	0	0	0	114.3	L494 S498	L494-T496 PolarHBondContact O-N 3.17Å; L494-T496 VanDerWaalsContact O-N 3.08Å; T496-S498 PolarHBondContact O-N 2.62Å
497	S	65.4	Low	76.5	Confident	41 Å²	41	57.7 Å²	57.7	29%	0.287	30%	0.304	S	S	.	.			trans	-80.4	101.5	-177.3	-175.7	0	0	0	0	112	L494 P495 A499 V500	L494-S497 PolarHBondContact O-N 3.37Å; P495-S497 VanDerWaalsContact C-N 3.27Å; P495-S497 PolarHBondContact O-N 2.81Å; S497-A499 PolarHBondContact O-N 3.48Å; S497-A499 VanDerWaalsContact O-N 3.11Å; S497-V500 WeakPolarHBondContact O-CB 2.96Å; S497-V500 PolarHBondContact O-N 3.1Å
498	S	68	Low	77.1	Confident	84 Å²	84	57.8 Å²	57.8	59%	0.587	30%	0.304	S	S	*	.	H	α-helix	trans	-53.2	-31.8	-179.2	-52.6	0	0	0	0	114.3	T496 V500 H501 R502	T496-S498 PolarHBondContact O-N 2.62Å; S498-V500 VanDerWaalsContact C-N 3.34Å; S498-V500 PolarHBondContact O-N 3.44Å; S498-H501 PolarHBondContact O-N 2.97Å; S498-R502 PolarHBondContact O-N 3.34Å
499	A	72.8	Confident	78	Confident	32 Å²	32	57.4 Å²	57.4	26%	0.264	30%	0.299	S	S	.	.	H	α-helix	trans	-65.4	-35.4	178.4	0	0	0	0	0	112.7	S497 H501 R502 I503 V756 S760	S497-A499 PolarHBondContact O-N 3.48Å; S497-A499 VanDerWaalsContact O-N 3.11Å; A499-H501 PolarHBondContact O-N 3.5Å; A499-R502 PolarHBondContact O-N 2.83Å; A499-R502 VanDerWaalsContact O-N 3.14Å; A499-I503 PolarHBondContact O-N 3.11Å; A499-V756 HydrophobicContact CB-CG1 3.8Å; A499-S760 WeakPolarHBondContact CB-OG 3.41Å
500	V	76.6	Confident	79	Confident	3 Å²	3	59.9 Å²	59.9	2%	0.018	31%	0.312	C	S	.	.	H	α-helix	trans	-67.7	-24.8	-179.5	-171.7	0	0	0	0	112	L493 S497 S498 L717 F718 V756	L493-V500 HydrophobicContact CB-CG1 4.42Å; L493-V500 HydrophobicContact CD1-CG1 3.64Å; L493-V500 HydrophobicContact CD2-CG1 4.37Å; L493-V500 HydrophobicContact CD2-CG2 4.12Å; L493-V500 HydrophobicContact CG-CG1 4.36Å; S497-V500 WeakPolarHBondContact O-CB 2.96Å; S497-V500 PolarHBondContact O-N 3.1Å; S498-V500 VanDerWaalsContact C-N 3.34Å; S498-V500 PolarHBondContact O-N 3.44Å; V500-L717 HydrophobicContact CG1-CB 4.35Å; V500-L717 HydrophobicContact CG1-CD2 4.39Å; V500-L717 HydrophobicContact CG1-CG 4.32Å; V500-F718 HydrophobicContact CG1-CB 3.8Å; V500-F718 HydrophobicContact CG1-CD2 4.27Å; V500-F718 PolarHBondContact O-N 3.28Å; V500-V756 HydrophobicContact CG2-CG1 3.79Å
501	H	81.7	Confident	79.7	Confident	82 Å²	82	62.8 Å²	62.8	38%	0.38	34%	0.337	S	S	.	.	H	α-helix	trans	-86.5	-18.6	175.4	-61.7	-66.5	0	0	0	113.5	P495 S498 A499 F718	P495-H501 PolarHBondContact O-NE2 2.99Å; S498-H501 PolarHBondContact O-N 2.97Å; A499-H501 PolarHBondContact O-N 3.5Å; H501-F718 AromaticContact CE1-CG 3.75Å
502	R	85.2	Confident	80.6	Confident	204 Å²	204	67.8 Å²	67.8	77%	0.77	36%	0.364	S	S	*	.	H	α-helix	trans	-80.3	-38.1	178.5	-72.1	179.7	178.5	-172.5	-0.7	113.1	S498 A499	S498-R502 PolarHBondContact O-N 3.34Å; A499-R502 PolarHBondContact O-N 2.83Å; A499-R502 VanDerWaalsContact O-N 3.14Å
503	I	86.8	Confident	81.5	Confident	36 Å²	36	64.9 Å²	64.9	19%	0.185	35%	0.349	C	S	.	.			trans	-73.7	133	177.2	-59.4	-167.3	0	0	0	110	A499 D507 F508 S716 L717 V756	A499-I503 PolarHBondContact O-N 3.11Å; I503-D507 HydrophobicContact CG2-CB 4.25Å; I503-F508 HydrophobicContact CG2-CD1 3.95Å; I503-F508 HydrophobicContact CG2-CE1 4.3Å; I503-S716 CarbonylContact O-C 3.55Å; I503-S716 WeakPolarHBondContact O-CA 3.43Å; I503-L717 HydrophobicContact CB-CB 4.18Å; I503-L717 HydrophobicContact CB-CD2 4.42Å; I503-L717 HydrophobicContact CG2-CB 4.29Å; I503-L717 HydrophobicContact CG2-CD2 4.48Å; I503-L717 PolarHBondContact O-N 3.43Å; I503-V756 HydrophobicContact CD1-CG2 3.39Å; I503-V756 HydrophobicContact CG1-CG2 4.27Å
504	L	92.1	Very high	82.5	Confident	34 Å²	34	67.7 Å²	67.7	18%	0.178	36%	0.36	C	S	.	.	B	Isolated β-bridge	trans	-109.7	157.8	-180	-56.6	-179.7	0	0	0	111.3	R506 D507 F508 S715	L504-R506 HydrophobicContact CB-CG 4.18Å; L504-R506 PolarHBondContact O-N 3.28Å; L504-D507 PolarHBondContact N-OD2 3.25Å; L504-D507 WeakPolarHBondContact O-CB 3.33Å; L504-D507 PolarHBondContact O-N 3.42Å; L504-F508 VanDerWaalsContact O-CD1 3.27Å; L504-F508 WeakPolarHBondContact O-CD1 3.3Å; L504-F508 WeakPolarHBondContact O-CE1 3.5Å; L504-S715 CarbonylContact C-O 3.55Å; L504-S715 WeakPolarHBondContact CA-O 3.49Å
505	V	92.5	Very high	83.7	Confident	0 Å²	0	64.8 Å²	64.8	0%	0	34%	0.341	C	S	.	.	G	3₁₀ helix	trans	-54.9	-38	179.2	159.4	0	0	0	0	112.5	D507 F508 M509 L711 E713 S715 A720 V734 V744	V505-D507 PolarHBondContact O-N 2.83Å; V505-F508 HydrophobicContact CG2-CE1 4.34Å; V505-F508 HydrophobicContact CG2-CZ 4.11Å; V505-F508 PolarHBondContact O-N 3.47Å; V505-M509 WeakPolarHBondContact O-CB 3.34Å; V505-M509 PolarHBondContact O-N 3.39Å; V505-L711 HydrophobicContact CG1-CB 4.47Å; V505-L711 HydrophobicContact CG2-CD1 4.14Å; V505-E713 PolarHBondContact N-O 3.25Å; V505-S715 WeakPolarHBondContact CG2-O 3.4Å; V505-S715 PolarHBondContact N-O 3.49Å; V505-A720 HydrophobicContact CG2-CB 3.68Å; V505-V734 HydrophobicContact CG1-CB 4.28Å; V505-V734 HydrophobicContact CG1-CG1 3.76Å; V505-V734 HydrophobicContact CG1-CG2 3.46Å; V505-V734 VanDerWaalsContact CG1-CG2 3.46Å; V505-V744 HydrophobicContact CG1-CG2 3.81Å
506	R	92.6	Very high	85.2	Confident	132 Å²	132	61 Å²	61	50%	0.498	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-59.3	-25	176.6	77.1	-169.2	-177.1	-175.7	0.7	114.1	L504 M509 E713	L504-R506 HydrophobicContact CB-CG 4.18Å; L504-R506 PolarHBondContact O-N 3.28Å; R506-M509 HydrophobicContact CB-CE 3.95Å; R506-M509 HydrophobicContact CB-SD 4.49Å; R506-E713 HydrophobicContact CB-CB 4.23Å; R506-E713 PolarHBondContact N-O 3.08Å
507	D	90.8	Very high	86.6	Confident	52 Å²	52	55.5 Å²	55.5	28%	0.278	28%	0.282	S	S	.	.	G	3₁₀ helix	trans	-80.9	-19.4	-172.7	-47.6	-26.1	0	0	0	112	I503 L504 V505 W774	I503-D507 HydrophobicContact CG2-CB 4.25Å; L504-D507 PolarHBondContact N-OD2 3.25Å; L504-D507 WeakPolarHBondContact O-CB 3.33Å; L504-D507 PolarHBondContact O-N 3.42Å; V505-D507 PolarHBondContact O-N 2.83Å; D507-W774 HydrophobicContact CB-CZ2 4.08Å
508	F	91.1	Very high	87.8	Confident	21 Å²	21	56.8 Å²	56.8	9%	0.092	29%	0.285	C	S	.	.	T	Hydrogen-bonded Turn	trans	-132.2	3.1	-177.7	68.5	-88.8	0	0	0	115.1	I503 L504 V505 L717 A720 V744 L749 A752	I503-F508 HydrophobicContact CG2-CD1 3.95Å; I503-F508 HydrophobicContact CG2-CE1 4.3Å; L504-F508 VanDerWaalsContact O-CD1 3.27Å; L504-F508 WeakPolarHBondContact O-CD1 3.3Å; L504-F508 WeakPolarHBondContact O-CE1 3.5Å; V505-F508 HydrophobicContact CG2-CE1 4.34Å; V505-F508 HydrophobicContact CG2-CZ 4.11Å; V505-F508 PolarHBondContact O-N 3.47Å; F508-L717 HydrophobicContact CD1-CD1 4.4Å; F508-L717 HydrophobicContact CE1-CB 4.36Å; F508-L717 HydrophobicContact CE1-CD1 3.62Å; F508-L717 HydrophobicContact CE2-CD1 4.24Å; F508-L717 HydrophobicContact CZ-CD1 3.54Å; F508-A720 HydrophobicContact CZ-CB 4.35Å; F508-V744 HydrophobicContact CE2-CG1 3.84Å; F508-V744 HydrophobicContact CE2-CG2 4.18Å; F508-L749 HydrophobicContact CE2-CB 4.43Å; F508-L749 HydrophobicContact CE2-CD1 3.91Å; F508-L749 HydrophobicContact CZ-CD1 3.96Å; F508-A752 HydrophobicContact CB-CB 3.97Å; F508-A752 HydrophobicContact CD1-CB 4.03Å; F508-A752 HydrophobicContact CD2-CB 3.93Å; F508-A752 HydrophobicContact CE2-CB 4.42Å; F508-A752 HydrophobicContact CG-CB 3.72Å
509	M	93.2	Very high	88.8	Confident	36 Å²	36	55.9 Å²	55.9	18%	0.177	28%	0.279	C	S	.	.	S	Bend	trans	-67.8	149.9	175.5	65.2	179.1	177.2	0	0	112.6	V505 R506 A511 V734 I741 V744	V505-M509 WeakPolarHBondContact O-CB 3.34Å; V505-M509 PolarHBondContact O-N 3.39Å; R506-M509 HydrophobicContact CB-CE 3.95Å; R506-M509 HydrophobicContact CB-SD 4.49Å; M509-A511 PolarHBondContact O-N 3.02Å; M509-V734 HydrophobicContact CB-CG2 3.89Å; M509-V734 HydrophobicContact SD-CB 3.91Å; M509-V734 HydrophobicContact SD-CG1 3.74Å; M509-V734 HydrophobicContact SD-CG2 4.03Å; M509-I741 HydrophobicContact CE-CG2 3.56Å; M509-I741 HydrophobicContact SD-CG2 4.03Å; M509-V744 HydrophobicContact CB-CG2 4.29Å
510	I	92.8	Very high	89.6	Confident	62 Å²	62	55 Å²	55	32%	0.318	27%	0.271	S	S	.	.	B	Isolated β-bridge	trans	-78.5	106	168.1	-54.8	173.1	0	0	0	107.5	V513 G742 L743 T745 K748	I510-V513 VanDerWaalsContact O-CG2 3.29Å; I510-V513 WeakPolarHBondContact O-CG2 3.33Å; I510-G742 CarbonylContact O-C 3.59Å; I510-G742 WeakPolarHBondContact O-CA 3.49Å; I510-L743 HydrophobicContact CB-CB 4.45Å; I510-L743 WeakPolarHBondContact CB-O 3.23Å; I510-L743 PolarHBondContact N-O 3.33Å; I510-L743 PolarHBondContact O-N 2.93Å; I510-T745 HydrophobicContact CD1-CG2 4.11Å; I510-K748 HydrophobicContact CD1-CG 4.18Å; I510-K748 HydrophobicContact CG1-CG 3.99Å
511	A	91.2	Very high	90.3	Very high	69 Å²	69	56 Å²	56	57%	0.57	28%	0.277	S	S	*	.			trans	-73.4	-34.2	179.8	0	0	0	0	0	113.3	M509 V513	M509-A511 PolarHBondContact O-N 3.02Å; A511-V513 VanDerWaalsContact C-N 3.27Å; A511-V513 PolarHBondContact O-N 3.48Å
512	D	89.8	Confident	90.6	Very high	110 Å²	110	52.7 Å²	52.7	59%	0.588	26%	0.261	S	S	*	.			trans	-79.7	70.8	179.1	-173.2	26.2	0	0	0	112.4	K514	D512-K514 WeakPolarHBondContact OD1-CE 3.26Å; D512-K514 IonicContact OD1-NZ 2.64Å; D512-K514 PolarHBondContact OD1-NZ 2.88Å; D512-K514 WeakPolarHBondContact OD2-CE 3.21Å; D512-K514 IonicContact OD2-NZ 3.8Å; D512-K514 PolarHBondContact OD2-NZ 3.03Å
513	V	88.9	Confident	90.7	Very high	17 Å²	17	48.1 Å²	48.1	10%	0.103	25%	0.247	C	C	.	.			trans	-87.9	117.5	176.2	-169.6	0	0	0	0	110.2	I510 A511 Y515 P539 Y733 L740 L743	I510-V513 VanDerWaalsContact O-CG2 3.29Å; I510-V513 WeakPolarHBondContact O-CG2 3.33Å; A511-V513 VanDerWaalsContact C-N 3.27Å; A511-V513 PolarHBondContact O-N 3.48Å; V513-Y515 WeakPolarHBondContact O-CD1 3.47Å; V513-P539 HydrophobicContact CG1-CG 3.84Å; V513-Y733 HydrophobicContact CG1-CE1 4.45Å; V513-L740 HydrophobicContact CB-CD2 4.4Å; V513-L740 HydrophobicContact CG1-CD2 4.11Å; V513-L743 HydrophobicContact CG1-CB 4.49Å; V513-L743 HydrophobicContact CG2-CB 3.62Å
514	K	91	Very high	90.9	Very high	79 Å²	79	49.8 Å²	49.8	34%	0.343	26%	0.257	S	S	.	.			trans	-76.1	125.5	171.9	-49.8	-54.7	177.9	-168.9	0	110	D512 F532 P539	D512-K514 WeakPolarHBondContact OD1-CE 3.26Å; D512-K514 IonicContact OD1-NZ 2.64Å; D512-K514 PolarHBondContact OD1-NZ 2.88Å; D512-K514 WeakPolarHBondContact OD2-CE 3.21Å; D512-K514 IonicContact OD2-NZ 3.8Å; D512-K514 PolarHBondContact OD2-NZ 3.03Å; K514-F532 HydrophobicContact CB-CE2 4.46Å; K514-F532 HydrophobicContact CD-CE2 4.44Å; K514-F532 HydrophobicContact CD-CZ 4.12Å; K514-F532 HydrophobicContact CG-CD2 4.41Å; K514-F532 HydrophobicContact CG-CE1 4.08Å; K514-F532 HydrophobicContact CG-CE2 3.86Å; K514-F532 HydrophobicContact CG-CZ 3.69Å; K514-P539 WeakPolarHBondContact O-CD 3.23Å
515	Y	91.9	Very high	90.8	Very high	66 Å²	66	48.3 Å²	48.3	26%	0.259	25%	0.249	S	C	.	.			trans	-119.6	162.9	-177.4	52.1	-100.8	0	0	0	111.7	V513 T517 P539 V541 E544 K547 L740	V513-Y515 WeakPolarHBondContact O-CD1 3.47Å; Y515-T517 HydrophobicContact CD2-CG2 4.24Å; Y515-T517 HydrophobicContact CE2-CG2 4.15Å; Y515-P539 WeakPolarHBondContact CA-O 3.32Å; Y515-V541 HydrophobicContact CD2-CG2 3.55Å; Y515-V541 HydrophobicContact CE2-CG2 4.13Å; Y515-V541 HydrophobicContact CG-CG1 4.43Å; Y515-V541 HydrophobicContact CG-CG2 3.94Å; Y515-E544 HydrophobicContact CE2-CG 4.49Å; Y515-K547 HydrophobicContact CE1-CD 4.41Å; Y515-K547 WeakPolarHBondContact OH-CE 3.32Å; Y515-L740 HydrophobicContact CD1-CD2 4.46Å
516	L	92.4	Very high	90.6	Very high	3 Å²	3	53.5 Å²	53.5	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	149.7	162	-70.9	168.1	0	0	0	109	I525 L528 F538 P539 L540 V541 I553 L558	L516-I525 HydrophobicContact CD1-CG1 4.33Å; L516-I525 HydrophobicContact CD2-CG1 3.76Å; L516-L528 HydrophobicContact CD2-CD1 3.92Å; L516-L528 HydrophobicContact CG-CD1 4.2Å; L516-F538 HydrophobicContact CD1-CB 4.42Å; L516-P539 PolarHBondContact N-O 3.11Å; L516-L540 HydrophobicContact CB-CD1 4.09Å; L516-L540 WeakPolarHBondContact O-CA 3.41Å; L516-V541 WeakPolarHBondContact O-CG2 3.36Å; L516-V541 PolarHBondContact O-N 2.77Å; L516-I553 HydrophobicContact CD1-CD1 4.41Å; L516-L558 HydrophobicContact CD1-CD1 3.9Å; L516-L558 HydrophobicContact CD1-CD2 3.85Å
517	T	92.2	Very high	90.5	Very high	2 Å²	2	51.2 Å²	51.2	1%	0.012	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	162.4	170.7	59.5	0	0	0	0	110.9	Y515 S519 S520 V541 E544 Y699	Y515-T517 HydrophobicContact CD2-CG2 4.24Å; Y515-T517 HydrophobicContact CE2-CG2 4.15Å; T517-S519 WeakPolarHBondContact CB-OG 3.14Å; T517-S519 PolarHBondContact O-N 3.03Å; T517-S519 VanDerWaalsContact O-N 3.14Å; T517-S519 PolarHBondContact OG1-N 2.76Å; T517-S519 PolarHBondContact OG1-OG 2.74Å; T517-S520 PolarHBondContact N-OG 3.48Å; T517-S520 WeakPolarHBondContact O-CB 3.28Å; T517-S520 PolarHBondContact O-N 2.95Å; T517-S520 VanDerWaalsContact O-N 3.08Å; T517-S520 PolarHBondContact O-OG 3.24Å; T517-S520 PolarHBondContact OG1-N 3.12Å; T517-S520 PolarHBondContact OG1-OG 2.92Å; T517-V541 WeakPolarHBondContact CA-O 3.45Å; T517-V541 HydrophobicContact CG2-CG2 4.11Å; T517-E544 HydrophobicContact CG2-CG 3.67Å; T517-Y699 WeakPolarHBondContact O-CE2 3.4Å; T517-Y699 PolarHBondContact O-OH 2.9Å
518	L	89.8	Confident	90.5	Very high	68 Å²	68	49.6 Å²	49.6	36%	0.356	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-19.6	167.8	-69.7	176.1	0	0	0	113.4	L540 V541 N542 I550 V696 Y699	L518-L540 HydrophobicContact CD2-CD1 4.4Å; L518-L540 HydrophobicContact CD2-CD2 3.95Å; L518-L540 HydrophobicContact CD2-CG 4.42Å; L518-V541 PolarHBondContact N-O 3.23Å; L518-N542 PolarHBondContact N-O 3.3Å; L518-I550 HydrophobicContact CD1-CD1 3.62Å; L518-I550 HydrophobicContact CD2-CD1 4.18Å; L518-I550 HydrophobicContact CG-CD1 3.89Å; L518-V696 WeakPolarHBondContact O-CG1 3.21Å; L518-Y699 HydrophobicContact CD2-CD2 4Å; L518-Y699 HydrophobicContact CD2-CG 4.18Å; L518-Y699 WeakPolarHBondContact O-CE2 3.26Å
519	S	89.8	Confident	90.4	Very high	65 Å²	65	48.9 Å²	48.9	46%	0.455	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-8.6	175.8	55.7	0	0	0	0	115	T517 T521	T517-S519 WeakPolarHBondContact CB-OG 3.14Å; T517-S519 PolarHBondContact O-N 3.03Å; T517-S519 VanDerWaalsContact O-N 3.14Å; T517-S519 PolarHBondContact OG1-N 2.76Å; T517-S519 PolarHBondContact OG1-OG 2.74Å; S519-T521 PolarHBondContact O-N 2.63Å
520	S	89.8	Confident	90.2	Very high	15 Å²	15	51.4 Å²	51.4	11%	0.105	27%	0.272	C	S	.	.			trans	-66.8	128.2	-174.4	-67.7	0	0	0	0	111.7	T517 P697 Y699	T517-S520 PolarHBondContact N-OG 3.48Å; T517-S520 WeakPolarHBondContact O-CB 3.28Å; T517-S520 PolarHBondContact O-N 2.95Å; T517-S520 VanDerWaalsContact O-N 3.08Å; T517-S520 PolarHBondContact O-OG 3.24Å; T517-S520 PolarHBondContact OG1-N 3.12Å; T517-S520 PolarHBondContact OG1-OG 2.92Å; S520-P697 WeakPolarHBondContact O-CD 3.4Å; S520-Y699 PolarHBondContact O-OH 3.09Å
521	T	90.6	Very high	90.1	Very high	23 Å²	23	52.6 Å²	52.6	14%	0.141	28%	0.282	C	S	.	.			trans	-82	170.3	-176.2	69.1	0	0	0	0	112.8	S519 K523 D524 I525 N694 D695 V696	S519-T521 PolarHBondContact O-N 2.63Å; T521-K523 PolarHBondContact O-N 3.22Å; T521-K523 WeakPolarHBondContact OG1-CB 3.33Å; T521-K523 PolarHBondContact OG1-N 2.76Å; T521-D524 WeakPolarHBondContact CB-OD2 3.2Å; T521-D524 PolarHBondContact N-OD2 3.08Å; T521-D524 PolarHBondContact O-N 2.77Å; T521-D524 VanDerWaalsContact O-N 3.14Å; T521-D524 PolarHBondContact OG1-N 2.59Å; T521-D524 PolarHBondContact OG1-OD2 3.5Å; T521-I525 WeakPolarHBondContact O-CG1 3.33Å; T521-I525 PolarHBondContact O-N 2.89Å; T521-N694 WeakPolarHBondContact CG2-O 3.5Å; T521-D695 WeakPolarHBondContact CA-O 3.37Å; T521-V696 HydrophobicContact CG2-CG2 4.38Å
522	Y	88.2	Confident	90	Very high	12 Å²	12	52.7 Å²	52.7	5%	0.047	27%	0.27	C	S	.	.	H	α-helix	trans	-61.8	-27.7	170.9	-73.1	-79.9	0	0	0	113.2	R526 L561 L562 K565 L693 D695 P697	Y522-R526 WeakPolarHBondContact O-CB 3.42Å; Y522-R526 PolarHBondContact O-N 2.81Å; Y522-L561 HydrophobicContact CE1-CB 4.28Å; Y522-L562 HydrophobicContact CD1-CD1 4.2Å; Y522-K565 HydrophobicContact CD1-CG 4.34Å; Y522-K565 HydrophobicContact CD2-CG 4.39Å; Y522-K565 HydrophobicContact CE1-CG 3.76Å; Y522-K565 HydrophobicContact CE2-CD 3.99Å; Y522-K565 HydrophobicContact CE2-CG 3.86Å; Y522-K565 VanDerWaalsContact CZ-CE 3.5Å; Y522-K565 VanDerWaalsContact CZ-CG 3.5Å; Y522-K565 WeakPolarHBondContact OH-CE 3.49Å; Y522-L693 CarbonylContact C-O 3.46Å; Y522-L693 WeakPolarHBondContact CB-O 3.21Å; Y522-L693 PolarHBondContact N-O 2.88Å; Y522-D695 HydrophobicContact CD2-CB 3.73Å; Y522-D695 WeakPolarHBondContact CD2-O 3.35Å; Y522-D695 HydrophobicContact CE2-CB 4.01Å; Y522-D695 PolarHBondContact N-O 2.89Å; Y522-P697 HydrophobicContact CE1-CB 4.07Å; Y522-P697 HydrophobicContact CE2-CB 3.9Å; Y522-P697 WeakPolarHBondContact OH-CA 3.32Å; Y522-P697 WeakPolarHBondContact OH-CB 3.27Å
523	K	87.1	Confident	89.8	Confident	108 Å²	108	55 Å²	55	47%	0.47	27%	0.274	S	S	.	.	H	α-helix	trans	-63.5	-47	171.3	-178.6	-171.2	174.5	-169.2	0	110.8	T521 R526 V527 L693	T521-K523 PolarHBondContact O-N 3.22Å; T521-K523 WeakPolarHBondContact OG1-CB 3.33Å; T521-K523 PolarHBondContact OG1-N 2.76Å; K523-R526 WeakPolarHBondContact O-CB 3.43Å; K523-R526 PolarHBondContact O-N 3.18Å; K523-V527 WeakPolarHBondContact O-CG2 3.2Å; K523-V527 PolarHBondContact O-N 3.35Å; K523-L693 HydrophobicContact CB-CB 4.26Å; K523-L693 PolarHBondContact N-O 3.23Å
524	D	90.2	Very high	89.5	Confident	72 Å²	72	65.7 Å²	65.7	39%	0.385	31%	0.313	S	S	.	.	H	α-helix	trans	-68.3	-42.2	-178.2	-50	-45.9	0	0	0	111	T521 R526 V527 L528	T521-D524 WeakPolarHBondContact CB-OD2 3.2Å; T521-D524 PolarHBondContact N-OD2 3.08Å; T521-D524 PolarHBondContact O-N 2.77Å; T521-D524 VanDerWaalsContact O-N 3.14Å; T521-D524 PolarHBondContact OG1-N 2.59Å; T521-D524 PolarHBondContact OG1-OD2 3.5Å; D524-R526 VanDerWaalsContact C-N 3.3Å; D524-R526 PolarHBondContact O-N 2.96Å; D524-V527 PolarHBondContact O-N 3.03Å; D524-L528 VanDerWaalsContact O-CB 3.25Å; D524-L528 WeakPolarHBondContact O-CB 2.94Å; D524-L528 PolarHBondContact O-N 3.38Å
525	I	90	Very high	89.2	Confident	3 Å²	3	64.7 Å²	64.7	2%	0.015	31%	0.313	C	S	.	.	H	α-helix	trans	-57	-43.8	170.8	-69.9	167.7	0	0	0	110.8	L516 T521 L529 L558 P697	L516-I525 HydrophobicContact CD1-CG1 4.33Å; L516-I525 HydrophobicContact CD2-CG1 3.76Å; T521-I525 WeakPolarHBondContact O-CG1 3.33Å; T521-I525 PolarHBondContact O-N 2.89Å; I525-L529 HydrophobicContact CG2-CD1 3.82Å; I525-L529 HydrophobicContact CG2-CG 4.24Å; I525-L529 VanDerWaalsContact O-CB 3.28Å; I525-L529 WeakPolarHBondContact O-CB 3.14Å; I525-L529 WeakPolarHBondContact O-CG 3.04Å; I525-L529 PolarHBondContact O-N 3.35Å; I525-L558 HydrophobicContact CD1-CD2 4.23Å; I525-L558 HydrophobicContact CG1-CD2 4.46Å; I525-L558 HydrophobicContact CG2-CB 4.13Å; I525-L558 HydrophobicContact CG2-CD2 4.09Å; I525-P697 HydrophobicContact CD1-CG 3.86Å
526	R	88.5	Confident	88.8	Confident	108 Å²	108	69 Å²	69	41%	0.408	33%	0.329	S	S	.	.	H	α-helix	trans	-63.6	-48.7	177.6	-177.8	177	178.5	175.9	-0.2	111.7	Y522 K523 D524 L528 L529 D530 L562	Y522-R526 WeakPolarHBondContact O-CB 3.42Å; Y522-R526 PolarHBondContact O-N 2.81Å; K523-R526 WeakPolarHBondContact O-CB 3.43Å; K523-R526 PolarHBondContact O-N 3.18Å; D524-R526 VanDerWaalsContact C-N 3.3Å; D524-R526 PolarHBondContact O-N 2.96Å; R526-L528 PolarHBondContact O-N 3.44Å; R526-L529 PolarHBondContact O-N 3.38Å; R526-D530 WeakPolarHBondContact CG-OD2 3.34Å; R526-D530 IonicContact NE-OD2 3.93Å; R526-D530 WeakPolarHBondContact O-CB 2.85Å; R526-D530 PolarHBondContact O-N 3.4Å; R526-L562 HydrophobicContact CB-CD1 4.47Å; R526-L562 HydrophobicContact CB-CD2 4.13Å; R526-L562 HydrophobicContact CG-CD2 4.23Å
527	V	90.3	Very high	88.6	Confident	84 Å²	84	69.7 Å²	69.7	51%	0.509	33%	0.333	S	S	.	.	H	α-helix	trans	-59.2	-45.5	177.5	171.1	0	0	0	0	111.2	K523 D524 D530 T531	K523-V527 WeakPolarHBondContact O-CG2 3.2Å; K523-V527 PolarHBondContact O-N 3.35Å; D524-V527 PolarHBondContact O-N 3.03Å; V527-D530 PolarHBondContact O-N 3.15Å; V527-T531 VanDerWaalsContact O-CB 3.24Å; V527-T531 WeakPolarHBondContact O-CB 3.4Å; V527-T531 PolarHBondContact O-N 3.46Å; V527-T531 PolarHBondContact O-OG1 2.66Å
528	L	91	Very high	88.6	Confident	19 Å²	19	69.7 Å²	69.7	10%	0.099	33%	0.333	C	S	.	.	H	α-helix	trans	-63.9	-41.2	176.5	171.7	147.7	0	0	0	112.3	L516 D524 R526 F532 F538	L516-L528 HydrophobicContact CD2-CD1 3.92Å; L516-L528 HydrophobicContact CG-CD1 4.2Å; D524-L528 VanDerWaalsContact O-CB 3.25Å; D524-L528 WeakPolarHBondContact O-CB 2.94Å; D524-L528 PolarHBondContact O-N 3.38Å; R526-L528 PolarHBondContact O-N 3.44Å; L528-F532 HydrophobicContact CG-CD2 4.41Å; L528-F532 WeakPolarHBondContact O-CB 3.36Å; L528-F532 PolarHBondContact O-N 2.92Å; L528-F538 HydrophobicContact CD1-CD1 4.14Å; L528-F538 HydrophobicContact CD1-CE1 4.37Å; L528-F538 HydrophobicContact CD2-CD1 3.76Å; L528-F538 HydrophobicContact CD2-CD2 3.78Å; L528-F538 HydrophobicContact CD2-CE1 3.6Å; L528-F538 HydrophobicContact CD2-CE2 3.64Å; L528-F538 HydrophobicContact CD2-CG 3.83Å; L528-F538 HydrophobicContact CD2-CZ 3.53Å; L528-F538 HydrophobicContact CG-CD1 4.2Å; L528-F538 HydrophobicContact CG-CE1 3.97Å; L528-F538 HydrophobicContact CG-CZ 4.29Å
529	L	89.9	Confident	88.8	Confident	5 Å²	5	66.7 Å²	66.7	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-64.7	-45.2	175.2	-76.2	174.2	0	0	0	112	I525 R526 F538 R555 L558 I559 L562	I525-L529 HydrophobicContact CG2-CD1 3.82Å; I525-L529 HydrophobicContact CG2-CG 4.24Å; I525-L529 VanDerWaalsContact O-CB 3.28Å; I525-L529 WeakPolarHBondContact O-CB 3.14Å; I525-L529 WeakPolarHBondContact O-CG 3.04Å; I525-L529 PolarHBondContact O-N 3.35Å; R526-L529 PolarHBondContact O-N 3.38Å; L529-F538 HydrophobicContact CD2-CE2 4.33Å; L529-R555 HydrophobicContact CD2-CB 4.5Å; L529-R555 HydrophobicContact CD2-CG 3.45Å; L529-R555 VanDerWaalsContact CD2-CG 3.45Å; L529-R555 VanDerWaalsContact O-CZ 3.28Å; L529-R555 PolarHBondContact O-NH1 3.01Å; L529-R555 PolarHBondContact O-NH2 3.41Å; L529-L558 HydrophobicContact CD1-CB 4.09Å; L529-L558 HydrophobicContact CD2-CB 4.15Å; L529-L558 HydrophobicContact CD2-CD1 4.32Å; L529-L558 HydrophobicContact CG-CB 4.48Å; L529-I559 HydrophobicContact CD1-CG1 4.01Å; L529-I559 HydrophobicContact CD2-CG1 4.34Å; L529-L562 HydrophobicContact CD1-CD2 4.32Å
530	D	89.3	Confident	89	Confident	89 Å²	89	63.6 Å²	63.6	48%	0.476	30%	0.296	S	S	.	.	H	α-helix	trans	-73.9	-29.2	-177.2	-73.6	-27.7	0	0	0	112.2	R526 V527 K533	R526-D530 WeakPolarHBondContact CG-OD2 3.34Å; R526-D530 IonicContact NE-OD2 3.93Å; R526-D530 WeakPolarHBondContact O-CB 2.85Å; R526-D530 PolarHBondContact O-N 3.4Å; V527-D530 PolarHBondContact O-N 3.15Å; D530-K533 WeakPolarHBondContact O-CE 3.17Å; D530-K533 VanDerWaalsContact O-CG 3.22Å; D530-K533 WeakPolarHBondContact O-CG 2.8Å
531	T	91.3	Very high	89.1	Confident	87 Å²	87	62.9 Å²	62.9	53%	0.534	29%	0.291	S	S	.	.	H	α-helix	trans	-75.3	-58	173	-54.5	0	0	0	0	110.8	V527 K533	V527-T531 VanDerWaalsContact O-CB 3.24Å; V527-T531 WeakPolarHBondContact O-CB 3.4Å; V527-T531 PolarHBondContact O-N 3.46Å; V527-T531 PolarHBondContact O-OG1 2.66Å; T531-K533 VanDerWaalsContact C-N 3.3Å; T531-K533 PolarHBondContact O-N 2.82Å
532	F	88.7	Confident	89.2	Confident	72 Å²	72	64.5 Å²	64.5	32%	0.316	30%	0.299	S	S	.	.			trans	-92.2	54.6	-171.3	-62.2	-74.5	0	0	0	112.5	K514 L528 R534 V535 F538 R555	K514-F532 HydrophobicContact CB-CE2 4.46Å; K514-F532 HydrophobicContact CD-CE2 4.44Å; K514-F532 HydrophobicContact CD-CZ 4.12Å; K514-F532 HydrophobicContact CG-CD2 4.41Å; K514-F532 HydrophobicContact CG-CE1 4.08Å; K514-F532 HydrophobicContact CG-CE2 3.86Å; K514-F532 HydrophobicContact CG-CZ 3.69Å; L528-F532 HydrophobicContact CG-CD2 4.41Å; L528-F532 WeakPolarHBondContact O-CB 3.36Å; L528-F532 PolarHBondContact O-N 2.92Å; F532-R534 PolarHBondContact O-N 3.4Å; F532-V535 HydrophobicContact CB-CB 4.18Å; F532-V535 HydrophobicContact CB-CG2 3.93Å; F532-V535 PolarHBondContact O-N 3.18Å; F532-F538 HydrophobicContact CB-CE1 3.98Å; F532-F538 HydrophobicContact CB-CZ 4.04Å; F532-R555 PolarHBondContact O-NH1 2.92Å
533	K	84.7	Confident	89.3	Confident	157 Å²	157	67.7 Å²	67.7	68%	0.683	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	-28.9	-174.4	-59.1	-174.4	-175.9	177.7	0	114.8	D530 T531	D530-K533 WeakPolarHBondContact O-CE 3.17Å; D530-K533 VanDerWaalsContact O-CG 3.22Å; D530-K533 WeakPolarHBondContact O-CG 2.8Å; T531-K533 VanDerWaalsContact C-N 3.3Å; T531-K533 PolarHBondContact O-N 2.82Å
534	R	82.5	Confident	89.5	Confident	243 Å²	243	68.5 Å²	68.5	92%	0.917	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.6	-16.5	-178.8	-65.7	-178.2	178.1	174.8	-0.6	114.5	F532	F532-R534 PolarHBondContact O-N 3.4Å
535	V	84.5	Confident	89.6	Confident	58 Å²	58	71.9 Å²	71.9	35%	0.352	35%	0.345	S	S	.	.			trans	-82.5	135.2	-173.4	178.9	0	0	0	0	111	F532 T537 F538 R555	F532-V535 HydrophobicContact CB-CB 4.18Å; F532-V535 HydrophobicContact CB-CG2 3.93Å; F532-V535 PolarHBondContact O-N 3.18Å; V535-T537 VanDerWaalsContact CG1-O 3.23Å; V535-T537 WeakPolarHBondContact CG1-O 3.38Å; V535-F538 HydrophobicContact CB-CE1 3.77Å; V535-F538 HydrophobicContact CB-CE2 4.5Å; V535-F538 HydrophobicContact CB-CZ 3.66Å; V535-F538 HydrophobicContact CG1-CD1 3.92Å; V535-F538 HydrophobicContact CG1-CE1 3.44Å; V535-F538 VanDerWaalsContact CG1-CE1 3.44Å; V535-F538 HydrophobicContact CG1-CE2 4.22Å; V535-F538 HydrophobicContact CG1-CG 4.5Å; V535-F538 HydrophobicContact CG1-CZ 3.62Å; V535-F538 HydrophobicContact CG2-CE1 4.47Å; V535-R555 WeakPolarHBondContact O-CD 3.34Å
536	R	84.1	Confident	89.6	Confident	156 Å²	156	73 Å²	73	59%	0.589	35%	0.353	S	S	*	.			trans	-95.6	-29.7	-168.3	-69.3	-176.3	-179.3	156.2	2	115.8	R555	R536-R555 VanDerWaalsContact O-CB 3.27Å; R536-R555 WeakPolarHBondContact O-CB 3.05Å; R536-R555 PolarHBondContact O-N 3.32Å
537	T	88.2	Confident	89.7	Confident	17 Å²	17	71.9 Å²	71.9	10%	0.104	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146	162	173.6	72	0	0	0	0	107.5	V535 E552 I553 R731	V535-T537 VanDerWaalsContact CG1-O 3.23Å; V535-T537 WeakPolarHBondContact CG1-O 3.38Å; T537-E552 PolarHBondContact OG1-OE2 3.04Å; T537-I553 CarbonylContact C-O 3.57Å; T537-I553 WeakPolarHBondContact CA-O 3.09Å; T537-I553 VanDerWaalsContact CB-O 3.26Å; T537-I553 WeakPolarHBondContact CB-O 3.36Å; T537-R731 PolarHBondContact OG1-NH1 2.86Å; T537-R731 PolarHBondContact OG1-NH2 2.82Å
538	F	92.4	Very high	89.9	Confident	3 Å²	3	71.4 Å²	71.4	1%	0.013	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	140.3	177	-58.8	-91.3	0	0	0	109.5	L516 L528 L529 F532 V535 E552 I553 L558	L516-F538 HydrophobicContact CD1-CB 4.42Å; L528-F538 HydrophobicContact CD1-CD1 4.14Å; L528-F538 HydrophobicContact CD1-CE1 4.37Å; L528-F538 HydrophobicContact CD2-CD1 3.76Å; L528-F538 HydrophobicContact CD2-CD2 3.78Å; L528-F538 HydrophobicContact CD2-CE1 3.6Å; L528-F538 HydrophobicContact CD2-CE2 3.64Å; L528-F538 HydrophobicContact CD2-CG 3.83Å; L528-F538 HydrophobicContact CD2-CZ 3.53Å; L528-F538 HydrophobicContact CG-CD1 4.2Å; L528-F538 HydrophobicContact CG-CE1 3.97Å; L528-F538 HydrophobicContact CG-CZ 4.29Å; L529-F538 HydrophobicContact CD2-CE2 4.33Å; F532-F538 HydrophobicContact CB-CE1 3.98Å; F532-F538 HydrophobicContact CB-CZ 4.04Å; V535-F538 HydrophobicContact CB-CE1 3.77Å; V535-F538 HydrophobicContact CB-CE2 4.5Å; V535-F538 HydrophobicContact CB-CZ 3.66Å; V535-F538 HydrophobicContact CG1-CD1 3.92Å; V535-F538 HydrophobicContact CG1-CE1 3.44Å; V535-F538 VanDerWaalsContact CG1-CE1 3.44Å; V535-F538 HydrophobicContact CG1-CE2 4.22Å; V535-F538 HydrophobicContact CG1-CG 4.5Å; V535-F538 HydrophobicContact CG1-CZ 3.62Å; V535-F538 HydrophobicContact CG2-CE1 4.47Å; F538-E552 WeakPolarHBondContact O-CA 3.44Å; F538-I553 PolarHBondContact N-O 3.38Å; F538-I553 PolarHBondContact O-N 3.32Å; F538-L558 HydrophobicContact CD2-CD1 3.7Å; F538-L558 HydrophobicContact CE2-CD1 4.26Å
539	P	93.6	Very high	90	Very high	4 Å²	4	71.2 Å²	71.2	3%	0.026	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68	137.4	172.8	27.7	-30.9	0	0	0	110.2	V513 K514 Y515 L516 L549 G551 Y733 L740	V513-P539 HydrophobicContact CG1-CG 3.84Å; K514-P539 WeakPolarHBondContact O-CD 3.23Å; Y515-P539 WeakPolarHBondContact CA-O 3.32Å; L516-P539 PolarHBondContact N-O 3.11Å; P539-L549 HydrophobicContact CB-CD1 3.52Å; P539-G551 WeakPolarHBondContact CA-O 3.3Å; P539-Y733 HydrophobicContact CB-CD1 4.25Å; P539-Y733 HydrophobicContact CB-CE1 3.65Å; P539-Y733 HydrophobicContact CG-CD1 4.38Å; P539-Y733 HydrophobicContact CG-CE1 3.65Å; P539-L740 HydrophobicContact CB-CD2 3.97Å; P539-L740 HydrophobicContact CG-CD2 3.71Å
540	L	93.4	Very high	90.1	Very high	1 Å²	1	74 Å²	74	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	121.2	166.7	-178.8	67.8	0	0	0	108.1	L516 L518 I550 G551 I553 Y699 L704	L516-L540 HydrophobicContact CB-CD1 4.09Å; L516-L540 WeakPolarHBondContact O-CA 3.41Å; L518-L540 HydrophobicContact CD2-CD1 4.4Å; L518-L540 HydrophobicContact CD2-CD2 3.95Å; L518-L540 HydrophobicContact CD2-CG 4.42Å; L540-I550 HydrophobicContact CD2-CB 4.48Å; L540-I550 HydrophobicContact CD2-CG2 4.23Å; L540-I550 HydrophobicContact CG-CB 4.45Å; L540-I550 PolarHBondContact O-N 2.6Å; L540-G551 PolarHBondContact N-O 3.46Å; L540-G551 PolarHBondContact O-N 2.63Å; L540-I553 HydrophobicContact CB-CD1 4.36Å; L540-I553 HydrophobicContact CD2-CD1 4.42Å; L540-Y699 HydrophobicContact CD1-CD1 3.95Å; L540-Y699 HydrophobicContact CD1-CE1 3.73Å; L540-Y699 HydrophobicContact CD1-CE2 4.48Å; L540-Y699 HydrophobicContact CD1-CG 4.46Å; L540-Y699 HydrophobicContact CD2-CD1 3.88Å; L540-Y699 HydrophobicContact CD2-CE1 4.48Å; L540-Y699 HydrophobicContact CD2-CG 4.19Å; L540-L704 HydrophobicContact CB-CD2 4.4Å; L540-L704 HydrophobicContact CD2-CD1 4.49Å; L540-L704 HydrophobicContact CD2-CD2 3.68Å
541	V	93.3	Very high	90.2	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	161.2	169.4	-59.6	0	0	0	0	110.7	Y515 L516 T517 L518 I548 L740	Y515-V541 HydrophobicContact CD2-CG2 3.55Å; Y515-V541 HydrophobicContact CE2-CG2 4.13Å; Y515-V541 HydrophobicContact CG-CG1 4.43Å; Y515-V541 HydrophobicContact CG-CG2 3.94Å; L516-V541 WeakPolarHBondContact O-CG2 3.36Å; L516-V541 PolarHBondContact O-N 2.77Å; T517-V541 WeakPolarHBondContact CA-O 3.45Å; T517-V541 HydrophobicContact CG2-CG2 4.11Å; L518-V541 PolarHBondContact N-O 3.23Å; V541-I548 CarbonylContact C-O 3.52Å; V541-I548 WeakPolarHBondContact CA-O 3.4Å; V541-I548 WeakPolarHBondContact CB-O 3.49Å; V541-L740 HydrophobicContact CG1-CB 4.12Å; V541-L740 HydrophobicContact CG1-CD2 3.87Å
542	N	92.2	Very high	90.2	Very high	56 Å²	56	66.9 Å²	66.9	30%	0.299	32%	0.316	S	S	.	.	S	Bend	trans	-61.4	-73.8	176.6	-173.8	-11.1	0	0	0	111.5	L518 I548 I550	L518-N542 PolarHBondContact N-O 3.3Å; N542-I548 HydrophobicContact CB-CB 4.37Å; N542-I548 PolarHBondContact N-O 3.19Å; N542-I550 HydrophobicContact CB-CD1 3.82Å; N542-I550 HydrophobicContact CB-CG1 4.31Å
543	N	91.1	Very high	90.3	Very high	79 Å²	79	63.5 Å²	63.5	42%	0.422	30%	0.302	S	S	.	.			trans	-136.3	158.8	179.4	-71.5	-44.9	0	0	0	110.4	V545 S546 K547	N543-V545 VanDerWaalsContact C-N 3.25Å; N543-V545 PolarHBondContact O-N 2.95Å; N543-S546 PolarHBondContact N-OG 3.48Å; N543-S546 PolarHBondContact O-N 2.82Å; N543-S546 PolarHBondContact O-OG 2.89Å; N543-K547 PolarHBondContact O-N 3.28Å
544	E	89.7	Confident	90.6	Very high	126 Å²	126	57.4 Å²	57.4	59%	0.589	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-33.1	-178.4	-56.6	-171.5	156.2	0	0	113.9	Y515 T517 K547	Y515-E544 HydrophobicContact CE2-CG 4.49Å; T517-E544 HydrophobicContact CG2-CG 3.67Å; E544-K547 WeakPolarHBondContact O-CE 3.44Å; E544-K547 WeakPolarHBondContact O-CG 3.42Å
545	V	92	Very high	90.9	Very high	142 Å²	142	48.2 Å²	48.2	86%	0.861	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-41	179.5	-177.5	0	0	0	0	111.7	N543	N543-V545 VanDerWaalsContact C-N 3.25Å; N543-V545 PolarHBondContact O-N 2.95Å
546	S	91.7	Very high	91	Very high	28 Å²	28	48.8 Å²	48.8	20%	0.196	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-33	-175.9	65	0	0	0	0	112.8	N543 I548 R739	N543-S546 PolarHBondContact N-OG 3.48Å; N543-S546 PolarHBondContact O-N 2.82Å; N543-S546 PolarHBondContact O-OG 2.89Å; S546-I548 PolarHBondContact O-N 3.28Å; S546-R739 WeakPolarHBondContact O-CG 3.27Å
547	K	90.7	Very high	91.2	Very high	83 Å²	83	44.2 Å²	44.2	36%	0.361	24%	0.24	S	C	.	.			trans	49.7	20.2	-175.3	-56.8	-168.7	176.5	-179.2	0	114.7	Y515 N543 E544 L549 R739 L740	Y515-K547 HydrophobicContact CE1-CD 4.41Å; Y515-K547 WeakPolarHBondContact OH-CE 3.32Å; N543-K547 PolarHBondContact O-N 3.28Å; E544-K547 WeakPolarHBondContact O-CE 3.44Å; E544-K547 WeakPolarHBondContact O-CG 3.42Å; K547-L549 PolarHBondContact O-N 2.86Å; K547-R739 WeakPolarHBondContact O-CA 3.45Å; K547-L740 WeakPolarHBondContact O-CB 3.4Å; K547-L740 PolarHBondContact O-N 3.36Å
548	I	93.5	Very high	91.3	Very high	74 Å²	74	43.4 Å²	43.4	38%	0.379	24%	0.236	S	C	.	.	B	Isolated β-bridge	trans	-65.7	123.3	179.6	-64	169.6	0	0	0	108.6	V541 N542 S546 I550 G738	V541-I548 CarbonylContact C-O 3.52Å; V541-I548 WeakPolarHBondContact CA-O 3.4Å; V541-I548 WeakPolarHBondContact CB-O 3.49Å; N542-I548 HydrophobicContact CB-CB 4.37Å; N542-I548 PolarHBondContact N-O 3.19Å; S546-I548 PolarHBondContact O-N 3.28Å; I548-I550 PolarHBondContact O-N 2.82Å; I548-G738 WeakPolarHBondContact CA-O 3.15Å
549	L	93.3	Very high	91.1	Very high	16 Å²	16	47.1 Å²	47.1	8%	0.084	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	123.2	-179.6	-176.2	63.5	0	0	0	110.2	P539 K547 P708 Q710 Y733 T735 G738	P539-L549 HydrophobicContact CB-CD1 3.52Å; K547-L549 PolarHBondContact O-N 2.86Å; L549-P708 HydrophobicContact CD2-CG 4.14Å; L549-P708 HydrophobicContact CG-CG 4.42Å; L549-Q710 HydrophobicContact CD2-CG 4.2Å; L549-Y733 HydrophobicContact CD2-CD2 4.18Å; L549-Y733 HydrophobicContact CD2-CG 4.05Å; L549-T735 HydrophobicContact CB-CG2 4.46Å; L549-T735 HydrophobicContact CD2-CG2 4.09Å; L549-G738 PolarHBondContact N-O 2.84Å; L549-G738 VanDerWaalsContact N-O 3.08Å
550	I	91.8	Very high	90.8	Very high	64 Å²	64	54.1 Å²	54.1	33%	0.328	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-35.2	177.9	-65.9	179.5	0	0	0	111.2	L518 L540 N542 I548	L518-I550 HydrophobicContact CD1-CD1 3.62Å; L518-I550 HydrophobicContact CD2-CD1 4.18Å; L518-I550 HydrophobicContact CG-CD1 3.89Å; L540-I550 HydrophobicContact CD2-CB 4.48Å; L540-I550 HydrophobicContact CD2-CG2 4.23Å; L540-I550 HydrophobicContact CG-CB 4.45Å; L540-I550 PolarHBondContact O-N 2.6Å; N542-I550 HydrophobicContact CB-CD1 3.82Å; N542-I550 HydrophobicContact CB-CG1 4.31Å; I548-I550 PolarHBondContact O-N 2.82Å
551	G	91.8	Very high	90.4	Very high	0 Å²	0	55.4 Å²	55.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.3	-169	-175.3	0	0	0	0	0	113.1	P539 L540 D705	P539-G551 WeakPolarHBondContact CA-O 3.3Å; L540-G551 PolarHBondContact N-O 3.46Å; L540-G551 PolarHBondContact O-N 2.63Å; G551-D705 CarbonylContact C-O 3.59Å; G551-D705 WeakPolarHBondContact CA-O 3.26Å
552	E	90.9	Very high	90.1	Very high	26 Å²	26	56.5 Å²	56.5	12%	0.121	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	153.4	164.5	73.3	165.4	-161.4	0	0	113	T537 F538 D705 P708 R731 Y733	T537-E552 PolarHBondContact OG1-OE2 3.04Å; F538-E552 WeakPolarHBondContact O-CA 3.44Å; E552-D705 HydrophobicContact CG-CB 3.86Å; E552-D705 PolarHBondContact N-O 3.01Å; E552-D705 PolarHBondContact O-N 2.97Å; E552-D705 VanDerWaalsContact O-N 3.07Å; E552-P708 HydrophobicContact CB-CB 4.4Å; E552-P708 HydrophobicContact CG-CB 4.13Å; E552-R731 IonicContact OE1-CZ 2.65Å; E552-R731 IonicContact OE1-NE 3.54Å; E552-R731 IonicContact OE1-NH2 3.74Å; E552-R731 PolarHBondContact OE1-NH2 3.42Å; E552-R731 IonicContact OE2-CZ 2.72Å; E552-R731 IonicContact OE2-NE 3.01Å; E552-R731 PolarHBondContact OE2-NE 3.49Å; E552-R731 VanDerWaalsContact OE2-NE 3.12Å; E552-R731 IonicContact OE2-NH1 2.66Å; E552-R731 IonicContact OE2-NH2 2.67Å; E552-R731 PolarHBondContact OE2-NH2 2.96Å; E552-Y733 HydrophobicContact CB-CE2 4.33Å; E552-Y733 PolarHBondContact OE2-OH 3.41Å
553	I	91.3	Very high	89.7	Confident	1 Å²	1	56.2 Å²	56.2	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	134.7	177.8	-49.5	169.8	0	0	0	108.8	L516 T537 F538 L540 E557 L558 Y699 I702 L704	L516-I553 HydrophobicContact CD1-CD1 4.41Å; T537-I553 CarbonylContact C-O 3.57Å; T537-I553 WeakPolarHBondContact CA-O 3.09Å; T537-I553 VanDerWaalsContact CB-O 3.26Å; T537-I553 WeakPolarHBondContact CB-O 3.36Å; F538-I553 PolarHBondContact N-O 3.38Å; F538-I553 PolarHBondContact O-N 3.32Å; L540-I553 HydrophobicContact CB-CD1 4.36Å; L540-I553 HydrophobicContact CD2-CD1 4.42Å; I553-E557 HydrophobicContact CG2-CB 3.94Å; I553-L558 HydrophobicContact CB-CD2 4.37Å; I553-L558 HydrophobicContact CB-CG 4.42Å; I553-L558 HydrophobicContact CD1-CD2 4.31Å; I553-L558 HydrophobicContact CG2-CD2 3.81Å; I553-L558 HydrophobicContact CG2-CG 3.83Å; I553-Y699 HydrophobicContact CD1-CD1 3.7Å; I553-Y699 HydrophobicContact CD1-CE1 3.63Å; I553-I702 HydrophobicContact CD1-CD1 4.44Å; I553-I702 HydrophobicContact CG2-CG2 4.08Å; I553-L704 HydrophobicContact CD1-CD2 4.01Å; I553-L704 HydrophobicContact CG1-CD2 3.44Å; I553-L704 VanDerWaalsContact CG1-CD2 3.44Å; I553-L704 HydrophobicContact CG1-CG 4.31Å
554	S	89.9	Confident	89.2	Confident	29 Å²	29	54.8 Å²	54.8	20%	0.203	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	151	177.5	88	0	0	0	0	113.2	A556 E557 L558	S554-A556 PolarHBondContact O-N 3.36Å; S554-A556 VanDerWaalsContact O-N 3.16Å; S554-A556 PolarHBondContact OG-N 3.43Å; S554-E557 WeakPolarHBondContact CB-OE2 3.44Å; S554-E557 PolarHBondContact N-OE2 2.88Å; S554-E557 PolarHBondContact O-N 2.82Å; S554-E557 VanDerWaalsContact O-N 3.13Å; S554-E557 VanDerWaalsContact OG-CD 3.3Å; S554-E557 PolarHBondContact OG-N 3.22Å; S554-E557 VanDerWaalsContact OG-N 3.11Å; S554-E557 PolarHBondContact OG-OE2 3.36Å; S554-L558 WeakPolarHBondContact O-CG 3.27Å; S554-L558 PolarHBondContact O-N 3.14Å
555	R	90.5	Very high	88.7	Confident	49 Å²	49	51.5 Å²	51.5	19%	0.185	28%	0.28	C	S	.	.	H	α-helix	trans	-55.8	-31.5	171.5	-165.3	-168.3	172.4	82	8.6	111.2	L529 F532 V535 R536 I559	L529-R555 HydrophobicContact CD2-CB 4.5Å; L529-R555 HydrophobicContact CD2-CG 3.45Å; L529-R555 VanDerWaalsContact CD2-CG 3.45Å; L529-R555 VanDerWaalsContact O-CZ 3.28Å; L529-R555 PolarHBondContact O-NH1 3.01Å; L529-R555 PolarHBondContact O-NH2 3.41Å; F532-R555 PolarHBondContact O-NH1 2.92Å; V535-R555 WeakPolarHBondContact O-CD 3.34Å; R536-R555 VanDerWaalsContact O-CB 3.27Å; R536-R555 WeakPolarHBondContact O-CB 3.05Å; R536-R555 PolarHBondContact O-N 3.32Å; R555-I559 HydrophobicContact CG-CD1 3.99Å; R555-I559 WeakPolarHBondContact O-CB 3.49Å; R555-I559 WeakPolarHBondContact O-CD1 3.47Å; R555-I559 WeakPolarHBondContact O-CG1 3.21Å; R555-I559 PolarHBondContact O-N 3.16Å
556	A	86.8	Confident	88	Confident	71 Å²	71	47.9 Å²	47.9	59%	0.587	26%	0.255	S	S	*	.	H	α-helix	trans	-70.5	-41.8	178.2	0	0	0	0	0	112.1	S554 K560	S554-A556 PolarHBondContact O-N 3.36Å; S554-A556 VanDerWaalsContact O-N 3.16Å; S554-A556 PolarHBondContact OG-N 3.43Å; A556-K560 VanDerWaalsContact O-CB 3.28Å; A556-K560 WeakPolarHBondContact O-CB 3.11Å; A556-K560 PolarHBondContact O-N 3.2Å
557	E	88.1	Confident	87.1	Confident	59 Å²	59	50.6 Å²	50.6	28%	0.276	27%	0.267	S	S	.	.	H	α-helix	trans	-64.1	-46.1	171.3	-83.2	102.7	-155.8	0	0	111.7	I553 S554 I559 K560 L561 I702	I553-E557 HydrophobicContact CG2-CB 3.94Å; S554-E557 WeakPolarHBondContact CB-OE2 3.44Å; S554-E557 PolarHBondContact N-OE2 2.88Å; S554-E557 PolarHBondContact O-N 2.82Å; S554-E557 VanDerWaalsContact O-N 3.13Å; S554-E557 VanDerWaalsContact OG-CD 3.3Å; S554-E557 PolarHBondContact OG-N 3.22Å; S554-E557 VanDerWaalsContact OG-N 3.11Å; S554-E557 PolarHBondContact OG-OE2 3.36Å; E557-I559 VanDerWaalsContact C-N 3.3Å; E557-I559 PolarHBondContact O-N 3.42Å; E557-K560 CarbonylContact O-C 3.49Å; E557-K560 WeakPolarHBondContact O-CA 3.36Å; E557-K560 WeakPolarHBondContact O-CB 3.43Å; E557-K560 PolarHBondContact O-N 3.35Å; E557-L561 WeakPolarHBondContact O-CB 3.3Å; E557-L561 WeakPolarHBondContact O-CD1 3.48Å; E557-L561 VanDerWaalsContact O-CG 3.24Å; E557-L561 WeakPolarHBondContact O-CG 3.45Å; E557-L561 PolarHBondContact O-N 3.07Å; E557-I702 HydrophobicContact CB-CG2 4.28Å; E557-I702 HydrophobicContact CG-CG2 4.34Å
558	L	89.5	Confident	86.2	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	27%	0.269	C	S	.	.	H	α-helix	trans	-58.2	-41.8	178.6	-65.7	173	0	0	0	111.9	L516 I525 L529 F538 I553 S554 L561 L562	L516-L558 HydrophobicContact CD1-CD1 3.9Å; L516-L558 HydrophobicContact CD1-CD2 3.85Å; I525-L558 HydrophobicContact CD1-CD2 4.23Å; I525-L558 HydrophobicContact CG1-CD2 4.46Å; I525-L558 HydrophobicContact CG2-CB 4.13Å; I525-L558 HydrophobicContact CG2-CD2 4.09Å; L529-L558 HydrophobicContact CD1-CB 4.09Å; L529-L558 HydrophobicContact CD2-CB 4.15Å; L529-L558 HydrophobicContact CD2-CD1 4.32Å; L529-L558 HydrophobicContact CG-CB 4.48Å; F538-L558 HydrophobicContact CD2-CD1 3.7Å; F538-L558 HydrophobicContact CE2-CD1 4.26Å; I553-L558 HydrophobicContact CB-CD2 4.37Å; I553-L558 HydrophobicContact CB-CG 4.42Å; I553-L558 HydrophobicContact CD1-CD2 4.31Å; I553-L558 HydrophobicContact CG2-CD2 3.81Å; I553-L558 HydrophobicContact CG2-CG 3.83Å; S554-L558 WeakPolarHBondContact O-CG 3.27Å; S554-L558 PolarHBondContact O-N 3.14Å; L558-L561 PolarHBondContact O-N 3.01Å; L558-L562 WeakPolarHBondContact O-CB 3.4Å; L558-L562 PolarHBondContact O-N 3.44Å
559	I	88.7	Confident	84.9	Confident	81 Å²	81	47.6 Å²	47.6	42%	0.415	26%	0.255	S	S	.	.	H	α-helix	trans	-67	-40.1	173.8	-69.9	167.5	0	0	0	111.6	L529 R555 E557 L561 S563	L529-I559 HydrophobicContact CD1-CG1 4.01Å; L529-I559 HydrophobicContact CD2-CG1 4.34Å; R555-I559 HydrophobicContact CG-CD1 3.99Å; R555-I559 WeakPolarHBondContact O-CB 3.49Å; R555-I559 WeakPolarHBondContact O-CD1 3.47Å; R555-I559 WeakPolarHBondContact O-CG1 3.21Å; R555-I559 PolarHBondContact O-N 3.16Å; E557-I559 VanDerWaalsContact C-N 3.3Å; E557-I559 PolarHBondContact O-N 3.42Å; I559-L561 VanDerWaalsContact C-N 3.33Å; I559-L561 PolarHBondContact O-N 2.99Å; I559-S563 WeakPolarHBondContact O-CB 3.14Å; I559-S563 PolarHBondContact O-N 3.13Å; I559-S563 PolarHBondContact O-OG 3.39Å
560	K	86.3	Confident	83.8	Confident	151 Å²	151	50.2 Å²	50.2	66%	0.657	27%	0.267	S	S	*	.	H	α-helix	trans	-63.3	-37.6	175.7	-176.9	-175.6	176.1	-171.3	0	111.9	A556 E557 S563 S564	A556-K560 VanDerWaalsContact O-CB 3.28Å; A556-K560 WeakPolarHBondContact O-CB 3.11Å; A556-K560 PolarHBondContact O-N 3.2Å; E557-K560 CarbonylContact O-C 3.49Å; E557-K560 WeakPolarHBondContact O-CA 3.36Å; E557-K560 WeakPolarHBondContact O-CB 3.43Å; E557-K560 PolarHBondContact O-N 3.35Å; K560-S563 WeakPolarHBondContact CA-OG 3.31Å; K560-S563 PolarHBondContact O-OG 3.18Å; K560-S564 VanDerWaalsContact O-CB 3.24Å; K560-S564 WeakPolarHBondContact O-CB 3.1Å; K560-S564 PolarHBondContact O-N 3.4Å; K560-S564 PolarHBondContact O-OG 2.8Å
561	L	86	Confident	82.8	Confident	28 Å²	28	55.1 Å²	55.1	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-71.6	-47.8	177.2	-70.1	159.2	0	0	0	111.8	Y522 E557 L558 I559 S563 S564 K565 I702	Y522-L561 HydrophobicContact CE1-CB 4.28Å; E557-L561 WeakPolarHBondContact O-CB 3.3Å; E557-L561 WeakPolarHBondContact O-CD1 3.48Å; E557-L561 VanDerWaalsContact O-CG 3.24Å; E557-L561 WeakPolarHBondContact O-CG 3.45Å; E557-L561 PolarHBondContact O-N 3.07Å; L558-L561 PolarHBondContact O-N 3.01Å; I559-L561 VanDerWaalsContact C-N 3.33Å; I559-L561 PolarHBondContact O-N 2.99Å; L561-S563 PolarHBondContact O-N 3.12Å; L561-S564 PolarHBondContact O-N 3.01Å; L561-S564 PolarHBondContact O-OG 3.42Å; L561-K565 PolarHBondContact O-N 2.55Å; L561-I702 HydrophobicContact CD1-CB 4.47Å; L561-I702 HydrophobicContact CD1-CD1 3.45Å; L561-I702 VanDerWaalsContact CD1-CD1 3.45Å; L561-I702 HydrophobicContact CD1-CG1 3.7Å; L561-I702 HydrophobicContact CD1-CG2 3.93Å; L561-I702 HydrophobicContact CD2-CG1 4.08Å
562	L	86	Confident	81.9	Confident	22 Å²	22	60.5 Å²	60.5	12%	0.115	31%	0.305	C	S	.	.	H	α-helix	trans	-60.2	-46.7	176.9	-174.2	65.7	0	0	0	111	Y522 R526 L529 L558 K565 L566 L693	Y522-L562 HydrophobicContact CD1-CD1 4.2Å; R526-L562 HydrophobicContact CB-CD1 4.47Å; R526-L562 HydrophobicContact CB-CD2 4.13Å; R526-L562 HydrophobicContact CG-CD2 4.23Å; L529-L562 HydrophobicContact CD1-CD2 4.32Å; L558-L562 WeakPolarHBondContact O-CB 3.4Å; L558-L562 PolarHBondContact O-N 3.44Å; L562-K565 PolarHBondContact O-N 3.44Å; L562-L566 HydrophobicContact CG-CD1 4.26Å; L562-L566 VanDerWaalsContact O-CG 3.29Å; L562-L566 WeakPolarHBondContact O-CG 3.23Å; L562-L566 PolarHBondContact O-N 2.9Å; L562-L693 HydrophobicContact CD1-CD2 3.78Å
563	S	83.6	Confident	80.8	Confident	50 Å²	50	61.7 Å²	61.7	35%	0.35	31%	0.31	S	S	.	.	H	α-helix	trans	-68.3	-32.9	176.6	56.9	0	0	0	0	113.6	I559 K560 L561 L566 L567	I559-S563 WeakPolarHBondContact O-CB 3.14Å; I559-S563 PolarHBondContact O-N 3.13Å; I559-S563 PolarHBondContact O-OG 3.39Å; K560-S563 WeakPolarHBondContact CA-OG 3.31Å; K560-S563 PolarHBondContact O-OG 3.18Å; L561-S563 PolarHBondContact O-N 3.12Å; S563-L566 PolarHBondContact O-N 2.93Å; S563-L567 WeakPolarHBondContact O-CB 3.33Å; S563-L567 VanDerWaalsContact O-CG 3.26Å; S563-L567 WeakPolarHBondContact O-CG 3.48Å; S563-L567 PolarHBondContact O-N 3.08Å
564	S	81.8	Confident	79.9	Confident	50 Å²	50	67.3 Å²	67.3	35%	0.35	34%	0.335	S	S	.	.	H	α-helix	trans	-67.1	-41	175.6	76.3	0	0	0	0	111.9	K560 L561 L567 I568	K560-S564 VanDerWaalsContact O-CB 3.24Å; K560-S564 WeakPolarHBondContact O-CB 3.1Å; K560-S564 PolarHBondContact O-N 3.4Å; K560-S564 PolarHBondContact O-OG 2.8Å; L561-S564 PolarHBondContact O-N 3.01Å; L561-S564 PolarHBondContact O-OG 3.42Å; S564-L567 PolarHBondContact O-N 3.33Å; S564-I568 WeakPolarHBondContact O-CD1 3.2Å; S564-I568 VanDerWaalsContact O-CG1 3.26Å; S564-I568 WeakPolarHBondContact O-CG1 2.95Å; S564-I568 PolarHBondContact O-N 3.5Å
565	K	79.5	Confident	78.9	Confident	57 Å²	57	75.5 Å²	75.5	25%	0.248	36%	0.361	C	S	.	.	H	α-helix	trans	-61.3	-50.5	171.3	-80.2	-81.8	-172.9	155.1	0	111.5	Y522 L561 L562 L567 I568 V569 D695	Y522-K565 HydrophobicContact CD1-CG 4.34Å; Y522-K565 HydrophobicContact CD2-CG 4.39Å; Y522-K565 HydrophobicContact CE1-CG 3.76Å; Y522-K565 HydrophobicContact CE2-CD 3.99Å; Y522-K565 HydrophobicContact CE2-CG 3.86Å; Y522-K565 VanDerWaalsContact CZ-CE 3.5Å; Y522-K565 VanDerWaalsContact CZ-CG 3.5Å; Y522-K565 WeakPolarHBondContact OH-CE 3.49Å; L561-K565 PolarHBondContact O-N 2.55Å; L562-K565 PolarHBondContact O-N 3.44Å; K565-L567 VanDerWaalsContact C-N 3.3Å; K565-L567 PolarHBondContact O-N 3.06Å; K565-I568 CarbonylContact O-C 3.54Å; K565-I568 WeakPolarHBondContact O-CA 3.31Å; K565-I568 WeakPolarHBondContact O-CB 3.19Å; K565-I568 PolarHBondContact O-N 2.89Å; K565-V569 WeakPolarHBondContact O-CG2 3.45Å; K565-V569 PolarHBondContact O-N 2.86Å; K565-D695 IonicContact NZ-OD2 3.7Å; K565-D695 PolarHBondContact NZ-OD2 2.86Å
566	L	76.5	Confident	78.1	Confident	66 Å²	66	79.7 Å²	79.7	35%	0.346	38%	0.381	S	S	.	.	H	α-helix	trans	-56.7	-42	178	-69.4	167.8	0	0	0	112.2	L562 S563 I568 V569 E570	L562-L566 HydrophobicContact CG-CD1 4.26Å; L562-L566 VanDerWaalsContact O-CG 3.29Å; L562-L566 WeakPolarHBondContact O-CG 3.23Å; L562-L566 PolarHBondContact O-N 2.9Å; S563-L566 PolarHBondContact O-N 2.93Å; L566-I568 VanDerWaalsContact C-N 3.32Å; L566-I568 PolarHBondContact O-N 3.36Å; L566-V569 WeakPolarHBondContact O-CB 3.48Å; L566-V569 PolarHBondContact O-N 3.36Å; L566-E570 PolarHBondContact O-N 3.03Å
567	L	72.5	Confident	77.6	Confident	84 Å²	84	82 Å²	82	44%	0.44	38%	0.377	S	S	.	.	H	α-helix	trans	-66	-30.4	174.1	-72.4	170.6	0	0	0	113.3	S563 S564 K565 R571	S563-L567 WeakPolarHBondContact O-CB 3.33Å; S563-L567 VanDerWaalsContact O-CG 3.26Å; S563-L567 WeakPolarHBondContact O-CG 3.48Å; S563-L567 PolarHBondContact O-N 3.08Å; S564-L567 PolarHBondContact O-N 3.33Å; K565-L567 VanDerWaalsContact C-N 3.3Å; K565-L567 PolarHBondContact O-N 3.06Å; L567-R571 WeakPolarHBondContact O-CB 3.4Å; L567-R571 VanDerWaalsContact O-CD 3.28Å; L567-R571 WeakPolarHBondContact O-CD 3.35Å; L567-R571 WeakPolarHBondContact O-CG 3.12Å; L567-R571 PolarHBondContact O-N 3.44Å
568	I	72.3	Confident	76.8	Confident	78 Å²	78	87.7 Å²	87.7	40%	0.4	40%	0.397	S	S	.	.	H	α-helix	trans	-71.9	-39.4	172.7	-70.4	162.7	0	0	0	110.7	S564 K565 L566 R571 K572	S564-I568 WeakPolarHBondContact O-CD1 3.2Å; S564-I568 VanDerWaalsContact O-CG1 3.26Å; S564-I568 WeakPolarHBondContact O-CG1 2.95Å; S564-I568 PolarHBondContact O-N 3.5Å; K565-I568 CarbonylContact O-C 3.54Å; K565-I568 WeakPolarHBondContact O-CA 3.31Å; K565-I568 WeakPolarHBondContact O-CB 3.19Å; K565-I568 PolarHBondContact O-N 2.89Å; L566-I568 VanDerWaalsContact C-N 3.32Å; L566-I568 PolarHBondContact O-N 3.36Å; I568-R571 PolarHBondContact O-N 3Å; I568-K572 HydrophobicContact CG2-CD 4.18Å; I568-K572 HydrophobicContact CG2-CG 4.43Å; I568-K572 WeakPolarHBondContact O-CB 3.43Å; I568-K572 WeakPolarHBondContact O-CG 2.91Å; I568-K572 PolarHBondContact O-N 3.42Å
569	V	66	Low	75.8	Confident	16 Å²	16	96.6 Å²	96.6	10%	0.097	43%	0.43	C	S	.	.	H	α-helix	trans	-59.4	-55.7	173.7	176.1	0	0	0	0	110.3	K565 L566 R571 K572 E573 Q692	K565-V569 WeakPolarHBondContact O-CG2 3.45Å; K565-V569 PolarHBondContact O-N 2.86Å; L566-V569 WeakPolarHBondContact O-CB 3.48Å; L566-V569 PolarHBondContact O-N 3.36Å; V569-R571 PolarHBondContact O-N 2.94Å; V569-R571 VanDerWaalsContact O-N 3.15Å; V569-K572 WeakPolarHBondContact O-CB 3.12Å; V569-K572 PolarHBondContact O-N 3.32Å; V569-E573 WeakPolarHBondContact CG1-OE1 3.27Å; V569-E573 PolarHBondContact O-N 3.11Å; V569-Q692 HydrophobicContact CG2-CB 4.13Å; V569-Q692 HydrophobicContact CG2-CG 4.49Å
570	E	69.5	Low	75	Confident	72 Å²	72	102.3 Å²	102.3	34%	0.336	45%	0.446	S	S	.	.	H	α-helix	trans	-49.6	-44.9	175.3	-83.1	-163.3	-144.7	0	0	112.1	L566 K574	L566-E570 PolarHBondContact O-N 3.03Å; E570-K574 VanDerWaalsContact O-CB 3.31Å; E570-K574 WeakPolarHBondContact O-CB 3.42Å; E570-K574 WeakPolarHBondContact O-CD 3.27Å; E570-K574 WeakPolarHBondContact O-CG 3.31Å; E570-K574 PolarHBondContact O-N 3.41Å; E570-K574 IonicContact OE2-NZ 2.61Å; E570-K574 PolarHBondContact OE2-NZ 2.98Å
571	R	71.8	Confident	74.5	Confident	166 Å²	166	102.6 Å²	102.6	63%	0.626	45%	0.448	S	S	*	.	H	α-helix	trans	-69.2	-39.2	-179	-74.8	168.8	179.2	-168.9	-0.6	112.2	L567 I568 V569 R575	L567-R571 WeakPolarHBondContact O-CB 3.4Å; L567-R571 VanDerWaalsContact O-CD 3.28Å; L567-R571 WeakPolarHBondContact O-CD 3.35Å; L567-R571 WeakPolarHBondContact O-CG 3.12Å; L567-R571 PolarHBondContact O-N 3.44Å; I568-R571 PolarHBondContact O-N 3Å; V569-R571 PolarHBondContact O-N 2.94Å; V569-R571 VanDerWaalsContact O-N 3.15Å; R571-R575 WeakPolarHBondContact O-CB 3.32Å; R571-R575 VanDerWaalsContact O-CG 3.3Å; R571-R575 WeakPolarHBondContact O-CG 3.08Å; R571-R575 PolarHBondContact O-N 2.86Å
572	K	72	Confident	73.7	Confident	113 Å²	113	110.7 Å²	110.7	49%	0.491	48%	0.476	S	S	.	.	H	α-helix	trans	-62.7	-45.1	174.3	-77.2	174.3	177.7	179.1	0	110.5	I568 V569 R575 K576	I568-K572 HydrophobicContact CG2-CD 4.18Å; I568-K572 HydrophobicContact CG2-CG 4.43Å; I568-K572 WeakPolarHBondContact O-CB 3.43Å; I568-K572 WeakPolarHBondContact O-CG 2.91Å; I568-K572 PolarHBondContact O-N 3.42Å; V569-K572 WeakPolarHBondContact O-CB 3.12Å; V569-K572 PolarHBondContact O-N 3.32Å; K572-R575 PolarHBondContact O-N 2.68Å; K572-K576 WeakPolarHBondContact O-CG 2.98Å; K572-K576 PolarHBondContact O-N 3.4Å
573	E	68.4	Low	72.6	Confident	51 Å²	51	114.4 Å²	114.4	24%	0.238	50%	0.496	C	S	.	.	H	α-helix	trans	-66.7	-47.2	178.5	-73.8	176	-161.7	0	0	113.2	V569 R575 K576 K577	V569-E573 WeakPolarHBondContact CG1-OE1 3.27Å; V569-E573 PolarHBondContact O-N 3.11Å; E573-R575 PolarHBondContact O-N 3.29Å; E573-K576 CarbonylContact O-C 3.45Å; E573-K576 WeakPolarHBondContact O-CA 3.2Å; E573-K576 WeakPolarHBondContact O-CB 3.42Å; E573-K576 PolarHBondContact O-N 3.19Å; E573-K577 PolarHBondContact O-N 3.15Å
574	K	71.6	Confident	71.7	Confident	119 Å²	119	116.3 Å²	116.3	52%	0.517	51%	0.509	S	S	.	.	H	α-helix	trans	-57	-40.4	175.2	-73.3	164.7	-177	173.7	0	110.5	E570 W578	E570-K574 VanDerWaalsContact O-CB 3.31Å; E570-K574 WeakPolarHBondContact O-CB 3.42Å; E570-K574 WeakPolarHBondContact O-CD 3.27Å; E570-K574 WeakPolarHBondContact O-CG 3.31Å; E570-K574 PolarHBondContact O-N 3.41Å; E570-K574 IonicContact OE2-NZ 2.61Å; E570-K574 PolarHBondContact OE2-NZ 2.98Å; K574-W578 WeakPolarHBondContact O-CB 3.47Å; K574-W578 VanDerWaalsContact O-CD1 3.3Å; K574-W578 PolarHBondContact O-N 2.83Å
575	R	70.2	Confident	70.5	Confident	202 Å²	202	118.4 Å²	118.4	76%	0.762	52%	0.524	S	S	*	.	H	α-helix	trans	-64.5	-43.8	171.3	-75.2	176.1	174.8	-169	-1.7	113.2	R571 K572 E573 W578 R579	R571-R575 WeakPolarHBondContact O-CB 3.32Å; R571-R575 VanDerWaalsContact O-CG 3.3Å; R571-R575 WeakPolarHBondContact O-CG 3.08Å; R571-R575 PolarHBondContact O-N 2.86Å; K572-R575 PolarHBondContact O-N 2.68Å; E573-R575 PolarHBondContact O-N 3.29Å; R575-W578 PolarHBondContact O-N 2.96Å; R575-R579 WeakPolarHBondContact O-CB 3.02Å; R575-R579 PolarHBondContact O-N 3.22Å
576	K	74	Confident	69.1	Low	137 Å²	137	123.5 Å²	123.5	60%	0.596	55%	0.546	S	S	*	.	H	α-helix	trans	-58.6	-47.9	174	-74.9	175.2	178	177.7	0	111.4	K572 E573 R579 R580	K572-K576 WeakPolarHBondContact O-CG 2.98Å; K572-K576 PolarHBondContact O-N 3.4Å; E573-K576 CarbonylContact O-C 3.45Å; E573-K576 WeakPolarHBondContact O-CA 3.2Å; E573-K576 WeakPolarHBondContact O-CB 3.42Å; E573-K576 PolarHBondContact O-N 3.19Å; K576-R579 PolarHBondContact O-N 3.39Å; K576-R580 PolarHBondContact O-N 2.68Å
577	K	75.8	Confident	67.9	Low	118 Å²	118	127.2 Å²	127.2	51%	0.513	57%	0.566	S	S	.	*	H	α-helix	trans	-64	-41.5	-179.7	-162.5	164.1	-175.4	168	0	111.7	E573 K581	E573-K577 PolarHBondContact O-N 3.15Å; K577-K581 PolarHBondContact O-N 2.67Å; K577-K581 VanDerWaalsContact O-N 3.13Å
578	W	71.3	Confident	66.8	Low	180 Å²	180	128.5 Å²	128.5	68%	0.682	58%	0.577	S	S	*	*	H	α-helix	trans	-63.1	-44.1	171.3	-93.4	87.4	0	0	0	113.2	K574 R575 K581 R582	K574-W578 WeakPolarHBondContact O-CB 3.47Å; K574-W578 VanDerWaalsContact O-CD1 3.3Å; K574-W578 PolarHBondContact O-N 2.83Å; R575-W578 PolarHBondContact O-N 2.96Å; W578-K581 PolarHBondContact O-N 3.29Å; W578-R582 PolarHBondContact O-N 3.39Å
579	R	69.1	Low	65.2	Low	188 Å²	188	132.1 Å²	132.1	71%	0.709	60%	0.596	S	S	*	*	H	α-helix	trans	-64	-40.5	178.4	-175.1	173.3	170.2	-176.6	-4.6	111.8	R575 K576 R582 L583	R575-R579 WeakPolarHBondContact O-CB 3.02Å; R575-R579 PolarHBondContact O-N 3.22Å; K576-R579 PolarHBondContact O-N 3.39Å; R579-R582 PolarHBondContact O-N 2.71Å; R579-L583 HydrophobicContact CG-CD1 4.15Å; R579-L583 PolarHBondContact O-N 3.09Å
580	R	72	Confident	64	Low	200 Å²	200	137 Å²	137	76%	0.755	63%	0.628	S	S	*	*	H	α-helix	trans	-58.7	-51	172.2	-75.1	-178.2	177.1	172.9	-1.1	111.7	K576 R582 L583 S584	K576-R580 PolarHBondContact O-N 2.68Å; R580-R582 VanDerWaalsContact C-N 3.33Å; R580-R582 PolarHBondContact O-N 3.25Å; R580-L583 PolarHBondContact O-N 2.62Å; R580-S584 PolarHBondContact O-N 2.7Å
581	K	74.9	Confident	62.2	Low	157 Å²	157	143.8 Å²	143.8	68%	0.683	66%	0.656	S	S	*	*	H	α-helix	trans	-58.6	-40.3	176.5	-74.8	-163.5	173.1	-165.8	0	112.7	K577 W578 L583 S585	K577-K581 PolarHBondContact O-N 2.67Å; K577-K581 VanDerWaalsContact O-N 3.13Å; W578-K581 PolarHBondContact O-N 3.29Å; K581-L583 PolarHBondContact O-N 3.16Å; K581-S585 WeakPolarHBondContact O-CB 3.36Å; K581-S585 PolarHBondContact O-N 2.75Å; K581-S585 VanDerWaalsContact O-N 3.08Å
582	R	68.3	Low	60.6	Low	198 Å²	198	145.2 Å²	145.2	75%	0.747	67%	0.667	S	S	*	*	H	α-helix	trans	-72	-24.1	179.8	-158.3	179.1	-169.1	-171	5.1	114	W578 R579 R580	W578-R582 PolarHBondContact O-N 3.39Å; R579-R582 PolarHBondContact O-N 2.71Å; R580-R582 VanDerWaalsContact C-N 3.33Å; R580-R582 PolarHBondContact O-N 3.25Å
583	L	64.1	Low	58.8	Low	100 Å²	100	146.5 Å²	146.5	52%	0.524	68%	0.679	S	S	.	*	H	α-helix	trans	-79.8	-47.4	172.9	-81.8	160.3	0	0	0	111.5	R579 R580 K581 S585 K586	R579-L583 HydrophobicContact CG-CD1 4.15Å; R579-L583 PolarHBondContact O-N 3.09Å; R580-L583 PolarHBondContact O-N 2.62Å; K581-L583 PolarHBondContact O-N 3.16Å; L583-S585 VanDerWaalsContact C-N 3.3Å; L583-S585 PolarHBondContact O-N 2.83Å; L583-K586 WeakPolarHBondContact O-CB 3.26Å; L583-K586 PolarHBondContact O-N 3.19Å
584	S	63.5	Low	56.9	Low	91 Å²	91	156.4 Å²	156.4	64%	0.636	72%	0.715	S	S	*	*	H	α-helix	trans	-55.4	-45.1	174.8	166.4	0	0	0	0	111.8	R580 K586 N587	R580-S584 PolarHBondContact O-N 2.7Å; S584-K586 PolarHBondContact O-N 2.62Å; S584-K586 VanDerWaalsContact O-N 3.07Å; S584-N587 PolarHBondContact O-N 3.37Å
585	S	56.9	Low	55.2	Low	93 Å²	93	159.1 Å²	159.1	65%	0.65	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	2.5	176.5	-175.1	0	0	0	0	115.4	K581 L583	K581-S585 WeakPolarHBondContact O-CB 3.36Å; K581-S585 PolarHBondContact O-N 2.75Å; K581-S585 VanDerWaalsContact O-N 3.08Å; L583-S585 VanDerWaalsContact C-N 3.3Å; L583-S585 PolarHBondContact O-N 2.83Å
586	K	50	Low	53.1	Low	165 Å²	165	159.2 Å²	159.2	72%	0.717	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-16.9	176	-98	-166	170.3	-161.7	0	114.3	L583 S584	L583-K586 WeakPolarHBondContact O-CB 3.26Å; L583-K586 PolarHBondContact O-N 3.19Å; S584-K586 PolarHBondContact O-N 2.62Å; S584-K586 VanDerWaalsContact O-N 3.07Å
587	N	51.2	Low	50.9	Low	144 Å²	144	158.2 Å²	158.2	77%	0.77	75%	0.745	S	S	*	*	S	Bend	trans	-96.6	15	-174.8	-70.9	17.2	0	0	0	113.1	S584	S584-N587 PolarHBondContact O-N 3.37Å
588	V	50.4	Low	48.7	Very low	111 Å²	111	161.5 Å²	161.5	67%	0.673	76%	0.762	S	S	*	*	S	Bend	trans	-135.7	149.5	178.6	-170.8	0	0	0	0	108.4
589	I	38.8	Very low	46.9	Very low	153 Å²	153	158.4 Å²	158.4	79%	0.785	77%	0.768	S	S	*	*			trans	90.8	107.6	-178.2	-52.6	162.8	0	0	0	114.4
590	P	40.2	Very low	45.4	Very low	120 Å²	120	154.4 Å²	154.4	78%	0.779	76%	0.764	S	S	*	*			trans	-78.1	162.9	169.4	33.4	-34.6	0	0	0	112.6	K592	P590-K592 PolarHBondContact O-N 3.29Å
591	K	32.6	Very low	43.7	Very low	214 Å²	214	149 Å²	149	93%	0.93	75%	0.754	S	S	*	*	S	Bend	trans	-80.8	103.4	-176.6	-65.3	177	-178.1	173.4	0	113
592	K	37.9	Very low	42	Very low	196 Å²	196	149 Å²	149	85%	0.852	75%	0.753	S	S	*	*			trans	-157.5	153	149.3	-115.8	167.7	-178.1	178.4	0	112	P590	P590-K592 PolarHBondContact O-N 3.29Å
593	N	33.8	Very low	40.7	Very low	140 Å²	140	146.1 Å²	146.1	75%	0.749	75%	0.748	S	S	*	*			trans	38.2	86.1	171	-63	10.9	0	0	0	118.4	Q595	N593-Q595 PolarHBondContact O-N 3.3Å
594	R	29.1	Very low	39.7	Very low	259 Å²	259	144.4 Å²	144.4	98%	0.977	74%	0.742	S	S	*	*			trans	-84.2	93.7	156.3	-83	-175.9	169.6	177.6	-3.5	110.5
595	Q	35.1	Very low	38.8	Very low	176 Å²	176	144.6 Å²	144.6	82%	0.822	74%	0.735	S	S	*	*			trans	-91.7	161.8	160.6	-104	160.5	-45.1	0	0	111.3	N593	N593-Q595 PolarHBondContact O-N 3.3Å
596	K	26.4	Very low	38.2	Very low	203 Å²	203	147.4 Å²	147.4	88%	0.883	73%	0.733	S	S	*	*			trans	-75.5	133.4	-160.3	-60.5	168.7	-177.7	171	0	112.4
597	S	27.7	Very low	38.1	Very low	116 Å²	116	144 Å²	144	81%	0.811	72%	0.719	S	S	*	*			trans	-148.3	141.8	143.3	-164.6	0	0	0	0	109.7
598	H	29.4	Very low	37.8	Very low	188 Å²	188	142.9 Å²	142.9	87%	0.87	71%	0.713	S	S	*	*			trans	-86	134.5	-174.7	-78.5	-89.8	0	0	0	111.4
599	S	33.1	Very low	37.6	Very low	114 Å²	114	141.3 Å²	141.3	80%	0.797	70%	0.703	S	S	*	*			trans	-137.7	130.9	165.6	62.5	0	0	0	0	110.3
600	V	37.1	Very low	38.3	Very low	105 Å²	105	138.7 Å²	138.7	64%	0.636	69%	0.686	S	S	*	*			trans	-60.7	137.4	-172.1	179.7	0	0	0	0	112	T604 I605	V600-T604 HydrophobicContact CG1-CG2 4.24Å; V600-I605 HydrophobicContact CG1-CG1 4.29Å
601	T	38	Very low	38.7	Very low	87 Å²	87	135.4 Å²	135.4	53%	0.534	67%	0.67	S	S	.	*			trans	-69.6	146.9	177.8	36.6	0	0	0	0	112.2	E603 T604	T601-E603 VanDerWaalsContact C-N 3.28Å; T601-E603 PolarHBondContact O-N 3.04Å; T601-T604 WeakPolarHBondContact O-CB 2.78Å; T601-T604 PolarHBondContact O-N 3.43Å; T601-T604 VanDerWaalsContact O-N 3.11Å; T601-T604 PolarHBondContact OG1-OG1 2.98Å
602	K	38.5	Very low	39.4	Very low	155 Å²	155	128 Å²	128	67%	0.674	65%	0.648	S	S	*	*	H	α-helix	trans	-69	-25.9	-173.7	-68.9	-175.3	176.3	-177.1	0	112.7	T604 I605 Y606	K602-T604 VanDerWaalsContact C-N 3.32Å; K602-T604 PolarHBondContact O-N 2.94Å; K602-I605 PolarHBondContact O-N 2.95Å; K602-Y606 WeakPolarHBondContact O-CB 3.17Å; K602-Y606 PolarHBondContact O-N 3.46Å
603	E	41.9	Very low	39.9	Very low	138 Å²	138	122.3 Å²	122.3	65%	0.645	63%	0.63	S	S	*	*	H	α-helix	trans	-59.7	-39.4	170.5	-68.7	82.5	-176.6	0	0	112.3	T601 I605 Y606 E607	T601-E603 VanDerWaalsContact C-N 3.28Å; T601-E603 PolarHBondContact O-N 3.04Å; E603-I605 PolarHBondContact O-N 3.42Å; E603-Y606 PolarHBondContact O-N 2.88Å; E603-E607 PolarHBondContact O-N 3.34Å
604	T	41.9	Very low	40.7	Very low	64 Å²	64	121.1 Å²	121.1	39%	0.393	62%	0.62	S	S	.	*	H	α-helix	trans	-64.8	-40.9	179.7	-43.8	0	0	0	0	111.4	V600 T601 K602 L608	V600-T604 HydrophobicContact CG1-CG2 4.24Å; T601-T604 WeakPolarHBondContact O-CB 2.78Å; T601-T604 PolarHBondContact O-N 3.43Å; T601-T604 VanDerWaalsContact O-N 3.11Å; T601-T604 PolarHBondContact OG1-OG1 2.98Å; K602-T604 VanDerWaalsContact C-N 3.32Å; K602-T604 PolarHBondContact O-N 2.94Å; T604-L608 HydrophobicContact CG2-CD1 4.14Å; T604-L608 WeakPolarHBondContact O-CB 3.47Å; T604-L608 VanDerWaalsContact O-CD1 3.27Å; T604-L608 WeakPolarHBondContact O-CD1 3.42Å; T604-L608 PolarHBondContact O-N 3.21Å
605	I	45.2	Very low	41.4	Very low	96 Å²	96	112.8 Å²	112.8	49%	0.492	60%	0.597	S	S	.	*	H	α-helix	trans	-68.8	-37.1	176.8	-57.7	176.9	0	0	0	110.9	V600 K602 E603 T609	V600-I605 HydrophobicContact CG1-CG1 4.29Å; K602-I605 PolarHBondContact O-N 2.95Å; E603-I605 PolarHBondContact O-N 3.42Å; I605-T609 PolarHBondContact O-N 2.87Å; I605-T609 PolarHBondContact O-OG1 3.44Å
606	Y	43.5	Very low	41.9	Very low	152 Å²	152	107.1 Å²	107.1	60%	0.596	58%	0.581	S	S	*	*	H	α-helix	trans	-66.7	-46	177.3	-177.2	-101.7	0	0	0	112.4	K602 E603 T609 K610	K602-Y606 WeakPolarHBondContact O-CB 3.17Å; K602-Y606 PolarHBondContact O-N 3.46Å; E603-Y606 PolarHBondContact O-N 2.88Å; Y606-T609 PolarHBondContact O-N 2.9Å; Y606-T609 PolarHBondContact O-OG1 3.35Å; Y606-T609 VanDerWaalsContact O-OG1 3.06Å; Y606-K610 HydrophobicContact CE1-CD 4.28Å; Y606-K610 WeakPolarHBondContact O-CB 3.38Å; Y606-K610 PolarHBondContact O-N 3.35Å
607	E	48.9	Very low	42.8	Very low	92 Å²	92	103.2 Å²	103.2	43%	0.43	57%	0.567	S	S	.	*	H	α-helix	trans	-70.7	-33.5	177.1	-69.7	-62.9	135	0	0	112.4	E603 K610 A611	E603-E607 PolarHBondContact O-N 3.34Å; E607-K610 WeakPolarHBondContact OE1-CD 3.38Å; E607-K610 IonicContact OE1-NZ 3.46Å; E607-K610 PolarHBondContact OE1-NZ 2.95Å; E607-K610 WeakPolarHBondContact OE2-CD 3.33Å; E607-K610 IonicContact OE2-NZ 3.49Å; E607-K610 PolarHBondContact OE2-NZ 3.25Å; E607-A611 VanDerWaalsContact O-CB 3.29Å; E607-A611 WeakPolarHBondContact O-CB 3.23Å; E607-A611 PolarHBondContact O-N 2.97Å
608	L	43.7	Very low	43.5	Very low	122 Å²	122	102.7 Å²	102.7	64%	0.639	56%	0.555	S	S	*	*	H	α-helix	trans	-62.9	-44.9	170.2	-101.6	80	0	0	0	112.4	T604 A611 A612	T604-L608 HydrophobicContact CG2-CD1 4.14Å; T604-L608 WeakPolarHBondContact O-CB 3.47Å; T604-L608 VanDerWaalsContact O-CD1 3.27Å; T604-L608 WeakPolarHBondContact O-CD1 3.42Å; T604-L608 PolarHBondContact O-N 3.21Å; L608-A611 PolarHBondContact O-N 2.91Å; L608-A612 WeakPolarHBondContact O-CB 3.48Å; L608-A612 PolarHBondContact O-N 3.36Å
609	T	47.9	Very low	44	Very low	78 Å²	78	99.6 Å²	99.6	48%	0.479	55%	0.545	S	S	.	.	H	α-helix	trans	-69.4	-37.3	179.5	43.5	0	0	0	0	112.4	I605 Y606 A612 V613	I605-T609 PolarHBondContact O-N 2.87Å; I605-T609 PolarHBondContact O-OG1 3.44Å; Y606-T609 PolarHBondContact O-N 2.9Å; Y606-T609 PolarHBondContact O-OG1 3.35Å; Y606-T609 VanDerWaalsContact O-OG1 3.06Å; T609-A612 PolarHBondContact O-N 3.36Å; T609-V613 WeakPolarHBondContact O-CG2 3.39Å; T609-V613 PolarHBondContact O-N 2.85Å
610	K	53	Low	44.4	Very low	97 Å²	97	102.6 Å²	102.6	42%	0.422	55%	0.546	S	S	.	.	H	α-helix	trans	-61.1	-45.8	171.4	178	179.2	160.8	-145.5	0	111.7	Y606 E607 Q614	Y606-K610 HydrophobicContact CE1-CD 4.28Å; Y606-K610 WeakPolarHBondContact O-CB 3.38Å; Y606-K610 PolarHBondContact O-N 3.35Å; E607-K610 WeakPolarHBondContact OE1-CD 3.38Å; E607-K610 IonicContact OE1-NZ 3.46Å; E607-K610 PolarHBondContact OE1-NZ 2.95Å; E607-K610 WeakPolarHBondContact OE2-CD 3.33Å; E607-K610 IonicContact OE2-NZ 3.49Å; E607-K610 PolarHBondContact OE2-NZ 3.25Å; K610-Q614 WeakPolarHBondContact O-CB 3.44Å; K610-Q614 PolarHBondContact O-N 2.96Å; K610-Q614 VanDerWaalsContact O-N 3.11Å
611	A	47.4	Very low	44.2	Very low	52 Å²	52	102 Å²	102	43%	0.43	55%	0.547	S	S	.	.	H	α-helix	trans	-62.8	-45.3	174.3	0	0	0	0	0	112.1	E607 L608 V613 Q614 V615	E607-A611 VanDerWaalsContact O-CB 3.29Å; E607-A611 WeakPolarHBondContact O-CB 3.23Å; E607-A611 PolarHBondContact O-N 2.97Å; L608-A611 PolarHBondContact O-N 2.91Å; A611-V613 PolarHBondContact O-N 3.4Å; A611-Q614 PolarHBondContact O-N 3.08Å; A611-Q614 VanDerWaalsContact O-N 3.13Å; A611-V615 WeakPolarHBondContact O-CG2 3.45Å; A611-V615 PolarHBondContact O-N 2.94Å
612	A	47.3	Very low	44.1	Very low	59 Å²	59	104.2 Å²	104.2	49%	0.488	55%	0.554	S	S	.	*	H	α-helix	trans	-61.6	-42.6	178.7	0	0	0	0	0	112.7	L608 T609 Q614 V615 A616	L608-A612 WeakPolarHBondContact O-CB 3.48Å; L608-A612 PolarHBondContact O-N 3.36Å; T609-A612 PolarHBondContact O-N 3.36Å; A612-Q614 VanDerWaalsContact C-N 3.29Å; A612-Q614 PolarHBondContact O-N 3.05Å; A612-V615 PolarHBondContact O-N 3.48Å; A612-A616 WeakPolarHBondContact O-CB 3.06Å; A612-A616 PolarHBondContact O-N 3.19Å
613	V	48.9	Very low	43.9	Very low	75 Å²	75	102.9 Å²	102.9	46%	0.455	56%	0.561	S	S	.	*	H	α-helix	trans	-63.6	-35.9	174.3	169.5	0	0	0	0	111.6	T609 A611 A616 M617	T609-V613 WeakPolarHBondContact O-CG2 3.39Å; T609-V613 PolarHBondContact O-N 2.85Å; A611-V613 PolarHBondContact O-N 3.4Å; V613-A616 PolarHBondContact O-N 3.42Å; V613-M617 HydrophobicContact CG1-CE 4.42Å; V613-M617 WeakPolarHBondContact O-CG 3.49Å; V613-M617 PolarHBondContact O-N 3.38Å; V613-M617 VanDerWaalsContact O-N 3.08Å
614	Q	50.1	Low	43.4	Very low	116 Å²	116	105.7 Å²	105.7	54%	0.542	57%	0.572	S	S	.	*	H	α-helix	trans	-76.4	-28.9	179.7	-160.6	160.4	5.3	0	0	112.8	K610 A611 A612 L618	K610-Q614 WeakPolarHBondContact O-CB 3.44Å; K610-Q614 PolarHBondContact O-N 2.96Å; K610-Q614 VanDerWaalsContact O-N 3.11Å; A611-Q614 PolarHBondContact O-N 3.08Å; A611-Q614 VanDerWaalsContact O-N 3.13Å; A612-Q614 VanDerWaalsContact C-N 3.29Å; A612-Q614 PolarHBondContact O-N 3.05Å; Q614-L618 PolarHBondContact O-N 2.93Å
615	V	45.2	Very low	42.9	Very low	83 Å²	83	114.1 Å²	114.1	50%	0.503	60%	0.596	S	S	.	*	H	α-helix	trans	-71.3	-40.4	167.3	172.7	0	0	0	0	111.2	A611 A612 M617 L618 N619	A611-V615 WeakPolarHBondContact O-CG2 3.45Å; A611-V615 PolarHBondContact O-N 2.94Å; A612-V615 PolarHBondContact O-N 3.48Å; V615-M617 VanDerWaalsContact C-N 3.33Å; V615-M617 PolarHBondContact O-N 3.11Å; V615-L618 PolarHBondContact O-N 3.34Å; V615-N619 PolarHBondContact O-N 3.12Å
616	A	45.8	Very low	42.3	Very low	58 Å²	58	113.6 Å²	113.6	48%	0.479	61%	0.606	S	S	.	*	H	α-helix	trans	-59.7	-42.2	176.4	0	0	0	0	0	112.2	A612 V613 L618 N619	A612-A616 WeakPolarHBondContact O-CB 3.06Å; A612-A616 PolarHBondContact O-N 3.19Å; V613-A616 PolarHBondContact O-N 3.42Å; A616-L618 PolarHBondContact O-N 2.64Å; A616-N619 PolarHBondContact O-N 2.95Å
617	M	44.3	Very low	41.7	Very low	120 Å²	120	112.3 Å²	112.3	59%	0.591	62%	0.619	S	S	*	*	H	α-helix	trans	-68	-18.3	174.6	-73.3	-175.7	173.4	0	0	114.6	V613 V615	V613-M617 HydrophobicContact CG1-CE 4.42Å; V613-M617 WeakPolarHBondContact O-CG 3.49Å; V613-M617 PolarHBondContact O-N 3.38Å; V613-M617 VanDerWaalsContact O-N 3.08Å; V615-M617 VanDerWaalsContact C-N 3.33Å; V615-M617 PolarHBondContact O-N 3.11Å
618	L	41.8	Very low	41.1	Very low	106 Å²	106	113.8 Å²	113.8	56%	0.555	64%	0.64	S	S	*	*	H	α-helix	trans	-90.4	-13.3	175.6	-84.3	163	0	0	0	113.2	Q614 V615 A616 S621	Q614-L618 PolarHBondContact O-N 2.93Å; V615-L618 PolarHBondContact O-N 3.34Å; A616-L618 PolarHBondContact O-N 2.64Å; L618-S621 PolarHBondContact O-OG 2.78Å
619	N	40.1	Very low	40.6	Very low	123 Å²	123	112.2 Å²	112.2	66%	0.658	64%	0.644	S	S	*	*	H	α-helix	trans	-101.1	-5.4	-175.2	-79.9	-8.7	0	0	0	114.8	V615 A616 S621	V615-N619 PolarHBondContact O-N 3.12Å; A616-N619 PolarHBondContact O-N 2.95Å; N619-S621 VanDerWaalsContact C-N 3.27Å; N619-S621 PolarHBondContact O-N 3.46Å
620	E	42.5	Very low	40.2	Very low	177 Å²	177	113.8 Å²	113.8	83%	0.827	66%	0.656	S	S	*	*	S	Bend	trans	-75.3	-13.3	174	-80.2	-172	135	0	0	113.5	L622	E620-L622 PolarHBondContact O-N 3.22Å
621	S	33.1	Very low	39.2	Very low	93 Å²	93	118.5 Å²	118.5	65%	0.65	68%	0.677	S	S	*	*			trans	-83.4	80	171.7	56	0	0	0	0	112	L618 N619	L618-S621 PolarHBondContact O-OG 2.78Å; N619-S621 VanDerWaalsContact C-N 3.27Å; N619-S621 PolarHBondContact O-N 3.46Å
622	L	34.8	Very low	38.5	Very low	133 Å²	133	126.7 Å²	126.7	70%	0.696	70%	0.696	S	S	*	*			trans	-175.7	106.7	156.9	-107.3	164.6	0	0	0	114	E620	E620-L622 PolarHBondContact O-N 3.22Å
623	P	35.6	Very low	37.7	Very low	126 Å²	126	129.5 Å²	129.5	82%	0.818	71%	0.713	S	S	*	*			trans	-81.5	113.2	162	31.2	-29.7	0	0	0	110.5
624	K	31.3	Very low	36.8	Very low	198 Å²	198	129.4 Å²	129.4	86%	0.861	73%	0.727	S	S	*	*			trans	-81.7	152	-175.5	-68.4	-173.1	176.2	-175.7	0	114
625	R	30.8	Very low	35.8	Very low	241 Å²	241	134.7 Å²	134.7	91%	0.909	74%	0.742	S	S	*	*			trans	-126.1	113.5	177.5	-166.4	178.3	-171.1	-179.5	2.4	112.6
626	A	31.4	Very low	35.1	Very low	85 Å²	85	139 Å²	139	70%	0.702	75%	0.754	S	S	*	*			trans	54.3	142.4	149.5	0	0	0	0	0	124.2
627	S	32.8	Very low	34.4	Very low	125 Å²	125	141.7 Å²	141.7	87%	0.874	76%	0.76	S	S	*	*			trans	69.8	148.9	160.4	74.6	0	0	0	0	118.4
628	S	35.3	Very low	33.8	Very low	122 Å²	122	146.3 Å²	146.3	85%	0.853	78%	0.777	S	S	*	*			cis	-132.8	-163.3	-0.7	66.5	0	0	0	0	112.2
629	A	33.9	Very low	33.4	Very low	89 Å²	89	145.1 Å²	145.1	74%	0.736	78%	0.777	S	S	*	*			trans	-140.4	-156.3	-156.8	0	0	0	0	0	113.4
630	P	40.1	Very low	33.3	Very low	112 Å²	112	146.5 Å²	146.5	73%	0.727	78%	0.78	S	S	*	*				-129.2	177.5	-71.9	36.2	-21.1	0	0	0	114.6
631	K	31.5	Very low	33.2	Very low	196 Å²	196	144.8 Å²	144.8	85%	0.852	78%	0.775	S	S	*	*			trans	168.7	155.5	144.7	-90.3	148.2	-167.1	172.3	0	108.9
632	R	31.2	Very low	33.3	Very low	223 Å²	223	147.9 Å²	147.9	84%	0.842	78%	0.779	S	S	*	*			cis	-155.9	147.7	9.9	-141.6	173.5	-174	166.7	-1	109.9
633	S	32.1	Very low	33.5	Very low	119 Å²	119	146.5 Å²	146.5	83%	0.832	77%	0.771	S	S	*	*			trans	41.1	134.3	156.3	55.2	0	0	0	0	122.2
634	G	29.3	Very low	33.5	Very low	73 Å²	73	147.3 Å²	147.3	75%	0.753	76%	0.763	S	S	*	*			cis	148.9	169.3	-7.8	0	0	0	0	0	114.9
635	R	29.7	Very low	33.9	Very low	227 Å²	227	144.4 Å²	144.4	86%	0.857	75%	0.752	S	S	*	*			trans	90	108.1	162.4	-155.8	177.7	-149.6	-170.1	7.1	119.3
636	K	29.8	Very low	34.2	Very low	173 Å²	173	139.8 Å²	139.8	75%	0.752	74%	0.735	S	S	*	*			trans	69	141.6	159.4	-67.1	177.4	178.8	-174.7	0	116.1
637	N	30.8	Very low	34.5	Very low	115 Å²	115	143.6 Å²	143.6	62%	0.615	73%	0.733	S	S	*	*			cis	-159.5	136.6	13	-111.9	-8.3	0	0	0	112.9	S639	N637-S639 VanDerWaalsContact C-N 3.34Å; N637-S639 PolarHBondContact O-N 3.07Å; N637-S639 PolarHBondContact O-OG 3.29Å
638	K	32	Very low	34.8	Very low	217 Å²	217	141.8 Å²	141.8	94%	0.943	71%	0.713	S	S	*	*	S	Bend	trans	44.5	-9.3	150.8	-83.6	-171	173.7	-175.2	0	124.4
639	S	33.8	Very low	35	Very low	80 Å²	80	142.5 Å²	142.5	56%	0.559	70%	0.701	S	S	*	*			trans	-99.7	-19.3	-177.5	53.7	0	0	0	0	115.6	N637 I641 Q642	N637-S639 VanDerWaalsContact C-N 3.34Å; N637-S639 PolarHBondContact O-N 3.07Å; N637-S639 PolarHBondContact O-OG 3.29Å; S639-I641 PolarHBondContact O-N 2.89Å; S639-Q642 PolarHBondContact O-N 3.45Å
640	E	38.3	Very low	35.3	Very low	153 Å²	153	141.5 Å²	141.5	72%	0.715	68%	0.683	S	S	*	*	H	α-helix	trans	-70.5	-25.4	-166.9	-60.8	-176.8	125	0	0	114.9	Q642 L643 F644	E640-Q642 PolarHBondContact O-N 3.03Å; E640-L643 PolarHBondContact O-N 2.69Å; E640-F644 PolarHBondContact O-N 3Å
641	I	40	Very low	35.1	Very low	140 Å²	140	145.1 Å²	145.1	72%	0.718	68%	0.682	S	S	*	*	H	α-helix	trans	-67.2	-37.2	-178.9	-62.1	176.1	0	0	0	111.3	S639 F644 H645	S639-I641 PolarHBondContact O-N 2.89Å; I641-F644 PolarHBondContact O-N 2.87Å; I641-H645 PolarHBondContact O-N 3.22Å
642	Q	35.7	Very low	35.6	Very low	159 Å²	159	140.4 Å²	140.4	74%	0.743	67%	0.665	S	S	*	*	H	α-helix	trans	-69	-35.8	174.5	-72.3	-179.2	-25.9	0	0	111.5	S639 E640 H645 Y646	S639-Q642 PolarHBondContact O-N 3.45Å; E640-Q642 PolarHBondContact O-N 3.03Å; Q642-H645 PolarHBondContact O-N 2.86Å; Q642-Y646 WeakPolarHBondContact O-CB 3.4Å; Q642-Y646 PolarHBondContact O-N 3.29Å
643	L	37.4	Very low	35.9	Very low	103 Å²	103	132.2 Å²	132.2	54%	0.539	64%	0.64	S	S	.	*	H	α-helix	trans	-67.5	-36	177.3	-155.8	73.7	0	0	0	112	E640 Y646 Y647	E640-L643 PolarHBondContact O-N 2.69Å; L643-Y646 PolarHBondContact O-N 3.01Å; L643-Y647 HydrophobicContact CG-CD2 4.32Å; L643-Y647 HydrophobicContact CG-CE2 4.46Å; L643-Y647 PolarHBondContact O-N 3.46Å
644	F	35.9	Very low	36.2	Very low	144 Å²	144	130.5 Å²	130.5	63%	0.632	63%	0.628	S	S	*	*	H	α-helix	trans	-65.4	-42.8	174.1	-166.7	-97.5	0	0	0	112.2	E640 I641 Y647 L648	E640-F644 PolarHBondContact O-N 3Å; I641-F644 PolarHBondContact O-N 2.87Å; F644-Y647 PolarHBondContact O-N 2.67Å; F644-L648 PolarHBondContact O-N 3.02Å
645	H	39.7	Very low	36.7	Very low	137 Å²	137	130.8 Å²	130.8	63%	0.634	62%	0.623	S	S	*	*	H	α-helix	trans	-61	-42.3	171.9	-101.6	-117.6	0	0	0	112.1	I641 Q642 Y647 L648 F649	I641-H645 PolarHBondContact O-N 3.22Å; Q642-H645 PolarHBondContact O-N 2.86Å; H645-Y647 PolarHBondContact O-N 3.13Å; H645-L648 PolarHBondContact O-N 2.81Å; H645-F649 VanDerWaalsContact O-CB 3.23Å; H645-F649 WeakPolarHBondContact O-CB 3.22Å; H645-F649 PolarHBondContact O-N 2.83Å
646	Y	37.8	Very low	37	Very low	143 Å²	143	126.1 Å²	126.1	56%	0.561	62%	0.615	S	S	*	*	H	α-helix	trans	-61.8	-42.8	176.8	-173.7	-105.2	0	0	0	112.5	Q642 L643 N650	Q642-Y646 WeakPolarHBondContact O-CB 3.4Å; Q642-Y646 PolarHBondContact O-N 3.29Å; L643-Y646 PolarHBondContact O-N 3.01Å; Y646-N650 WeakPolarHBondContact CE1-ND2 3.05Å; Y646-N650 WeakPolarHBondContact O-CB 3.08Å; Y646-N650 PolarHBondContact O-N 3.33Å; Y646-N650 PolarHBondContact O-ND2 3Å
647	Y	37.5	Very low	37.4	Very low	166 Å²	166	122.4 Å²	122.4	65%	0.651	60%	0.603	S	S	*	*	H	α-helix	trans	-65.8	-40.4	174.8	-98.5	-85.9	0	0	0	113.1	L643 F644 H645 R651	L643-Y647 HydrophobicContact CG-CD2 4.32Å; L643-Y647 HydrophobicContact CG-CE2 4.46Å; L643-Y647 PolarHBondContact O-N 3.46Å; F644-Y647 PolarHBondContact O-N 2.67Å; H645-Y647 PolarHBondContact O-N 3.13Å; Y647-R651 WeakPolarHBondContact O-CB 3.19Å; Y647-R651 PolarHBondContact O-N 2.78Å; Y647-R651 VanDerWaalsContact O-N 3.12Å
648	L	40.1	Very low	37.7	Very low	87 Å²	87	128.9 Å²	128.9	46%	0.455	62%	0.619	S	S	.	*	H	α-helix	trans	-68.8	-42.1	177.9	-160.8	72.9	0	0	0	111.4	F644 H645 R651 I652	F644-L648 PolarHBondContact O-N 3.02Å; H645-L648 PolarHBondContact O-N 2.81Å; L648-R651 PolarHBondContact O-N 3.16Å; L648-I652 HydrophobicContact CG-CD1 4.49Å; L648-I652 WeakPolarHBondContact O-CG1 3.24Å; L648-I652 PolarHBondContact O-N 3.05Å
649	F	38.9	Very low	38.1	Very low	136 Å²	136	122.7 Å²	122.7	60%	0.596	60%	0.596	S	S	*	*	H	α-helix	trans	-62.2	-51.7	176.9	-173.9	-99.2	0	0	0	111.7	H645 R651 I652 V653	H645-F649 VanDerWaalsContact O-CB 3.23Å; H645-F649 WeakPolarHBondContact O-CB 3.22Å; H645-F649 PolarHBondContact O-N 2.83Å; F649-R651 PolarHBondContact O-N 3.48Å; F649-I652 PolarHBondContact O-N 3.39Å; F649-I652 VanDerWaalsContact O-N 3.09Å; F649-V653 HydrophobicContact CD1-CG2 4.01Å; F649-V653 HydrophobicContact CE1-CG2 3.76Å; F649-V653 HydrophobicContact CZ-CG2 4.08Å; F649-V653 WeakPolarHBondContact O-CG2 3.43Å; F649-V653 PolarHBondContact O-N 3.09Å
650	N	39.3	Very low	38.4	Very low	68 Å²	68	122.9 Å²	122.9	36%	0.364	59%	0.591	S	S	.	*	H	α-helix	trans	-59.3	-33.7	176.2	-82.9	-30	0	0	0	112.5	Y646 V653 S654	Y646-N650 WeakPolarHBondContact CE1-ND2 3.05Å; Y646-N650 WeakPolarHBondContact O-CB 3.08Å; Y646-N650 PolarHBondContact O-N 3.33Å; Y646-N650 PolarHBondContact O-ND2 3Å; N650-V653 PolarHBondContact O-N 3.26Å; N650-S654 WeakPolarHBondContact O-CB 3.42Å; N650-S654 PolarHBondContact O-N 2.93Å; N650-S654 PolarHBondContact O-OG 3.17Å
651	R	37.1	Very low	38.4	Very low	189 Å²	189	120.4 Å²	120.4	71%	0.713	59%	0.587	S	S	*	*	H	α-helix	trans	-66.7	-41.6	175.3	-163.7	172.3	-175.2	-178.1	0.4	112.1	Y647 L648 F649 S654 A655	Y647-R651 WeakPolarHBondContact O-CB 3.19Å; Y647-R651 PolarHBondContact O-N 2.78Å; Y647-R651 VanDerWaalsContact O-N 3.12Å; L648-R651 PolarHBondContact O-N 3.16Å; F649-R651 PolarHBondContact O-N 3.48Å; R651-S654 PolarHBondContact O-N 3.21Å; R651-S654 PolarHBondContact O-OG 3Å; R651-A655 PolarHBondContact O-N 3.11Å
652	I	40.8	Very low	38.4	Very low	97 Å²	97	119.5 Å²	119.5	50%	0.497	58%	0.579	S	S	.	*	H	α-helix	trans	-67.6	-41.6	174.7	-66.2	165.3	0	0	0	111.3	L648 F649 S654 A655 N656	L648-I652 HydrophobicContact CG-CD1 4.49Å; L648-I652 WeakPolarHBondContact O-CG1 3.24Å; L648-I652 PolarHBondContact O-N 3.05Å; F649-I652 PolarHBondContact O-N 3.39Å; F649-I652 VanDerWaalsContact O-N 3.09Å; I652-S654 VanDerWaalsContact C-N 3.33Å; I652-S654 PolarHBondContact O-N 3.45Å; I652-A655 PolarHBondContact O-N 3.19Å; I652-N656 PolarHBondContact O-N 3.03Å
653	V	38.3	Very low	38.9	Very low	51 Å²	51	115 Å²	115	31%	0.309	56%	0.562	S	S	.	*	H	α-helix	trans	-61.3	-41.9	174.6	172.1	0	0	0	0	110.9	F649 N650 A655 N656 L657	F649-V653 HydrophobicContact CD1-CG2 4.01Å; F649-V653 HydrophobicContact CE1-CG2 3.76Å; F649-V653 HydrophobicContact CZ-CG2 4.08Å; F649-V653 WeakPolarHBondContact O-CG2 3.43Å; F649-V653 PolarHBondContact O-N 3.09Å; N650-V653 PolarHBondContact O-N 3.26Å; V653-A655 VanDerWaalsContact C-N 3.26Å; V653-A655 PolarHBondContact O-N 3.18Å; V653-N656 PolarHBondContact O-N 3.36Å; V653-L657 HydrophobicContact CG1-CD1 4.23Å; V653-L657 HydrophobicContact CG1-CD2 4.4Å; V653-L657 PolarHBondContact O-N 3.45Å
654	S	39.1	Very low	38.8	Very low	82 Å²	82	115 Å²	115	57%	0.573	56%	0.562	S	S	*	*	H	α-helix	trans	-66.3	-22.5	177.1	75.5	0	0	0	0	114.4	N650 R651 I652	N650-S654 WeakPolarHBondContact O-CB 3.42Å; N650-S654 PolarHBondContact O-N 2.93Å; N650-S654 PolarHBondContact O-OG 3.17Å; R651-S654 PolarHBondContact O-N 3.21Å; R651-S654 PolarHBondContact O-OG 3Å; I652-S654 VanDerWaalsContact C-N 3.33Å; I652-S654 PolarHBondContact O-N 3.45Å
655	A	38.8	Very low	38.9	Very low	80 Å²	80	113.7 Å²	113.7	66%	0.661	56%	0.56	S	S	*	*	H	α-helix	trans	-78.5	-31.8	174.5	0	0	0	0	0	112.7	R651 I652 V653	R651-A655 PolarHBondContact O-N 3.11Å; I652-A655 PolarHBondContact O-N 3.19Å; V653-A655 VanDerWaalsContact C-N 3.26Å; V653-A655 PolarHBondContact O-N 3.18Å
656	N	36.3	Very low	39.4	Very low	129 Å²	129	112.7 Å²	112.7	69%	0.69	56%	0.555	S	S	*	*	H	α-helix	trans	-94.8	-29.3	-177.7	-75.7	-41.8	0	0	0	113.7	I652 V653	I652-N656 PolarHBondContact O-N 3.03Å; V653-N656 PolarHBondContact O-N 3.36Å
657	L	37.7	Very low	39.5	Very low	95 Å²	95	110.6 Å²	110.6	50%	0.497	55%	0.55	S	S	.	.			trans	-93.8	108	173	-83.1	68.2	0	0	0	110.1	V653 L659	V653-L657 HydrophobicContact CG1-CD1 4.23Å; V653-L657 HydrophobicContact CG1-CD2 4.4Å; V653-L657 PolarHBondContact O-N 3.45Å; L657-L659 HydrophobicContact CB-CD1 4.4Å; L657-L659 HydrophobicContact CD2-CD1 4.05Å; L657-L659 PolarHBondContact O-N 3.36Å
658	R	37.1	Very low	39.5	Very low	251 Å²	251	108.5 Å²	108.5	95%	0.947	55%	0.546	S	S	*	.			trans	-70.3	39.1	173.2	-67.1	-176.4	173.6	-175.4	-2.1	113.8	N660	R658-N660 PolarHBondContact O-N 2.76Å; R658-N660 VanDerWaalsContact O-N 3.13Å
659	L	39.9	Very low	39.5	Very low	87 Å²	87	110.3 Å²	110.3	46%	0.455	55%	0.55	S	S	.	.			trans	-81.4	90.3	174.7	-94.7	144.3	0	0	0	109.5	L657 V663	L657-L659 HydrophobicContact CB-CD1 4.4Å; L657-L659 HydrophobicContact CD2-CD1 4.05Å; L657-L659 PolarHBondContact O-N 3.36Å; L659-V663 HydrophobicContact CD2-CB 4.46Å; L659-V663 HydrophobicContact CD2-CG1 4.02Å
660	N	41.5	Very low	40	Very low	84 Å²	84	107.7 Å²	107.7	45%	0.449	54%	0.54	S	S	.	.			trans	-46.5	129.4	174.3	-170.9	-45.8	0	0	0	110.2	R658 K662 V663	R658-N660 PolarHBondContact O-N 2.76Å; R658-N660 VanDerWaalsContact O-N 3.13Å; N660-K662 PolarHBondContact O-N 3.36Å; N660-K662 VanDerWaalsContact OD1-CB 3.32Å; N660-K662 WeakPolarHBondContact OD1-CB 3.34Å; N660-K662 WeakPolarHBondContact OD1-CG 3.36Å; N660-K662 PolarHBondContact OD1-N 2.9Å; N660-K662 VanDerWaalsContact OD1-N 3.14Å; N660-V663 HydrophobicContact CB-CG2 4.23Å; N660-V663 WeakPolarHBondContact O-CB 3.36Å; N660-V663 PolarHBondContact O-N 3.5Å
661	P	37.1	Very low	39.9	Very low	100 Å²	100	110 Å²	110	65%	0.649	55%	0.549	S	S	*	.	H	α-helix	trans	-60.2	-21.5	-175.7	22.1	-33.2	0	0	0	113.1	V663 L664 L665	P661-V663 VanDerWaalsContact C-N 3.27Å; P661-V663 PolarHBondContact O-N 2.87Å; P661-L664 PolarHBondContact O-N 3.18Å; P661-L665 WeakPolarHBondContact O-CB 3.46Å; P661-L665 PolarHBondContact O-N 2.67Å
662	K	40.2	Very low	40.1	Very low	122 Å²	122	106.5 Å²	106.5	53%	0.53	54%	0.541	S	S	.	.	H	α-helix	trans	-64.6	-27	170.9	-62.4	177.4	178.1	179.7	0	113.5	N660 K666	N660-K662 PolarHBondContact O-N 3.36Å; N660-K662 VanDerWaalsContact OD1-CB 3.32Å; N660-K662 WeakPolarHBondContact OD1-CB 3.34Å; N660-K662 WeakPolarHBondContact OD1-CG 3.36Å; N660-K662 PolarHBondContact OD1-N 2.9Å; N660-K662 VanDerWaalsContact OD1-N 3.14Å; K662-K666 WeakPolarHBondContact O-CB 3.42Å; K662-K666 PolarHBondContact O-N 2.89Å; K662-K666 VanDerWaalsContact O-N 3.08Å
663	V	45.6	Very low	40.3	Very low	65 Å²	65	106.6 Å²	106.6	39%	0.394	54%	0.541	S	S	.	.	H	α-helix	trans	-77.6	-47.7	176.4	177	0	0	0	0	110.1	L659 N660 P661 K666 Q667	L659-V663 HydrophobicContact CD2-CB 4.46Å; L659-V663 HydrophobicContact CD2-CG1 4.02Å; N660-V663 HydrophobicContact CB-CG2 4.23Å; N660-V663 WeakPolarHBondContact O-CB 3.36Å; N660-V663 PolarHBondContact O-N 3.5Å; P661-V663 VanDerWaalsContact C-N 3.27Å; P661-V663 PolarHBondContact O-N 2.87Å; V663-K666 CarbonylContact O-C 3.59Å; V663-K666 PolarHBondContact O-N 3.46Å; V663-Q667 HydrophobicContact CG1-CG 4.46Å; V663-Q667 WeakPolarHBondContact O-CB 3.43Å; V663-Q667 WeakPolarHBondContact O-CG 3.27Å; V663-Q667 PolarHBondContact O-N 3.29Å
664	L	36.6	Very low	40.6	Very low	103 Å²	103	108.2 Å²	108.2	54%	0.539	55%	0.545	S	S	.	.	H	α-helix	trans	-60.6	-47	175.3	-90.7	164.3	0	0	0	111.9	P661 K666 Q667 H668	P661-L664 PolarHBondContact O-N 3.18Å; L664-K666 VanDerWaalsContact C-N 3.32Å; L664-K666 PolarHBondContact O-N 3.18Å; L664-Q667 PolarHBondContact O-N 3.2Å; L664-H668 PolarHBondContact O-N 2.75Å
665	L	38	Very low	40.9	Very low	115 Å²	115	108.7 Å²	108.7	60%	0.602	55%	0.554	S	S	*	*	H	α-helix	trans	-63.6	-37.9	176.1	-168.1	71.6	0	0	0	111.8	P661 F669	P661-L665 WeakPolarHBondContact O-CB 3.46Å; P661-L665 PolarHBondContact O-N 2.67Å; L665-F669 WeakPolarHBondContact O-CB 3.5Å; L665-F669 PolarHBondContact O-N 2.92Å
666	K	48.8	Very low	41.2	Very low	117 Å²	117	113.1 Å²	113.1	51%	0.509	56%	0.561	S	S	.	*	H	α-helix	trans	-65.5	-41.4	173.7	-173.6	-174.4	179	-165.1	0	111.4	K662 V663 L664 Q670	K662-K666 WeakPolarHBondContact O-CB 3.42Å; K662-K666 PolarHBondContact O-N 2.89Å; K662-K666 VanDerWaalsContact O-N 3.08Å; V663-K666 CarbonylContact O-C 3.59Å; V663-K666 PolarHBondContact O-N 3.46Å; L664-K666 VanDerWaalsContact C-N 3.32Å; L664-K666 PolarHBondContact O-N 3.18Å; K666-Q670 WeakPolarHBondContact O-CA 3.39Å; K666-Q670 WeakPolarHBondContact O-CB 3.34Å; K666-Q670 PolarHBondContact O-N 3.41Å
667	Q	41.4	Very low	41.8	Very low	99 Å²	99	109.9 Å²	109.9	46%	0.463	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-41	177.5	-76.3	173.4	-55.2	0	0	111.7	V663 L664 Q670 M671	V663-Q667 HydrophobicContact CG1-CG 4.46Å; V663-Q667 WeakPolarHBondContact O-CB 3.43Å; V663-Q667 WeakPolarHBondContact O-CG 3.27Å; V663-Q667 PolarHBondContact O-N 3.29Å; L664-Q667 PolarHBondContact O-N 3.2Å; Q667-Q670 PolarHBondContact O-N 3.26Å; Q667-M671 WeakPolarHBondContact O-CG 3.5Å; Q667-M671 PolarHBondContact O-N 2.93Å
668	H	37.1	Very low	42.1	Very low	122 Å²	122	107.8 Å²	107.8	57%	0.565	53%	0.533	S	S	*	.	H	α-helix	trans	-64	-52.8	176.4	-140.5	66	0	0	0	111.3	L664 Q670 M671 E672	L664-H668 PolarHBondContact O-N 2.75Å; H668-Q670 PolarHBondContact O-N 3Å; H668-M671 PolarHBondContact O-N 3.15Å; H668-E672 PolarHBondContact O-N 3.09Å
669	F	40.5	Very low	43.1	Very low	124 Å²	124	100.4 Å²	100.4	54%	0.544	52%	0.517	S	S	.	.	H	α-helix	trans	-57.7	-32.9	173.4	-109.4	-81.9	0	0	0	113	L665 M673	L665-F669 WeakPolarHBondContact O-CB 3.5Å; L665-F669 PolarHBondContact O-N 2.92Å; F669-M673 WeakPolarHBondContact O-CB 3.45Å; F669-M673 VanDerWaalsContact O-CG 3.25Å; F669-M673 WeakPolarHBondContact O-CG 3.34Å; F669-M673 PolarHBondContact O-N 3.27Å
670	Q	48.8	Very low	44.2	Very low	81 Å²	81	100.1 Å²	100.1	38%	0.379	52%	0.519	S	S	.	.	H	α-helix	trans	-78.4	-35.3	-177.4	-175	157.5	-15	0	0	111.8	K666 Q667 H668 M673 E674	K666-Q670 WeakPolarHBondContact O-CA 3.39Å; K666-Q670 WeakPolarHBondContact O-CB 3.34Å; K666-Q670 PolarHBondContact O-N 3.41Å; Q667-Q670 PolarHBondContact O-N 3.26Å; H668-Q670 PolarHBondContact O-N 3Å; Q670-M673 CarbonylContact O-C 3.4Å; Q670-M673 PolarHBondContact O-N 3.03Å; Q670-E674 HydrophobicContact CG-CG 4.43Å; Q670-E674 WeakPolarHBondContact CG-OE1 3.24Å; Q670-E674 PolarHBondContact NE2-OE1 3.31Å; Q670-E674 VanDerWaalsContact O-CB 3.27Å; Q670-E674 WeakPolarHBondContact O-CB 3.43Å; Q670-E674 WeakPolarHBondContact O-CG 3.19Å; Q670-E674 PolarHBondContact O-N 3.21Å
671	M	36.9	Very low	44.9	Very low	116 Å²	116	100.6 Å²	100.6	57%	0.571	52%	0.519	S	S	*	.	H	α-helix	trans	-63.9	-45.6	168.8	-71.8	-176.5	-66.2	0	0	111.6	Q667 H668 M673 E674 A675	Q667-M671 WeakPolarHBondContact O-CG 3.5Å; Q667-M671 PolarHBondContact O-N 2.93Å; H668-M671 PolarHBondContact O-N 3.15Å; M671-M673 VanDerWaalsContact C-N 3.31Å; M671-M673 PolarHBondContact O-N 3.28Å; M671-E674 PolarHBondContact O-N 3.37Å; M671-E674 VanDerWaalsContact O-N 3.12Å; M671-A675 PolarHBondContact O-N 3.07Å
672	E	40.7	Very low	45.8	Very low	116 Å²	116	99 Å²	99	54%	0.542	51%	0.505	S	S	.	.	H	α-helix	trans	-59.2	-41.6	173	-68.8	-180	135.6	0	0	111.7	H668 E674	H668-E672 PolarHBondContact O-N 3.09Å; E672-E674 VanDerWaalsContact C-N 3.28Å; E672-E674 PolarHBondContact O-N 2.72Å
673	M	45.2	Very low	46.7	Very low	99 Å²	99	98.6 Å²	98.6	49%	0.488	50%	0.504	S	S	.	.	H	α-helix	trans	-78.8	-0.3	176.5	-75.6	-155.7	74.8	0	0	115.5	F669 Q670 M671 R677	F669-M673 WeakPolarHBondContact O-CB 3.45Å; F669-M673 VanDerWaalsContact O-CG 3.25Å; F669-M673 WeakPolarHBondContact O-CG 3.34Å; F669-M673 PolarHBondContact O-N 3.27Å; Q670-M673 CarbonylContact O-C 3.4Å; Q670-M673 PolarHBondContact O-N 3.03Å; M671-M673 VanDerWaalsContact C-N 3.31Å; M671-M673 PolarHBondContact O-N 3.28Å; M673-R677 PolarHBondContact O-NE 3.17Å; M673-R677 PolarHBondContact O-NH2 3.07Å
674	E	46.4	Very low	47.3	Very low	85 Å²	85	101.5 Å²	101.5	40%	0.397	51%	0.513	S	S	.	.	H	α-helix	trans	-105.7	-31.3	174.4	-78.5	164.3	-171.8	0	0	110.9	Q670 M671 E672 E676 R677	Q670-E674 HydrophobicContact CG-CG 4.43Å; Q670-E674 WeakPolarHBondContact CG-OE1 3.24Å; Q670-E674 PolarHBondContact NE2-OE1 3.31Å; Q670-E674 VanDerWaalsContact O-CB 3.27Å; Q670-E674 WeakPolarHBondContact O-CB 3.43Å; Q670-E674 WeakPolarHBondContact O-CG 3.19Å; Q670-E674 PolarHBondContact O-N 3.21Å; M671-E674 PolarHBondContact O-N 3.37Å; M671-E674 VanDerWaalsContact O-N 3.12Å; E672-E674 VanDerWaalsContact C-N 3.28Å; E672-E674 PolarHBondContact O-N 2.72Å; E674-E676 VanDerWaalsContact C-N 3.25Å; E674-E676 PolarHBondContact O-N 3.4Å; E674-R677 PolarHBondContact O-N 3.5Å
675	A	45.3	Very low	48.4	Very low	92 Å²	92	99.1 Å²	99.1	76%	0.76	50%	0.5	S	S	*	.	H	α-helix	trans	-58.9	-28.3	171.7	0	0	0	0	0	114.5	M671	M671-A675 PolarHBondContact O-N 3.07Å
676	E	44.9	Very low	49.4	Very low	173 Å²	173	99.2 Å²	99.2	81%	0.808	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.3	2.3	177.9	-68	-166.3	144.3	0	0	115.1	E674	E674-E676 VanDerWaalsContact C-N 3.25Å; E674-E676 PolarHBondContact O-N 3.4Å
677	R	47.6	Very low	50.1	Low	61 Å²	61	99.6 Å²	99.6	23%	0.23	50%	0.501	C	S	.	.			trans	-99	119.8	-172.6	-60.8	-167.6	-156.8	-179.8	20.8	113.4	M673 E674 L682	M673-R677 PolarHBondContact O-NE 3.17Å; M673-R677 PolarHBondContact O-NH2 3.07Å; E674-R677 PolarHBondContact O-N 3.5Å; R677-L682 HydrophobicContact CB-CD2 4.41Å; R677-L682 HydrophobicContact CB-CG 4.29Å
678	S	45.1	Very low	51	Low	52 Å²	52	96.6 Å²	96.6	36%	0.364	49%	0.491	S	S	.	.			trans	-61.5	142.5	168.2	61.9	0	0	0	0	111.3	T680 Q681	S678-T680 PolarHBondContact O-N 3.04Å; S678-T680 VanDerWaalsContact O-N 3.15Å; S678-Q681 WeakPolarHBondContact O-CB 3.02Å; S678-Q681 PolarHBondContact O-N 3.02Å; S678-Q681 PolarHBondContact OG-NE2 3.03Å; S678-Q681 VanDerWaalsContact OG-NE2 3.1Å
679	P	58.5	Low	52.3	Low	95 Å²	95	93.7 Å²	93.7	62%	0.617	48%	0.477	S	S	*	.	H	α-helix	trans	-59.3	-33.1	-171.3	20.6	-32.9	0	0	0	113.5	Q681 L682 Q683	P679-Q681 PolarHBondContact O-N 3.31Å; P679-L682 WeakPolarHBondContact O-CB 2.99Å; P679-L682 PolarHBondContact O-N 3.07Å; P679-Q683 PolarHBondContact O-N 3.09Å; P679-Q683 VanDerWaalsContact O-N 3.07Å
680	T	62	Low	53.6	Low	82 Å²	82	92.5 Å²	92.5	50%	0.503	48%	0.475	S	S	.	.	H	α-helix	trans	-59.6	-30.7	175.3	-11	0	0	0	0	113.1	S678 Q684	S678-T680 PolarHBondContact O-N 3.04Å; S678-T680 VanDerWaalsContact O-N 3.15Å; T680-Q684 WeakPolarHBondContact O-CB 3.48Å; T680-Q684 WeakPolarHBondContact O-CG 3.23Å; T680-Q684 PolarHBondContact O-N 2.92Å
681	Q	55.8	Low	54.5	Low	94 Å²	94	95.7 Å²	95.7	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-76.4	-28.4	175.5	-68.5	-178.8	55.2	0	0	112.2	S678 P679 Q685	S678-Q681 WeakPolarHBondContact O-CB 3.02Å; S678-Q681 PolarHBondContact O-N 3.02Å; S678-Q681 PolarHBondContact OG-NE2 3.03Å; S678-Q681 VanDerWaalsContact OG-NE2 3.1Å; P679-Q681 PolarHBondContact O-N 3.31Å; Q681-Q685 WeakPolarHBondContact O-CB 2.99Å; Q681-Q685 PolarHBondContact O-N 3.44Å; Q681-Q685 VanDerWaalsContact O-N 3.12Å
682	L	55.5	Low	55.9	Low	67 Å²	67	92.5 Å²	92.5	35%	0.351	47%	0.474	S	S	.	.	H	α-helix	trans	-73.1	-44.5	175.8	-68	169.5	0	0	0	110.8	R677 P679 Q685 Q686	R677-L682 HydrophobicContact CB-CD2 4.41Å; R677-L682 HydrophobicContact CB-CG 4.29Å; P679-L682 WeakPolarHBondContact O-CB 2.99Å; P679-L682 PolarHBondContact O-N 3.07Å; L682-Q685 PolarHBondContact O-N 3.45Å; L682-Q686 WeakPolarHBondContact O-CG 3.28Å; L682-Q686 PolarHBondContact O-N 3.36Å
683	Q	59.4	Low	57.5	Low	113 Å²	113	87.9 Å²	87.9	53%	0.528	45%	0.453	S	S	.	.	H	α-helix	trans	-59.3	-51.2	174	-72.2	177.9	-62.6	0	0	111.7	P679 Q685 Q686 E687	P679-Q683 PolarHBondContact O-N 3.09Å; P679-Q683 VanDerWaalsContact O-N 3.07Å; Q683-Q685 PolarHBondContact O-N 3.2Å; Q683-Q686 PolarHBondContact O-N 3.44Å; Q683-Q686 VanDerWaalsContact O-N 3.1Å; Q683-E687 WeakPolarHBondContact O-CG 3.37Å; Q683-E687 PolarHBondContact O-N 3.09Å
684	Q	59.5	Low	59.1	Low	125 Å²	125	87 Å²	87	58%	0.584	45%	0.451	S	S	*	.	H	α-helix	trans	-60.3	-32.4	177.6	-73.7	179.5	3.5	0	0	113.1	T680 S688	T680-Q684 WeakPolarHBondContact O-CB 3.48Å; T680-Q684 WeakPolarHBondContact O-CG 3.23Å; T680-Q684 PolarHBondContact O-N 2.92Å; Q684-S688 WeakPolarHBondContact O-CB 3.4Å; Q684-S688 PolarHBondContact O-N 2.86Å; Q684-S688 PolarHBondContact O-OG 3.47Å
685	Q	58.5	Low	60.9	Low	54 Å²	54	86.3 Å²	86.3	25%	0.252	45%	0.449	S	S	.	.	H	α-helix	trans	-68.6	-50.1	173.4	-165.1	-170.1	-53.2	0	0	110.3	Q681 L682 Q683 E687 S688 E689	Q681-Q685 WeakPolarHBondContact O-CB 2.99Å; Q681-Q685 PolarHBondContact O-N 3.44Å; Q681-Q685 VanDerWaalsContact O-N 3.12Å; L682-Q685 PolarHBondContact O-N 3.45Å; Q683-Q685 PolarHBondContact O-N 3.2Å; Q685-E687 PolarHBondContact O-N 3.38Å; Q685-S688 CarbonylContact O-C 3.59Å; Q685-S688 PolarHBondContact O-N 3.37Å; Q685-S688 VanDerWaalsContact O-N 3.12Å; Q685-S688 PolarHBondContact O-OG 3.46Å; Q685-E689 PolarHBondContact NE2-OE1 3.25Å; Q685-E689 WeakPolarHBondContact O-CG 3.37Å; Q685-E689 PolarHBondContact O-N 3.42Å
686	Q	59.2	Low	62.7	Low	117 Å²	117	85.5 Å²	85.5	55%	0.547	44%	0.435	S	S	.	.	H	α-helix	trans	-59.1	-45.4	179.1	-73.2	172.6	-15.9	0	0	112.8	L682 Q683 S688 E689 I690	L682-Q686 WeakPolarHBondContact O-CG 3.28Å; L682-Q686 PolarHBondContact O-N 3.36Å; Q683-Q686 PolarHBondContact O-N 3.44Å; Q683-Q686 VanDerWaalsContact O-N 3.1Å; Q686-S688 VanDerWaalsContact C-N 3.32Å; Q686-S688 PolarHBondContact O-N 3.49Å; Q686-E689 PolarHBondContact O-N 3.48Å; Q686-I690 WeakPolarHBondContact O-CB 3.37Å; Q686-I690 VanDerWaalsContact O-CG1 3.26Å; Q686-I690 WeakPolarHBondContact O-CG1 3.21Å; Q686-I690 PolarHBondContact O-N 2.9Å
687	E	63.5	Low	64.6	Low	125 Å²	125	77.5 Å²	77.5	58%	0.584	40%	0.398	S	S	*	.	H	α-helix	trans	-58.2	-44.3	173.5	-71.2	172.9	160.9	0	0	111.2	Q683 Q685 I690 Q691	Q683-E687 WeakPolarHBondContact O-CG 3.37Å; Q683-E687 PolarHBondContact O-N 3.09Å; Q685-E687 PolarHBondContact O-N 3.38Å; E687-I690 PolarHBondContact O-N 3Å; E687-Q691 WeakPolarHBondContact O-CB 3.07Å; E687-Q691 PolarHBondContact O-N 3.35Å
688	S	61.6	Low	66.2	Low	36 Å²	36	79.1 Å²	79.1	25%	0.252	41%	0.411	S	S	.	.	H	α-helix	trans	-69.5	-31.6	178.1	80.9	0	0	0	0	113.3	Q684 Q685 Q686 Q692	Q684-S688 WeakPolarHBondContact O-CB 3.4Å; Q684-S688 PolarHBondContact O-N 2.86Å; Q684-S688 PolarHBondContact O-OG 3.47Å; Q685-S688 CarbonylContact O-C 3.59Å; Q685-S688 PolarHBondContact O-N 3.37Å; Q685-S688 VanDerWaalsContact O-N 3.12Å; Q685-S688 PolarHBondContact O-OG 3.46Å; Q686-S688 VanDerWaalsContact C-N 3.32Å; Q686-S688 PolarHBondContact O-N 3.49Å; S688-Q692 WeakPolarHBondContact O-CB 3.34Å; S688-Q692 VanDerWaalsContact O-CG 3.26Å; S688-Q692 WeakPolarHBondContact O-CG 3.3Å; S688-Q692 PolarHBondContact O-N 3.05Å; S688-Q692 VanDerWaalsContact O-N 3.11Å; S688-Q692 PolarHBondContact O-NE2 3.48Å
689	E	64	Low	68	Low	60 Å²	60	77.1 Å²	77.1	28%	0.28	40%	0.396	S	S	.	.	H	α-helix	trans	-68.2	-44.7	172	-75.3	179	-151.6	0	0	111	Q685 Q686 Q692 L693	Q685-E689 PolarHBondContact NE2-OE1 3.25Å; Q685-E689 WeakPolarHBondContact O-CG 3.37Å; Q685-E689 PolarHBondContact O-N 3.42Å; Q686-E689 PolarHBondContact O-N 3.48Å; E689-Q692 PolarHBondContact O-N 2.93Å; E689-L693 WeakPolarHBondContact O-CG 3.36Å; E689-L693 PolarHBondContact O-N 2.96Å
690	I	66.4	Low	68.9	Low	99 Å²	99	82 Å²	82	51%	0.508	41%	0.407	S	S	.	.	H	α-helix	trans	-60.9	-47.3	175.7	-69.4	163.2	0	0	0	110.5	Q686 E687 Q692 L693 N694	Q686-I690 WeakPolarHBondContact O-CB 3.37Å; Q686-I690 VanDerWaalsContact O-CG1 3.26Å; Q686-I690 WeakPolarHBondContact O-CG1 3.21Å; Q686-I690 PolarHBondContact O-N 2.9Å; E687-I690 PolarHBondContact O-N 3Å; I690-Q692 VanDerWaalsContact C-N 3.27Å; I690-Q692 PolarHBondContact O-N 2.92Å; I690-L693 WeakPolarHBondContact O-CB 3.35Å; I690-L693 PolarHBondContact O-N 3.32Å; I690-N694 PolarHBondContact O-N 3.45Å
691	Q	68.2	Low	69.5	Low	148 Å²	148	82.1 Å²	82.1	69%	0.692	41%	0.411	S	S	*	.	H	α-helix	trans	-64.7	-31.6	179.8	-162.4	174.9	32.1	0	0	112.3	E687	E687-Q691 WeakPolarHBondContact O-CB 3.07Å; E687-Q691 PolarHBondContact O-N 3.35Å
692	Q	65.9	Low	70.6	Confident	50 Å²	50	78.5 Å²	78.5	23%	0.234	40%	0.395	C	S	.	.	H	α-helix	trans	-80.8	-9.5	174.2	-71.8	171	107.6	0	0	113.9	V569 S688 E689 I690	V569-Q692 HydrophobicContact CG2-CB 4.13Å; V569-Q692 HydrophobicContact CG2-CG 4.49Å; S688-Q692 WeakPolarHBondContact O-CB 3.34Å; S688-Q692 VanDerWaalsContact O-CG 3.26Å; S688-Q692 WeakPolarHBondContact O-CG 3.3Å; S688-Q692 PolarHBondContact O-N 3.05Å; S688-Q692 VanDerWaalsContact O-N 3.11Å; S688-Q692 PolarHBondContact O-NE2 3.48Å; E689-Q692 PolarHBondContact O-N 2.93Å; I690-Q692 VanDerWaalsContact C-N 3.27Å; I690-Q692 PolarHBondContact O-N 2.92Å
693	L	74.3	Confident	71.8	Confident	18 Å²	18	78.5 Å²	78.5	9%	0.094	40%	0.404	C	S	.	.	H	α-helix	trans	-87.6	-12.1	171	-75.5	165.9	0	0	0	113.1	Y522 K523 L562 E689 I690 D695	Y522-L693 CarbonylContact C-O 3.46Å; Y522-L693 WeakPolarHBondContact CB-O 3.21Å; Y522-L693 PolarHBondContact N-O 2.88Å; K523-L693 HydrophobicContact CB-CB 4.26Å; K523-L693 PolarHBondContact N-O 3.23Å; L562-L693 HydrophobicContact CD1-CD2 3.78Å; E689-L693 WeakPolarHBondContact O-CG 3.36Å; E689-L693 PolarHBondContact O-N 2.96Å; I690-L693 WeakPolarHBondContact O-CB 3.35Å; I690-L693 PolarHBondContact O-N 3.32Å; L693-D695 PolarHBondContact O-N 3.49Å
694	N	80.1	Confident	72.9	Confident	82 Å²	82	75.6 Å²	75.6	44%	0.439	39%	0.392	S	S	.	.	S	Bend	trans	-79.2	-5.5	173.7	-62.8	-19.9	0	0	0	113	T521 I690	T521-N694 WeakPolarHBondContact CG2-O 3.5Å; I690-N694 PolarHBondContact O-N 3.45Å
695	D	82.7	Confident	74.2	Confident	69 Å²	69	72.9 Å²	72.9	37%	0.369	38%	0.382	S	S	.	.	P	Polyproline II helix	trans	-53.3	142.1	167.4	-88.5	12.5	0	0	0	110.4	T521 Y522 K565 L693	T521-D695 WeakPolarHBondContact CA-O 3.37Å; Y522-D695 HydrophobicContact CD2-CB 3.73Å; Y522-D695 WeakPolarHBondContact CD2-O 3.35Å; Y522-D695 HydrophobicContact CE2-CB 4.01Å; Y522-D695 PolarHBondContact N-O 2.89Å; K565-D695 IonicContact NZ-OD2 3.7Å; K565-D695 PolarHBondContact NZ-OD2 2.86Å; L693-D695 PolarHBondContact O-N 3.49Å
696	V	85.1	Confident	75.4	Confident	75 Å²	75	75 Å²	75	46%	0.455	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-86.8	136.1	164	-177.5	0	0	0	0	108.6	L518 T521 Y699	L518-V696 WeakPolarHBondContact O-CG1 3.21Å; T521-V696 HydrophobicContact CG2-CG2 4.38Å; V696-Y699 HydrophobicContact CG1-CE2 4.48Å
697	P	83.2	Confident	76.5	Confident	6 Å²	6	73.1 Å²	73.1	4%	0.039	41%	0.407	C	S	.	.	P	Polyproline II helix	trans	-69.3	142	171	29	-34.6	0	0	0	111.4	S520 Y522 I525 Y699	S520-P697 WeakPolarHBondContact O-CD 3.4Å; Y522-P697 HydrophobicContact CE1-CB 4.07Å; Y522-P697 HydrophobicContact CE2-CB 3.9Å; Y522-P697 WeakPolarHBondContact OH-CA 3.32Å; Y522-P697 WeakPolarHBondContact OH-CB 3.27Å; I525-P697 HydrophobicContact CD1-CG 3.86Å; P697-Y699 HydrophobicContact CG-CD2 4.13Å; P697-Y699 HydrophobicContact CG-CE1 4.04Å; P697-Y699 HydrophobicContact CG-CE2 3.55Å; P697-Y699 VanDerWaalsContact CG-CZ 3.48Å; P697-Y699 WeakPolarHBondContact O-CD2 3.35Å; P697-Y699 PolarHBondContact O-N 2.71Å
698	D	82.7	Confident	77.7	Confident	94 Å²	94	67.4 Å²	67.4	50%	0.503	38%	0.381	S	S	.	.			trans	-73.9	94.8	164.7	174.9	19.7	0	0	0	109.6	K700 S701	D698-K700 PolarHBondContact O-N 3.45Å; D698-K700 WeakPolarHBondContact OD1-CB 3.27Å; D698-K700 PolarHBondContact OD1-N 2.97Å; D698-S701 PolarHBondContact O-N 2.93Å; D698-S701 VanDerWaalsContact O-N 3.13Å; D698-S701 PolarHBondContact O-OG 3.08Å
699	Y	81.2	Confident	79	Confident	11 Å²	11	69.3 Å²	69.3	4%	0.043	39%	0.385	C	S	.	.	G	3₁₀ helix	trans	-57.4	-27.9	178.9	-72.8	-79.5	0	0	0	113.3	T517 L518 S520 L540 I553 V696 P697 S701 I702 L704	T517-Y699 WeakPolarHBondContact O-CE2 3.4Å; T517-Y699 PolarHBondContact O-OH 2.9Å; L518-Y699 HydrophobicContact CD2-CD2 4Å; L518-Y699 HydrophobicContact CD2-CG 4.18Å; L518-Y699 WeakPolarHBondContact O-CE2 3.26Å; S520-Y699 PolarHBondContact O-OH 3.09Å; L540-Y699 HydrophobicContact CD1-CD1 3.95Å; L540-Y699 HydrophobicContact CD1-CE1 3.73Å; L540-Y699 HydrophobicContact CD1-CE2 4.48Å; L540-Y699 HydrophobicContact CD1-CG 4.46Å; L540-Y699 HydrophobicContact CD2-CD1 3.88Å; L540-Y699 HydrophobicContact CD2-CE1 4.48Å; L540-Y699 HydrophobicContact CD2-CG 4.19Å; I553-Y699 HydrophobicContact CD1-CD1 3.7Å; I553-Y699 HydrophobicContact CD1-CE1 3.63Å; V696-Y699 HydrophobicContact CG1-CE2 4.48Å; P697-Y699 HydrophobicContact CG-CD2 4.13Å; P697-Y699 HydrophobicContact CG-CE1 4.04Å; P697-Y699 HydrophobicContact CG-CE2 3.55Å; P697-Y699 VanDerWaalsContact CG-CZ 3.48Å; P697-Y699 WeakPolarHBondContact O-CD2 3.35Å; P697-Y699 PolarHBondContact O-N 2.71Å; Y699-S701 PolarHBondContact O-N 2.85Å; Y699-I702 HydrophobicContact CD1-CD1 3.65Å; Y699-I702 HydrophobicContact CE1-CD1 4.28Å; Y699-I702 HydrophobicContact CG-CD1 4.3Å; Y699-I702 WeakPolarHBondContact O-CB 3.46Å; Y699-I702 PolarHBondContact O-N 3.48Å; Y699-L704 VanDerWaalsContact O-CD1 3.22Å; Y699-L704 WeakPolarHBondContact O-CD1 3.35Å
700	K	77.2	Confident	80.4	Confident	196 Å²	196	70.3 Å²	70.3	85%	0.852	39%	0.389	S	S	*	.	G	3₁₀ helix	trans	-68.6	-20.8	179.8	-60.2	-179.9	174	179.8	0	113.2	D698 I702	D698-K700 PolarHBondContact O-N 3.45Å; D698-K700 WeakPolarHBondContact OD1-CB 3.27Å; D698-K700 PolarHBondContact OD1-N 2.97Å; K700-I702 VanDerWaalsContact C-N 3.32Å
701	S	75.1	Confident	81.7	Confident	85 Å²	85	66 Å²	66	59%	0.594	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-84.3	-3.7	177	73.2	0	0	0	0	114.2	D698 Y699	D698-S701 PolarHBondContact O-N 2.93Å; D698-S701 VanDerWaalsContact O-N 3.13Å; D698-S701 PolarHBondContact O-OG 3.08Å; Y699-S701 PolarHBondContact O-N 2.85Å
702	I	80.3	Confident	82.9	Confident	18 Å²	18	63.1 Å²	63.1	9%	0.092	36%	0.36	C	S	.	.	S	Bend	trans	-94.6	146	-175.1	-49.7	174.9	0	0	0	109.9	I553 E557 L561 Y699 K700 L704	I553-I702 HydrophobicContact CD1-CD1 4.44Å; I553-I702 HydrophobicContact CG2-CG2 4.08Å; E557-I702 HydrophobicContact CB-CG2 4.28Å; E557-I702 HydrophobicContact CG-CG2 4.34Å; L561-I702 HydrophobicContact CD1-CB 4.47Å; L561-I702 HydrophobicContact CD1-CD1 3.45Å; L561-I702 VanDerWaalsContact CD1-CD1 3.45Å; L561-I702 HydrophobicContact CD1-CG1 3.7Å; L561-I702 HydrophobicContact CD1-CG2 3.93Å; L561-I702 HydrophobicContact CD2-CG1 4.08Å; Y699-I702 HydrophobicContact CD1-CD1 3.65Å; Y699-I702 HydrophobicContact CE1-CD1 4.28Å; Y699-I702 HydrophobicContact CG-CD1 4.3Å; Y699-I702 WeakPolarHBondContact O-CB 3.46Å; Y699-I702 PolarHBondContact O-N 3.48Å; K700-I702 VanDerWaalsContact C-N 3.32Å; I702-L704 VanDerWaalsContact C-N 3.32Å; I702-L704 PolarHBondContact O-N 3.04Å
703	A	79	Confident	84.2	Confident	67 Å²	67	63.2 Å²	63.2	55%	0.554	36%	0.36	S	S	*	.			trans	-68.5	93.4	161.3	0	0	0	0	0	109.1
704	L	83.9	Confident	85.1	Confident	52 Å²	52	65.7 Å²	65.7	27%	0.272	38%	0.378	S	S	.	.			trans	-89.6	138.3	170.8	-81	146.2	0	0	0	109.3	L540 I553 Y699 I702 S706	L540-L704 HydrophobicContact CB-CD2 4.4Å; L540-L704 HydrophobicContact CD2-CD1 4.49Å; L540-L704 HydrophobicContact CD2-CD2 3.68Å; I553-L704 HydrophobicContact CD1-CD2 4.01Å; I553-L704 HydrophobicContact CG1-CD2 3.44Å; I553-L704 VanDerWaalsContact CG1-CD2 3.44Å; I553-L704 HydrophobicContact CG1-CG 4.31Å; Y699-L704 VanDerWaalsContact O-CD1 3.22Å; Y699-L704 WeakPolarHBondContact O-CD1 3.35Å; I702-L704 VanDerWaalsContact C-N 3.32Å; I702-L704 PolarHBondContact O-N 3.04Å; L704-S706 PolarHBondContact O-N 3.29Å
705	D	85.1	Confident	85.7	Confident	69 Å²	69	62.8 Å²	62.8	37%	0.369	36%	0.364	S	S	.	.	B	Isolated β-bridge	trans	-77.6	108	152.5	176.3	8.6	0	0	0	107	G551 E552 A707	G551-D705 CarbonylContact C-O 3.59Å; G551-D705 WeakPolarHBondContact CA-O 3.26Å; E552-D705 HydrophobicContact CG-CB 3.86Å; E552-D705 PolarHBondContact N-O 3.01Å; E552-D705 PolarHBondContact O-N 2.97Å; E552-D705 VanDerWaalsContact O-N 3.07Å; D705-A707 VanDerWaalsContact C-N 3.33Å; D705-A707 PolarHBondContact OD1-N 3.18Å
706	S	83.9	Confident	86.1	Confident	98 Å²	98	60.1 Å²	60.1	69%	0.685	35%	0.351	S	S	*	.	S	Bend	trans	-84.4	-5	179.5	58.7	0	0	0	0	113.7	L704 P708	L704-S706 PolarHBondContact O-N 3.29Å; S706-P708 VanDerWaalsContact C-CD 3.41Å
707	A	83.6	Confident	86.4	Confident	77 Å²	77	56.6 Å²	56.6	64%	0.636	33%	0.33	S	S	*	.	S	Bend	trans	-132	48.5	-178.1	0	0	0	0	0	112.8	D705 F709	D705-A707 VanDerWaalsContact C-N 3.33Å; D705-A707 PolarHBondContact OD1-N 3.18Å; A707-F709 PolarHBondContact O-N 3.19Å
708	P	87.5	Confident	86.6	Confident	5 Å²	5	58.9 Å²	58.9	3%	0.032	34%	0.339	C	S	.	.			trans	-63	137.2	179	30.5	-37.4	0	0	0	110.1	L549 E552 S706 Q710 Y733	L549-P708 HydrophobicContact CD2-CG 4.14Å; L549-P708 HydrophobicContact CG-CG 4.42Å; E552-P708 HydrophobicContact CB-CB 4.4Å; E552-P708 HydrophobicContact CG-CB 4.13Å; S706-P708 VanDerWaalsContact C-CD 3.41Å; P708-Q710 VanDerWaalsContact O-CG 3.27Å; P708-Q710 WeakPolarHBondContact O-CG 3.43Å; P708-Q710 PolarHBondContact O-N 3.14Å; P708-Y733 HydrophobicContact CB-CD2 3.9Å; P708-Y733 HydrophobicContact CB-CE2 3.87Å; P708-Y733 HydrophobicContact CG-CD2 4.38Å
709	F	90.2	Very high	86.9	Confident	77 Å²	77	60.8 Å²	60.8	34%	0.338	34%	0.343	S	S	.	.			trans	-61.1	129.7	-170.1	-162	-79.7	0	0	0	112.8	A707 L711 V723 L727 L729 A732 Y733	A707-F709 PolarHBondContact O-N 3.19Å; F709-L711 HydrophobicContact CE1-CD2 4.05Å; F709-L711 HydrophobicContact CE1-CG 4.36Å; F709-V723 HydrophobicContact CD1-CG1 4.18Å; F709-V723 HydrophobicContact CE1-CG1 3.36Å; F709-V723 HydrophobicContact CE2-CG1 4.29Å; F709-V723 HydrophobicContact CZ-CG1 3.42Å; F709-V723 VanDerWaalsContact CZ-CG1 3.42Å; F709-L727 HydrophobicContact CD2-CD1 3.8Å; F709-L727 HydrophobicContact CE2-CD1 3.32Å; F709-L727 HydrophobicContact CZ-CD1 4Å; F709-L729 HydrophobicContact CB-CD1 4.06Å; F709-L729 HydrophobicContact CB-CD2 4.35Å; F709-L729 HydrophobicContact CD1-CD1 3.62Å; F709-L729 HydrophobicContact CD2-CD1 4.18Å; F709-L729 HydrophobicContact CE1-CD1 4.2Å; F709-L729 HydrophobicContact CG-CD1 3.64Å; F709-L729 HydrophobicContact CG-CD2 4.48Å; F709-A732 HydrophobicContact CD1-CB 3.9Å; F709-A732 WeakPolarHBondContact O-CA 3.36Å; F709-Y733 PolarHBondContact O-N 2.95Å
710	Q	92.8	Very high	87.4	Confident	80 Å²	80	60.3 Å²	60.3	37%	0.374	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	142.9	-176.6	-51	-170.7	26.6	0	0	112.2	L549 P708 Y733 T735	L549-Q710 HydrophobicContact CD2-CG 4.2Å; P708-Q710 VanDerWaalsContact O-CG 3.27Å; P708-Q710 WeakPolarHBondContact O-CG 3.43Å; P708-Q710 PolarHBondContact O-N 3.14Å; Q710-Y733 CarbonylContact C-O 3.57Å; Q710-Y733 VanDerWaalsContact CA-O 3.28Å; Q710-Y733 WeakPolarHBondContact CA-O 3.38Å; Q710-T735 HydrophobicContact CG-CG2 4.36Å; Q710-T735 VanDerWaalsContact OE1-CG2 3.23Å; Q710-T735 PolarHBondContact OE1-OG1 3.38Å
711	L	93.7	Very high	88	Confident	10 Å²	10	51.6 Å²	51.6	5%	0.052	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	141.8	169.2	-73	175.1	0	0	0	110.2	V505 F709 A720 V723 F724 A732 Y733 V734 T735 V744	V505-L711 HydrophobicContact CG1-CB 4.47Å; V505-L711 HydrophobicContact CG2-CD1 4.14Å; F709-L711 HydrophobicContact CE1-CD2 4.05Å; F709-L711 HydrophobicContact CE1-CG 4.36Å; L711-A720 HydrophobicContact CD1-CB 4.1Å; L711-V723 HydrophobicContact CD2-CG1 4.32Å; L711-F724 HydrophobicContact CD1-CE2 3.98Å; L711-A732 HydrophobicContact CD1-CB 3.87Å; L711-A732 HydrophobicContact CG-CB 3.91Å; L711-Y733 PolarHBondContact N-O 2.92Å; L711-V734 WeakPolarHBondContact O-CA 3.32Å; L711-T735 PolarHBondContact O-N 2.97Å; L711-V744 HydrophobicContact CD1-CG2 4.29Å
712	V	93.8	Very high	88.6	Confident	87 Å²	87	48.9 Å²	48.9	53%	0.527	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	137.5	170	-177.1	0	0	0	0	108.9	C714 S715	V712-C714 PolarHBondContact O-N 3.26Å; V712-C714 VanDerWaalsContact O-N 3.15Å; V712-S715 VanDerWaalsContact O-CB 3.27Å; V712-S715 WeakPolarHBondContact O-CB 3.4Å; V712-S715 PolarHBondContact O-N 2.9Å; V712-S715 PolarHBondContact O-OG 3.37Å
713	E	93	Very high	89	Confident	51 Å²	51	49.8 Å²	49.8	24%	0.238	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-33.4	-177.1	72.4	-161.4	145	0	0	114.2	V505 R506 S715 V734 S736 I741	V505-E713 PolarHBondContact N-O 3.25Å; R506-E713 HydrophobicContact CB-CB 4.23Å; R506-E713 PolarHBondContact N-O 3.08Å; E713-S715 VanDerWaalsContact C-N 3.34Å; E713-V734 HydrophobicContact CB-CG1 3.91Å; E713-S736 WeakPolarHBondContact OE1-CB 3.24Å; E713-S736 PolarHBondContact OE1-OG 2.98Å; E713-I741 WeakPolarHBondContact OE2-CD1 3.16Å
714	C	92.9	Very high	89.4	Confident	71 Å²	71	46.8 Å²	46.8	48%	0.48	27%	0.267	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	16.8	176.5	-62.5	0	0	0	0	114.2	V712	V712-C714 PolarHBondContact O-N 3.26Å; V712-C714 VanDerWaalsContact O-N 3.15Å
715	S	92.9	Very high	89.3	Confident	20 Å²	20	46.2 Å²	46.2	14%	0.14	27%	0.267	C	S	.	.			trans	-70.3	135.3	169.2	-53	0	0	0	0	109.6	L504 V505 V712 E713	L504-S715 CarbonylContact C-O 3.55Å; L504-S715 WeakPolarHBondContact CA-O 3.49Å; V505-S715 WeakPolarHBondContact CG2-O 3.4Å; V505-S715 PolarHBondContact N-O 3.49Å; V712-S715 VanDerWaalsContact O-CB 3.27Å; V712-S715 WeakPolarHBondContact O-CB 3.4Å; V712-S715 PolarHBondContact O-N 2.9Å; V712-S715 PolarHBondContact O-OG 3.37Å; E713-S715 VanDerWaalsContact C-N 3.34Å
716	S	91.5	Very high	89.2	Confident	14 Å²	14	48 Å²	48	10%	0.098	28%	0.276	C	S	.	.	B	Isolated β-bridge	trans	-69.9	156.4	174.3	64.3	0	0	0	0	112.3	I503 F718 K719 A720	I503-S716 CarbonylContact O-C 3.55Å; I503-S716 WeakPolarHBondContact O-CA 3.43Å; S716-F718 PolarHBondContact O-N 2.63Å; S716-K719 PolarHBondContact O-N 3.04Å; S716-A720 PolarHBondContact O-N 2.72Å
717	L	90	Very high	89.2	Confident	0 Å²	0	48 Å²	48	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-54.4	-36.9	175.6	179	64.9	0	0	0	111.6	V500 I503 F508 A720 H721 L749 A752 V753 V756	V500-L717 HydrophobicContact CG1-CB 4.35Å; V500-L717 HydrophobicContact CG1-CD2 4.39Å; V500-L717 HydrophobicContact CG1-CG 4.32Å; I503-L717 HydrophobicContact CB-CB 4.18Å; I503-L717 HydrophobicContact CB-CD2 4.42Å; I503-L717 HydrophobicContact CG2-CB 4.29Å; I503-L717 HydrophobicContact CG2-CD2 4.48Å; I503-L717 PolarHBondContact O-N 3.43Å; F508-L717 HydrophobicContact CD1-CD1 4.4Å; F508-L717 HydrophobicContact CE1-CB 4.36Å; F508-L717 HydrophobicContact CE1-CD1 3.62Å; F508-L717 HydrophobicContact CE2-CD1 4.24Å; F508-L717 HydrophobicContact CZ-CD1 3.54Å; L717-A720 PolarHBondContact O-N 2.71Å; L717-H721 VanDerWaalsContact O-CB 3.23Å; L717-H721 WeakPolarHBondContact O-CB 3.4Å; L717-H721 PolarHBondContact O-N 3.39Å; L717-L749 HydrophobicContact CD1-CD1 3.71Å; L717-A752 HydrophobicContact CD1-CB 3.87Å; L717-A752 HydrophobicContact CD2-CB 4.3Å; L717-V753 HydrophobicContact CD1-CG2 4.2Å; L717-V753 HydrophobicContact CD2-CG2 4.16Å; L717-V753 HydrophobicContact CG-CG2 4.31Å; L717-V756 HydrophobicContact CD2-CG2 3.78Å
718	F	87.9	Confident	88.8	Confident	55 Å²	55	48.2 Å²	48.2	24%	0.241	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-47.5	173.6	-171.7	-98.6	0	0	0	112.4	L493 P495 V500 H501 S716 H721 A722	L493-F718 HydrophobicContact CB-CD2 4.18Å; L493-F718 HydrophobicContact CB-CE2 4.37Å; P495-F718 HydrophobicContact CB-CE2 3.98Å; P495-F718 HydrophobicContact CB-CZ 3.92Å; V500-F718 HydrophobicContact CG1-CB 3.8Å; V500-F718 HydrophobicContact CG1-CD2 4.27Å; V500-F718 PolarHBondContact O-N 3.28Å; H501-F718 AromaticContact CE1-CG 3.75Å; S716-F718 PolarHBondContact O-N 2.63Å; F718-H721 PolarHBondContact O-N 3.13Å; F718-A722 WeakPolarHBondContact O-CB 3.5Å; F718-A722 PolarHBondContact O-N 3.38Å
719	K	90.3	Very high	88.7	Confident	134 Å²	134	49.5 Å²	49.5	58%	0.583	27%	0.265	S	S	*	.	H	α-helix	trans	-66.1	-43.7	179.6	-70.8	179.5	178.1	-179.4	0	111.2	S716 A722 V723	S716-K719 PolarHBondContact O-N 3.04Å; K719-A722 PolarHBondContact O-N 2.81Å; K719-V723 WeakPolarHBondContact O-CB 3.25Å; K719-V723 VanDerWaalsContact O-CG2 3.3Å; K719-V723 WeakPolarHBondContact O-CG2 3.4Å; K719-V723 PolarHBondContact O-N 3.04Å
720	A	91.4	Very high	88.4	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.9	-44.7	175.2	0	0	0	0	0	112	V505 F508 L711 S716 L717 V723 F724 L749	V505-A720 HydrophobicContact CG2-CB 3.68Å; F508-A720 HydrophobicContact CZ-CB 4.35Å; L711-A720 HydrophobicContact CD1-CB 4.1Å; S716-A720 PolarHBondContact O-N 2.72Å; L717-A720 PolarHBondContact O-N 2.71Å; A720-V723 PolarHBondContact O-N 3.03Å; A720-F724 WeakPolarHBondContact O-CD2 3.36Å; A720-F724 PolarHBondContact O-N 3.33Å; A720-L749 HydrophobicContact CB-CD1 4.09Å
721	H	88.9	Confident	88.2	Confident	14 Å²	14	49.3 Å²	49.3	7%	0.065	26%	0.262	C	S	.	.	H	α-helix	trans	-59.8	-48.6	175.3	173.6	-78.3	0	0	0	112.4	P491 L493 L717 F718 V723 F724 S725	P491-H721 PolarHBondContact O-NE2 3.35Å; L493-H721 HydrophobicContact CD1-CB 3.52Å; L717-H721 VanDerWaalsContact O-CB 3.23Å; L717-H721 WeakPolarHBondContact O-CB 3.4Å; L717-H721 PolarHBondContact O-N 3.39Å; F718-H721 PolarHBondContact O-N 3.13Å; H721-V723 PolarHBondContact O-N 3.06Å; H721-F724 PolarHBondContact O-N 3.38Å; H721-S725 PolarHBondContact CE1-OG 3Å; H721-S725 VanDerWaalsContact O-CB 3.27Å; H721-S725 WeakPolarHBondContact O-CB 3.33Å; H721-S725 PolarHBondContact O-N 3.34Å; H721-S725 PolarHBondContact O-OG 3.43Å
722	A	87.4	Confident	88.2	Confident	28 Å²	28	48.9 Å²	48.9	23%	0.231	26%	0.26	C	S	.	.	H	α-helix	trans	-59.5	-47.9	179	0	0	0	0	0	111.3	F718 K719 S725 L726	F718-A722 WeakPolarHBondContact O-CB 3.5Å; F718-A722 PolarHBondContact O-N 3.38Å; K719-A722 PolarHBondContact O-N 2.81Å; A722-S725 PolarHBondContact O-N 2.99Å; A722-L726 WeakPolarHBondContact O-CB 3.35Å; A722-L726 WeakPolarHBondContact O-CD1 3.34Å; A722-L726 VanDerWaalsContact O-CG 3.3Å; A722-L726 WeakPolarHBondContact O-CG 3.33Å; A722-L726 PolarHBondContact O-N 2.93Å
723	V	89.4	Confident	88.3	Confident	36 Å²	36	45 Å²	45	22%	0.218	24%	0.235	C	C	.	.	H	α-helix	trans	-59.6	-48.7	178.1	166.2	0	0	0	0	112.1	F709 L711 K719 A720 H721 S725 L726 L727 L729	F709-V723 HydrophobicContact CD1-CG1 4.18Å; F709-V723 HydrophobicContact CE1-CG1 3.36Å; F709-V723 HydrophobicContact CE2-CG1 4.29Å; F709-V723 HydrophobicContact CZ-CG1 3.42Å; F709-V723 VanDerWaalsContact CZ-CG1 3.42Å; L711-V723 HydrophobicContact CD2-CG1 4.32Å; K719-V723 WeakPolarHBondContact O-CB 3.25Å; K719-V723 VanDerWaalsContact O-CG2 3.3Å; K719-V723 WeakPolarHBondContact O-CG2 3.4Å; K719-V723 PolarHBondContact O-N 3.04Å; A720-V723 PolarHBondContact O-N 3.03Å; H721-V723 PolarHBondContact O-N 3.06Å; V723-S725 VanDerWaalsContact C-N 3.29Å; V723-S725 PolarHBondContact O-N 3.07Å; V723-L726 PolarHBondContact O-N 3.41Å; V723-L727 HydrophobicContact CG1-CD1 4.34Å; V723-L727 WeakPolarHBondContact O-CB 3.21Å; V723-L727 PolarHBondContact O-N 3.49Å; V723-L729 HydrophobicContact CG1-CD1 3.91Å
724	F	87.9	Confident	88.4	Confident	4 Å²	4	42.5 Å²	42.5	2%	0.018	22%	0.224	C	C	.	.	H	α-helix	trans	-60.8	-37.9	176	-91.5	-114.1	0	0	0	112.3	L711 A720 H721 N728 L729 R731 A732 V744 L746 L749	L711-F724 HydrophobicContact CD1-CE2 3.98Å; A720-F724 WeakPolarHBondContact O-CD2 3.36Å; A720-F724 PolarHBondContact O-N 3.33Å; H721-F724 PolarHBondContact O-N 3.38Å; F724-N728 VanDerWaalsContact O-CA 3.25Å; F724-N728 WeakPolarHBondContact O-CA 3.2Å; F724-N728 PolarHBondContact O-N 3.46Å; F724-L729 HydrophobicContact CD1-CB 3.94Å; F724-L729 WeakPolarHBondContact CD1-O 3.25Å; F724-L729 HydrophobicContact CD2-CB 4.46Å; F724-L729 HydrophobicContact CD2-CD1 4.34Å; F724-L729 HydrophobicContact CE1-CB 4.23Å; F724-L729 HydrophobicContact CG-CB 4.07Å; F724-L729 PolarHBondContact O-N 3.28Å; F724-L729 VanDerWaalsContact O-N 3.11Å; F724-R731 VanDerWaalsContact CZ-C 3.45Å; F724-A732 HydrophobicContact CE2-CB 3.69Å; F724-A732 HydrophobicContact CZ-CB 3.96Å; F724-V744 HydrophobicContact CE1-CG1 4.39Å; F724-V744 HydrophobicContact CE2-CB 4.24Å; F724-V744 HydrophobicContact CE2-CG1 3.84Å; F724-V744 HydrophobicContact CZ-CB 3.97Å; F724-V744 HydrophobicContact CZ-CG1 3.56Å; F724-L746 HydrophobicContact CD1-CB 4.37Å; F724-L746 HydrophobicContact CD1-CD1 4.19Å; F724-L746 HydrophobicContact CE1-CB 4.35Å; F724-L749 HydrophobicContact CB-CD2 3.54Å; F724-L749 HydrophobicContact CD1-CD2 3.65Å; F724-L749 HydrophobicContact CD2-CD2 3.92Å; F724-L749 HydrophobicContact CE1-CD2 4.29Å; F724-L749 HydrophobicContact CG-CD2 3.44Å; F724-L749 VanDerWaalsContact CG-CD2 3.44Å
725	S	81.7	Confident	88.4	Confident	40 Å²	40	39.7 Å²	39.7	28%	0.28	21%	0.205	S	C	.	.	H	α-helix	trans	-79.2	-27.3	-177.2	-56.5	0	0	0	0	114.2	H241 H721 A722 V723	H241-S725 PolarHBondContact ND1-O 3.36Å; H721-S725 PolarHBondContact CE1-OG 3Å; H721-S725 VanDerWaalsContact O-CB 3.27Å; H721-S725 WeakPolarHBondContact O-CB 3.33Å; H721-S725 PolarHBondContact O-N 3.34Å; H721-S725 PolarHBondContact O-OG 3.43Å; A722-S725 PolarHBondContact O-N 2.99Å; V723-S725 VanDerWaalsContact C-N 3.29Å; V723-S725 PolarHBondContact O-N 3.07Å
726	L	82.2	Confident	88.5	Confident	106 Å²	106	40.3 Å²	40.3	56%	0.555	21%	0.209	S	C	*	.	H	α-helix	trans	-82.4	-43.1	177.2	-76.5	163.1	0	0	0	111.5	H241 A722 V723	H241-L726 VanDerWaalsContact CE1-CD2 3.48Å; H241-L726 WeakPolarHBondContact CE1-CD2 3.23Å; A722-L726 WeakPolarHBondContact O-CB 3.35Å; A722-L726 WeakPolarHBondContact O-CD1 3.34Å; A722-L726 VanDerWaalsContact O-CG 3.3Å; A722-L726 WeakPolarHBondContact O-CG 3.33Å; A722-L726 PolarHBondContact O-N 2.93Å; V723-L726 PolarHBondContact O-N 3.41Å
727	L	83.8	Confident	88.4	Confident	99 Å²	99	51.1 Å²	51.1	52%	0.518	25%	0.248	S	C	.	.	H	α-helix	trans	-96.4	2.3	-176.2	-59.3	178.1	0	0	0	113.5	F709 V723 L729	F709-L727 HydrophobicContact CD2-CD1 3.8Å; F709-L727 HydrophobicContact CE2-CD1 3.32Å; F709-L727 HydrophobicContact CZ-CD1 4Å; V723-L727 HydrophobicContact CG1-CD1 4.34Å; V723-L727 WeakPolarHBondContact O-CB 3.21Å; V723-L727 PolarHBondContact O-N 3.49Å; L727-L729 VanDerWaalsContact C-N 3.27Å; L727-L729 HydrophobicContact CB-CD1 4.4Å; L727-L729 HydrophobicContact CB-CD2 3.88Å; L727-L729 HydrophobicContact CB-CG 3.82Å; L727-L729 PolarHBondContact O-N 3.01Å
728	N	76.6	Confident	88.4	Confident	82 Å²	82	52.6 Å²	52.6	44%	0.439	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.7	42.7	-178.3	-162.5	5.6	0	0	0	113.2	F724	F724-N728 VanDerWaalsContact O-CA 3.25Å; F724-N728 WeakPolarHBondContact O-CA 3.2Å; F724-N728 PolarHBondContact O-N 3.46Å
729	L	84.3	Confident	88.6	Confident	31 Å²	31	56.9 Å²	56.9	16%	0.162	28%	0.277	C	S	.	.			trans	-74.4	134.7	-175.1	-58.3	-179.9	0	0	0	111.2	F709 V723 F724 L727 A732	F709-L729 HydrophobicContact CB-CD1 4.06Å; F709-L729 HydrophobicContact CB-CD2 4.35Å; F709-L729 HydrophobicContact CD1-CD1 3.62Å; F709-L729 HydrophobicContact CD2-CD1 4.18Å; F709-L729 HydrophobicContact CE1-CD1 4.2Å; F709-L729 HydrophobicContact CG-CD1 3.64Å; F709-L729 HydrophobicContact CG-CD2 4.48Å; V723-L729 HydrophobicContact CG1-CD1 3.91Å; F724-L729 HydrophobicContact CD1-CB 3.94Å; F724-L729 WeakPolarHBondContact CD1-O 3.25Å; F724-L729 HydrophobicContact CD2-CB 4.46Å; F724-L729 HydrophobicContact CD2-CD1 4.34Å; F724-L729 HydrophobicContact CE1-CB 4.23Å; F724-L729 HydrophobicContact CG-CB 4.07Å; F724-L729 PolarHBondContact O-N 3.28Å; F724-L729 VanDerWaalsContact O-N 3.11Å; L727-L729 VanDerWaalsContact C-N 3.27Å; L727-L729 HydrophobicContact CB-CD1 4.4Å; L727-L729 HydrophobicContact CB-CD2 3.88Å; L727-L729 HydrophobicContact CB-CG 3.82Å; L727-L729 PolarHBondContact O-N 3.01Å; L729-A732 HydrophobicContact CD1-CB 4.47Å
730	Q	83.4	Confident	88.8	Confident	81 Å²	81	51.1 Å²	51.1	38%	0.379	25%	0.253	S	S	.	.	S	Bend	trans	-82.8	-18.6	168.2	-54.9	-156.1	-34.3	0	0	112	G145 L746	G145-Q730 PolarHBondContact O-NE2 3.31Å; Q730-L746 PolarHBondContact O-N 2.98Å
731	R	90	Very high	88.8	Confident	72 Å²	72	53.9 Å²	53.9	27%	0.272	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162.6	165.2	-178.7	55.6	158.1	174.1	-110.6	-14.5	111.9	T537 E552 F724 L743 V744	T537-R731 PolarHBondContact OG1-NH1 2.86Å; T537-R731 PolarHBondContact OG1-NH2 2.82Å; E552-R731 IonicContact OE1-CZ 2.65Å; E552-R731 IonicContact OE1-NE 3.54Å; E552-R731 IonicContact OE1-NH2 3.74Å; E552-R731 PolarHBondContact OE1-NH2 3.42Å; E552-R731 IonicContact OE2-CZ 2.72Å; E552-R731 IonicContact OE2-NE 3.01Å; E552-R731 PolarHBondContact OE2-NE 3.49Å; E552-R731 VanDerWaalsContact OE2-NE 3.12Å; E552-R731 IonicContact OE2-NH1 2.66Å; E552-R731 IonicContact OE2-NH2 2.67Å; E552-R731 PolarHBondContact OE2-NH2 2.96Å; F724-R731 VanDerWaalsContact CZ-C 3.45Å; R731-L743 HydrophobicContact CB-CD1 4.09Å; R731-V744 CarbonylContact C-O 3.14Å; R731-V744 WeakPolarHBondContact CA-O 3.34Å; R731-V744 WeakPolarHBondContact CB-O 3.48Å
732	A	93.7	Very high	89.1	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.008	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	143.2	163.1	0	0	0	0	0	109.3	F709 L711 F724 L729 V744	F709-A732 HydrophobicContact CD1-CB 3.9Å; F709-A732 WeakPolarHBondContact O-CA 3.36Å; L711-A732 HydrophobicContact CD1-CB 3.87Å; L711-A732 HydrophobicContact CG-CB 3.91Å; F724-A732 HydrophobicContact CE2-CB 3.69Å; F724-A732 HydrophobicContact CZ-CB 3.96Å; L729-A732 HydrophobicContact CD1-CB 4.47Å; A732-V744 PolarHBondContact N-O 3.33Å; A732-V744 PolarHBondContact O-N 3.48Å
733	Y	94.7	Very high	89.4	Confident	5 Å²	5	53.5 Å²	53.5	2%	0.02	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	144.7	172.3	-64.8	-77.4	0	0	0	109.8	V513 P539 L549 E552 P708 F709 Q710 L711 L740 L743	V513-Y733 HydrophobicContact CG1-CE1 4.45Å; P539-Y733 HydrophobicContact CB-CD1 4.25Å; P539-Y733 HydrophobicContact CB-CE1 3.65Å; P539-Y733 HydrophobicContact CG-CD1 4.38Å; P539-Y733 HydrophobicContact CG-CE1 3.65Å; L549-Y733 HydrophobicContact CD2-CD2 4.18Å; L549-Y733 HydrophobicContact CD2-CG 4.05Å; E552-Y733 HydrophobicContact CB-CE2 4.33Å; E552-Y733 PolarHBondContact OE2-OH 3.41Å; P708-Y733 HydrophobicContact CB-CD2 3.9Å; P708-Y733 HydrophobicContact CB-CE2 3.87Å; P708-Y733 HydrophobicContact CG-CD2 4.38Å; F709-Y733 PolarHBondContact O-N 2.95Å; Q710-Y733 CarbonylContact C-O 3.57Å; Q710-Y733 VanDerWaalsContact CA-O 3.28Å; Q710-Y733 WeakPolarHBondContact CA-O 3.38Å; L711-Y733 PolarHBondContact N-O 2.92Å; Y733-L740 HydrophobicContact CD1-CD1 3.74Å; Y733-L740 HydrophobicContact CG-CD1 4.28Å; Y733-L743 HydrophobicContact CD1-CD1 3.73Å; Y733-L743 HydrophobicContact CE1-CD1 3.72Å; Y733-L743 HydrophobicContact CG-CD1 4.35Å
734	V	95.4	Very high	89.6	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	125.2	174.7	-171.2	0	0	0	0	108.5	V505 M509 L711 E713 I741 G742 V744	V505-V734 HydrophobicContact CG1-CB 4.28Å; V505-V734 HydrophobicContact CG1-CG1 3.76Å; V505-V734 HydrophobicContact CG1-CG2 3.46Å; V505-V734 VanDerWaalsContact CG1-CG2 3.46Å; M509-V734 HydrophobicContact CB-CG2 3.89Å; M509-V734 HydrophobicContact SD-CB 3.91Å; M509-V734 HydrophobicContact SD-CG1 3.74Å; M509-V734 HydrophobicContact SD-CG2 4.03Å; L711-V734 WeakPolarHBondContact O-CA 3.32Å; E713-V734 HydrophobicContact CB-CG1 3.91Å; V734-I741 PolarHBondContact O-N 3.02Å; V734-G742 PolarHBondContact N-O 3.15Å; V734-G742 PolarHBondContact O-N 3.42Å; V734-V744 HydrophobicContact CG2-CG2 3.77Å
735	T	94.2	Very high	89.7	Confident	12 Å²	12	53.2 Å²	53.2	7%	0.074	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	151.7	179.4	66.1	0	0	0	0	112.7	L549 Q710 L711 R739	L549-T735 HydrophobicContact CB-CG2 4.46Å; L549-T735 HydrophobicContact CD2-CG2 4.09Å; Q710-T735 HydrophobicContact CG-CG2 4.36Å; Q710-T735 VanDerWaalsContact OE1-CG2 3.23Å; Q710-T735 PolarHBondContact OE1-OG1 3.38Å; L711-T735 PolarHBondContact O-N 2.97Å; T735-R739 WeakPolarHBondContact CA-O 2.98Å; T735-R739 VanDerWaalsContact CB-O 3.29Å; T735-R739 WeakPolarHBondContact CB-O 3.5Å
736	S	93.3	Very high	89.9	Confident	32 Å²	32	52.5 Å²	52.5	22%	0.224	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	128.4	166.5	-165	0	0	0	0	108.9	E713 G738 R739 I741	E713-S736 WeakPolarHBondContact OE1-CB 3.24Å; E713-S736 PolarHBondContact OE1-OG 2.98Å; S736-G738 PolarHBondContact O-N 3.45Å; S736-G738 VanDerWaalsContact O-N 3.15Å; S736-R739 PolarHBondContact N-O 3.3Å; S736-R739 VanDerWaalsContact N-O 3.12Å; S736-R739 WeakPolarHBondContact O-CB 3.47Å; S736-R739 PolarHBondContact O-N 3.16Å; S736-I741 VanDerWaalsContact CB-CD1 3.42Å
737	R	90.4	Very high	90	Very high	242 Å²	242	53.2 Å²	53.2	91%	0.913	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	38.8	-171.9	-56.1	178.5	178.4	174.2	-1.5	112.5	R739	R737-R739 PolarHBondContact O-N 3.2Å
738	G	88.9	Confident	90.2	Very high	30 Å²	30	52.3 Å²	52.3	31%	0.309	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	74.7	-6.3	-177.6	0	0	0	0	0	116.2	I548 L549 S736	I548-G738 WeakPolarHBondContact CA-O 3.15Å; L549-G738 PolarHBondContact N-O 2.84Å; L549-G738 VanDerWaalsContact N-O 3.08Å; S736-G738 PolarHBondContact O-N 3.45Å; S736-G738 VanDerWaalsContact O-N 3.15Å
739	R	93.4	Very high	90.8	Very high	145 Å²	145	48.4 Å²	48.4	55%	0.547	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	133.9	177.4	-53.1	-171.1	177.7	172	-3.3	110.5	S546 K547 T735 S736 R737 I741	S546-R739 WeakPolarHBondContact O-CG 3.27Å; K547-R739 WeakPolarHBondContact O-CA 3.45Å; T735-R739 WeakPolarHBondContact CA-O 2.98Å; T735-R739 VanDerWaalsContact CB-O 3.29Å; T735-R739 WeakPolarHBondContact CB-O 3.5Å; S736-R739 PolarHBondContact N-O 3.3Å; S736-R739 VanDerWaalsContact N-O 3.12Å; S736-R739 WeakPolarHBondContact O-CB 3.47Å; S736-R739 PolarHBondContact O-N 3.16Å; R737-R739 PolarHBondContact O-N 3.2Å; R739-I741 PolarHBondContact O-N 3.41Å
740	L	93.9	Very high	90.8	Very high	14 Å²	14	48.4 Å²	48.4	7%	0.073	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	119.9	171.5	178.1	64.7	0	0	0	110.2	V513 Y515 P539 V541 K547 Y733	V513-L740 HydrophobicContact CB-CD2 4.4Å; V513-L740 HydrophobicContact CG1-CD2 4.11Å; Y515-L740 HydrophobicContact CD1-CD2 4.46Å; P539-L740 HydrophobicContact CB-CD2 3.97Å; P539-L740 HydrophobicContact CG-CD2 3.71Å; V541-L740 HydrophobicContact CG1-CB 4.12Å; V541-L740 HydrophobicContact CG1-CD2 3.87Å; K547-L740 WeakPolarHBondContact O-CB 3.4Å; K547-L740 PolarHBondContact O-N 3.36Å; Y733-L740 HydrophobicContact CD1-CD1 3.74Å; Y733-L740 HydrophobicContact CG-CD1 4.28Å
741	I	92.4	Very high	90.8	Very high	58 Å²	58	46.9 Å²	46.9	30%	0.297	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	-35.7	178.9	-66.9	178.8	0	0	0	111.5	M509 E713 V734 S736 R739	M509-I741 HydrophobicContact CE-CG2 3.56Å; M509-I741 HydrophobicContact SD-CG2 4.03Å; E713-I741 WeakPolarHBondContact OE2-CD1 3.16Å; V734-I741 PolarHBondContact O-N 3.02Å; S736-I741 VanDerWaalsContact CB-CD1 3.42Å; R739-I741 PolarHBondContact O-N 3.41Å
742	G	93.8	Very high	90.6	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	-178.5	-174	0	0	0	0	0	114.8	I510 V734	I510-G742 CarbonylContact O-C 3.59Å; I510-G742 WeakPolarHBondContact O-CA 3.49Å; V734-G742 PolarHBondContact N-O 3.15Å; V734-G742 PolarHBondContact O-N 3.42Å
743	L	93.6	Very high	90.1	Very high	33 Å²	33	43.8 Å²	43.8	17%	0.173	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136	121.5	175.9	178.3	73	0	0	0	109.3	I510 V513 R731 Y733 T745	I510-L743 HydrophobicContact CB-CB 4.45Å; I510-L743 WeakPolarHBondContact CB-O 3.23Å; I510-L743 PolarHBondContact N-O 3.33Å; I510-L743 PolarHBondContact O-N 2.93Å; V513-L743 HydrophobicContact CG1-CB 4.49Å; V513-L743 HydrophobicContact CG2-CB 3.62Å; R731-L743 HydrophobicContact CB-CD1 4.09Å; Y733-L743 HydrophobicContact CD1-CD1 3.73Å; Y733-L743 HydrophobicContact CE1-CD1 3.72Å; Y733-L743 HydrophobicContact CG-CD1 4.35Å; L743-T745 HydrophobicContact CD2-CG2 4.01Å; L743-T745 HydrophobicContact CG-CG2 4.14Å
744	V	93.3	Very high	89.1	Confident	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.9	164.1	-179.7	0	0	0	0	108.1	V505 F508 M509 L711 F724 R731 A732 V734 L749	V505-V744 HydrophobicContact CG1-CG2 3.81Å; F508-V744 HydrophobicContact CE2-CG1 3.84Å; F508-V744 HydrophobicContact CE2-CG2 4.18Å; M509-V744 HydrophobicContact CB-CG2 4.29Å; L711-V744 HydrophobicContact CD1-CG2 4.29Å; F724-V744 HydrophobicContact CE1-CG1 4.39Å; F724-V744 HydrophobicContact CE2-CB 4.24Å; F724-V744 HydrophobicContact CE2-CG1 3.84Å; F724-V744 HydrophobicContact CZ-CB 3.97Å; F724-V744 HydrophobicContact CZ-CG1 3.56Å; R731-V744 CarbonylContact C-O 3.14Å; R731-V744 WeakPolarHBondContact CA-O 3.34Å; R731-V744 WeakPolarHBondContact CB-O 3.48Å; A732-V744 PolarHBondContact N-O 3.33Å; A732-V744 PolarHBondContact O-N 3.48Å; V734-V744 HydrophobicContact CG2-CG2 3.77Å; V744-L749 HydrophobicContact CG1-CB 4.15Å
745	T	90.3	Very high	88.2	Confident	35 Å²	35	51.5 Å²	51.5	22%	0.215	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	156.3	169.2	64.9	0	0	0	0	109.5	I510 L743 Q747 K748 L749	I510-T745 HydrophobicContact CD1-CG2 4.11Å; L743-T745 HydrophobicContact CD2-CG2 4.01Å; L743-T745 HydrophobicContact CG-CG2 4.14Å; T745-Q747 PolarHBondContact O-N 3.48Å; T745-Q747 VanDerWaalsContact O-N 3.09Å; T745-K748 PolarHBondContact O-N 2.95Å; T745-K748 VanDerWaalsContact O-N 3.11Å; T745-K748 PolarHBondContact OG1-N 3.48Å; T745-L749 WeakPolarHBondContact O-CB 3.33Å; T745-L749 PolarHBondContact O-N 2.99Å
746	L	85.5	Confident	87.3	Confident	25 Å²	25	51.3 Å²	51.3	13%	0.131	24%	0.24	C	C	.	.	H	α-helix	trans	-56.2	-27.1	176	-178.6	62.7	0	0	0	112.6	V146 L490 F724 Q730 L749 R750	V146-L746 HydrophobicContact CG2-CD2 4.01Å; L490-L746 HydrophobicContact CB-CD1 4.31Å; L490-L746 HydrophobicContact CD2-CD1 3.88Å; F724-L746 HydrophobicContact CD1-CB 4.37Å; F724-L746 HydrophobicContact CD1-CD1 4.19Å; F724-L746 HydrophobicContact CE1-CB 4.35Å; Q730-L746 PolarHBondContact O-N 2.98Å; L746-L749 HydrophobicContact CD1-CD2 4.5Å; L746-R750 PolarHBondContact O-N 2.8Å
747	Q	85.4	Confident	86	Confident	120 Å²	120	55 Å²	55	56%	0.561	25%	0.249	S	C	*	.	H	α-helix	trans	-69.6	-55.5	172.9	178	-180	-21.4	0	0	111.8	T745 L749 R750 E751	T745-Q747 PolarHBondContact O-N 3.48Å; T745-Q747 VanDerWaalsContact O-N 3.09Å; Q747-L749 PolarHBondContact O-N 3.03Å; Q747-R750 WeakPolarHBondContact O-CA 3.43Å; Q747-R750 WeakPolarHBondContact O-CB 3.45Å; Q747-R750 PolarHBondContact O-N 3.38Å; Q747-E751 WeakPolarHBondContact CG-OE1 3.38Å; Q747-E751 PolarHBondContact NE2-OE1 3.24Å; Q747-E751 PolarHBondContact O-N 2.69Å
748	K	88.3	Confident	84.7	Confident	81 Å²	81	50 Å²	50	35%	0.352	24%	0.239	S	C	.	.	H	α-helix	trans	-61.3	-33.6	179.8	-83.3	-76.9	165.9	-156.4	0	112.8	I510 T745 E751 A752	I510-K748 HydrophobicContact CD1-CG 4.18Å; I510-K748 HydrophobicContact CG1-CG 3.99Å; T745-K748 PolarHBondContact O-N 2.95Å; T745-K748 VanDerWaalsContact O-N 3.11Å; T745-K748 PolarHBondContact OG1-N 3.48Å; K748-E751 VanDerWaalsContact CD-OE2 3.26Å; K748-E751 WeakPolarHBondContact CD-OE2 3.46Å; K748-E751 WeakPolarHBondContact CE-OE2 3.33Å; K748-E751 IonicContact NZ-OE2 2.69Å; K748-E751 PolarHBondContact NZ-OE2 3.18Å; K748-E751 PolarHBondContact O-N 2.84Å; K748-A752 PolarHBondContact O-N 3.03Å; K748-A752 VanDerWaalsContact O-N 3.08Å
749	L	88.5	Confident	83.1	Confident	0 Å²	0	56.8 Å²	56.8	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.3	-38.5	171.9	-176.7	67.4	0	0	0	112.6	L490 F508 L717 A720 F724 V744 T745 L746 Q747 V753	L490-L749 HydrophobicContact CD1-CD2 4.29Å; L490-L749 HydrophobicContact CD1-CG 4.06Å; L490-L749 HydrophobicContact CD2-CD2 3.83Å; L490-L749 HydrophobicContact CD2-CG 4.47Å; F508-L749 HydrophobicContact CE2-CB 4.43Å; F508-L749 HydrophobicContact CE2-CD1 3.91Å; F508-L749 HydrophobicContact CZ-CD1 3.96Å; L717-L749 HydrophobicContact CD1-CD1 3.71Å; A720-L749 HydrophobicContact CB-CD1 4.09Å; F724-L749 HydrophobicContact CB-CD2 3.54Å; F724-L749 HydrophobicContact CD1-CD2 3.65Å; F724-L749 HydrophobicContact CD2-CD2 3.92Å; F724-L749 HydrophobicContact CE1-CD2 4.29Å; F724-L749 HydrophobicContact CG-CD2 3.44Å; F724-L749 VanDerWaalsContact CG-CD2 3.44Å; V744-L749 HydrophobicContact CG1-CB 4.15Å; T745-L749 WeakPolarHBondContact O-CB 3.33Å; T745-L749 PolarHBondContact O-N 2.99Å; L746-L749 HydrophobicContact CD1-CD2 4.5Å; Q747-L749 PolarHBondContact O-N 3.03Å; L749-V753 WeakPolarHBondContact O-CG2 3.4Å; L749-V753 PolarHBondContact O-N 3.3Å
750	R	83.8	Confident	81	Confident	30 Å²	30	52.4 Å²	52.4	11%	0.113	25%	0.248	C	C	.	.	H	α-helix	trans	-68.1	-47.9	173.6	-175.7	-170.8	-57.6	111.2	6.2	111.5	P488 Y489 L490 L746 Q747 A752 V753 E754	P488-R750 VanDerWaalsContact C-CZ 3.43Å; P488-R750 PolarHBondContact O-NH2 3.31Å; Y489-R750 VanDerWaalsContact C-NE 3.33Å; Y489-R750 VanDerWaalsContact O-CD 3.24Å; Y489-R750 WeakPolarHBondContact O-CD 3.34Å; Y489-R750 WeakPolarHBondContact O-CG 3.35Å; Y489-R750 PolarHBondContact O-NE 2.69Å; L490-R750 HydrophobicContact CD1-CB 4.17Å; L746-R750 PolarHBondContact O-N 2.8Å; Q747-R750 WeakPolarHBondContact O-CA 3.43Å; Q747-R750 WeakPolarHBondContact O-CB 3.45Å; Q747-R750 PolarHBondContact O-N 3.38Å; R750-A752 VanDerWaalsContact C-N 3.27Å; R750-A752 PolarHBondContact O-N 3.41Å; R750-V753 CarbonylContact O-C 3.56Å; R750-V753 WeakPolarHBondContact O-CA 3.32Å; R750-V753 WeakPolarHBondContact O-CB 3.2Å; R750-V753 PolarHBondContact O-N 2.75Å; R750-E754 WeakPolarHBondContact CD-OE1 3.45Å; R750-E754 HydrophobicContact CG-CG 4.11Å; R750-E754 WeakPolarHBondContact CG-OE1 3.46Å; R750-E754 PolarHBondContact O-N 3.1Å
751	E	84.2	Confident	78.3	Confident	49 Å²	49	53.4 Å²	53.4	23%	0.229	26%	0.262	C	S	.	.	H	α-helix	trans	-53.3	-47.4	179.3	-69	167.9	-164	0	0	110.3	Q747 K748 V753 E754 H755	Q747-E751 WeakPolarHBondContact CG-OE1 3.38Å; Q747-E751 PolarHBondContact NE2-OE1 3.24Å; Q747-E751 PolarHBondContact O-N 2.69Å; K748-E751 VanDerWaalsContact CD-OE2 3.26Å; K748-E751 WeakPolarHBondContact CD-OE2 3.46Å; K748-E751 WeakPolarHBondContact CE-OE2 3.33Å; K748-E751 IonicContact NZ-OE2 2.69Å; K748-E751 PolarHBondContact NZ-OE2 3.18Å; K748-E751 PolarHBondContact O-N 2.84Å; E751-V753 PolarHBondContact O-N 3.13Å; E751-E754 PolarHBondContact O-N 3.29Å; E751-H755 PolarHBondContact O-CD2 3.39Å; E751-H755 PolarHBondContact O-N 3.07Å
752	A	85.4	Confident	75.4	Confident	9 Å²	9	57.5 Å²	57.5	7%	0.074	29%	0.293	C	S	.	.	H	α-helix	trans	-59.2	-41.5	174.2	0	0	0	0	0	113.7	F508 L717 K748 R750 V756	F508-A752 HydrophobicContact CB-CB 3.97Å; F508-A752 HydrophobicContact CD1-CB 4.03Å; F508-A752 HydrophobicContact CD2-CB 3.93Å; F508-A752 HydrophobicContact CE2-CB 4.42Å; F508-A752 HydrophobicContact CG-CB 3.72Å; L717-A752 HydrophobicContact CD1-CB 3.87Å; L717-A752 HydrophobicContact CD2-CB 4.3Å; K748-A752 PolarHBondContact O-N 3.03Å; K748-A752 VanDerWaalsContact O-N 3.08Å; R750-A752 VanDerWaalsContact C-N 3.27Å; R750-A752 PolarHBondContact O-N 3.41Å; A752-V756 WeakPolarHBondContact O-CG2 3.29Å; A752-V756 PolarHBondContact O-N 3.09Å; A752-V756 VanDerWaalsContact O-N 3.12Å
753	V	82.7	Confident	72.5	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-67.4	-37.5	176.8	163.7	0	0	0	0	112.6	L490 P491 L493 L717 L749 R750 E751 V756 R757	L490-V753 HydrophobicContact CD1-CG2 4.36Å; P491-V753 HydrophobicContact CG-CG1 3.7Å; L493-V753 HydrophobicContact CD1-CG2 3.8Å; L493-V753 HydrophobicContact CD2-CB 4.49Å; L493-V753 HydrophobicContact CD2-CG1 3.76Å; L493-V753 HydrophobicContact CD2-CG2 4.06Å; L493-V753 HydrophobicContact CG-CG2 4.32Å; L717-V753 HydrophobicContact CD1-CG2 4.2Å; L717-V753 HydrophobicContact CD2-CG2 4.16Å; L717-V753 HydrophobicContact CG-CG2 4.31Å; L749-V753 WeakPolarHBondContact O-CG2 3.4Å; L749-V753 PolarHBondContact O-N 3.3Å; R750-V753 CarbonylContact O-C 3.56Å; R750-V753 WeakPolarHBondContact O-CA 3.32Å; R750-V753 WeakPolarHBondContact O-CB 3.2Å; R750-V753 PolarHBondContact O-N 2.75Å; E751-V753 PolarHBondContact O-N 3.13Å; V753-V756 PolarHBondContact O-N 3.49Å; V753-R757 WeakPolarHBondContact O-CG 3.45Å; V753-R757 PolarHBondContact O-N 3.33Å; V753-R757 VanDerWaalsContact O-N 3.11Å
754	E	75.3	Confident	69.6	Low	90 Å²	90	68.1 Å²	68.1	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-68.8	-42.9	177.6	-73.2	173.9	174.1	0	0	111.1	R750 E751 V756 R757 L758	R750-E754 WeakPolarHBondContact CD-OE1 3.45Å; R750-E754 HydrophobicContact CG-CG 4.11Å; R750-E754 WeakPolarHBondContact CG-OE1 3.46Å; R750-E754 PolarHBondContact O-N 3.1Å; E751-E754 PolarHBondContact O-N 3.29Å; E754-V756 PolarHBondContact O-N 2.96Å; E754-R757 PolarHBondContact O-N 2.87Å; E754-L758 WeakPolarHBondContact O-CG 3.2Å; E754-L758 PolarHBondContact O-N 3.45Å
755	H	75.8	Confident	66.4	Low	76 Å²	76	71.4 Å²	71.4	35%	0.352	38%	0.382	S	S	.	.	H	α-helix	trans	-57	-47.7	171.1	-73.2	-65.9	0	0	0	112.1	E751 R757 L758 Y759	E751-H755 PolarHBondContact O-CD2 3.39Å; E751-H755 PolarHBondContact O-N 3.07Å; H755-R757 VanDerWaalsContact C-N 3.29Å; H755-R757 PolarHBondContact O-N 3.29Å; H755-L758 PolarHBondContact O-N 2.95Å; H755-Y759 VanDerWaalsContact O-CD2 3.23Å; H755-Y759 WeakPolarHBondContact O-CD2 3.34Å; H755-Y759 PolarHBondContact O-N 3.22Å; H755-Y759 VanDerWaalsContact O-N 3.11Å
756	V	74.7	Confident	63.4	Low	9 Å²	9	78.6 Å²	78.6	6%	0.055	41%	0.413	C	S	.	.	H	α-helix	trans	-58.1	-42.5	177.7	173.9	0	0	0	0	111.7	A499 V500 I503 L717 A752 V753 E754 L758 Y759 S760	A499-V756 HydrophobicContact CB-CG1 3.8Å; V500-V756 HydrophobicContact CG2-CG1 3.79Å; I503-V756 HydrophobicContact CD1-CG2 3.39Å; I503-V756 HydrophobicContact CG1-CG2 4.27Å; L717-V756 HydrophobicContact CD2-CG2 3.78Å; A752-V756 WeakPolarHBondContact O-CG2 3.29Å; A752-V756 PolarHBondContact O-N 3.09Å; A752-V756 VanDerWaalsContact O-N 3.12Å; V753-V756 PolarHBondContact O-N 3.49Å; E754-V756 PolarHBondContact O-N 2.96Å; V756-L758 PolarHBondContact O-N 2.56Å; V756-Y759 PolarHBondContact O-N 3.03Å; V756-S760 WeakPolarHBondContact O-CB 3.44Å; V756-S760 PolarHBondContact O-N 3.18Å; V756-S760 PolarHBondContact O-OG 3.06Å
757	R	67.5	Low	60.8	Low	110 Å²	110	84.8 Å²	84.8	42%	0.415	45%	0.445	S	S	.	.	H	α-helix	trans	-65.3	-36.2	179.7	-77	176.8	165.4	-133.3	-5.5	112.9	N492 V753 E754 H755	N492-R757 PolarHBondContact O-NH2 3Å; V753-R757 WeakPolarHBondContact O-CG 3.45Å; V753-R757 PolarHBondContact O-N 3.33Å; V753-R757 VanDerWaalsContact O-N 3.11Å; E754-R757 PolarHBondContact O-N 2.87Å; H755-R757 VanDerWaalsContact C-N 3.29Å; H755-R757 PolarHBondContact O-N 3.29Å
758	L	62.3	Low	58.1	Low	136 Å²	136	83.6 Å²	83.6	71%	0.712	45%	0.45	S	S	*	.	H	α-helix	trans	-71.1	-38.3	178	-68.6	169.9	0	0	0	112.6	E754 H755 V756	E754-L758 WeakPolarHBondContact O-CG 3.2Å; E754-L758 PolarHBondContact O-N 3.45Å; H755-L758 PolarHBondContact O-N 2.95Å; V756-L758 PolarHBondContact O-N 2.56Å
759	Y	55.3	Low	55.3	Low	172 Å²	172	86.1 Å²	86.1	68%	0.675	48%	0.478	S	S	*	.	H	α-helix	trans	-91.3	-10.7	-178	-65.9	-68.1	0	0	0	115.1	H755 V756 G761 S764	H755-Y759 VanDerWaalsContact O-CD2 3.23Å; H755-Y759 WeakPolarHBondContact O-CD2 3.34Å; H755-Y759 PolarHBondContact O-N 3.22Å; H755-Y759 VanDerWaalsContact O-N 3.11Å; V756-Y759 PolarHBondContact O-N 3.03Å; Y759-G761 VanDerWaalsContact C-N 3.3Å; Y759-G761 PolarHBondContact O-N 3.02Å; Y759-S764 WeakPolarHBondContact O-CB 3.43Å; Y759-S764 PolarHBondContact O-OG 3.35Å
760	S	48.8	Very low	52.3	Low	53 Å²	53	90.3 Å²	90.3	37%	0.371	51%	0.507	S	S	.	.			trans	-89.9	20.4	177.6	-53.7	0	0	0	0	114.3	A499 V756	A499-S760 WeakPolarHBondContact CB-OG 3.41Å; V756-S760 WeakPolarHBondContact O-CB 3.44Å; V756-S760 PolarHBondContact O-N 3.18Å; V756-S760 PolarHBondContact O-OG 3.06Å
761	G	36.7	Very low	49.5	Very low	35 Å²	35	94.8 Å²	94.8	36%	0.361	53%	0.533	S	S	.	.	S	Bend	trans	-66	156.6	169.4	0	0	0	0	0	111.9	Y759 E763 S764	Y759-G761 VanDerWaalsContact C-N 3.3Å; Y759-G761 PolarHBondContact O-N 3.02Å; G761-E763 PolarHBondContact O-N 3.37Å; G761-S764 PolarHBondContact O-N 3.08Å; G761-S764 PolarHBondContact O-OG 3.42Å
762	P	32.4	Very low	46.9	Very low	144 Å²	144	98.5 Å²	98.5	94%	0.935	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.9	4.1	-167.6	27.2	-35.9	0	0	0	116.3
763	E	32.4	Very low	44.1	Very low	188 Å²	188	103.6 Å²	103.6	88%	0.879	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.5	-11.3	-176.8	-60.9	-172.3	146.5	0	0	114.2	G761 G765	G761-E763 PolarHBondContact O-N 3.37Å; E763-G765 PolarHBondContact O-N 2.7Å
764	S	32.5	Very low	41.5	Very low	69 Å²	69	111.4 Å²	111.4	48%	0.483	62%	0.619	S	S	.	*			trans	-79.2	23.8	-171.9	59.6	0	0	0	0	115.8	Y759 G761 H766	Y759-S764 WeakPolarHBondContact O-CB 3.43Å; Y759-S764 PolarHBondContact O-OG 3.35Å; G761-S764 PolarHBondContact O-N 3.08Å; G761-S764 PolarHBondContact O-OG 3.42Å; S764-H766 VanDerWaalsContact C-N 3.26Å; S764-H766 PolarHBondContact O-N 2.92Å
765	G	26.3	Very low	39.1	Very low	68 Å²	68	112.4 Å²	112.4	70%	0.701	63%	0.631	S	S	*	*			trans	-72.6	7.2	-169.1	0	0	0	0	0	117.9	E763	E763-G765 PolarHBondContact O-N 2.7Å
766	H	27.1	Very low	36.8	Very low	186 Å²	186	112.9 Å²	112.9	86%	0.861	64%	0.642	S	S	*	*			trans	-149.2	84	-176.5	-81.6	-70.5	0	0	0	114	S764	S764-H766 VanDerWaalsContact C-N 3.26Å; S764-H766 PolarHBondContact O-N 2.92Å
767	I	31.6	Very low	34.3	Very low	156 Å²	156	118.8 Å²	118.8	80%	0.8	67%	0.674	S	S	*	*			trans	-134.8	136.1	153.3	-71.8	93.8	0	0	0	108.7
768	S	28.1	Very low	32.4	Very low	95 Å²	95	123.8 Å²	123.8	66%	0.664	69%	0.694	S	S	*	*			trans	-85.8	157.8	-179.2	46.5	0	0	0	0	113.6	S770	S768-S770 PolarHBondContact O-N 3.35Å; S768-S770 VanDerWaalsContact O-N 3.08Å
769	S	29.2	Very low	30.5	Very low	134 Å²	134	124.8 Å²	124.8	94%	0.937	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	61.8	-168.3	58.4	0	0	0	0	114.6
770	S	27.1	Very low	29.2	Very low	87 Å²	87	122.2 Å²	122.2	61%	0.608	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.4	-41.1	176.3	54.2	0	0	0	0	113.9	S768	S768-S770 PolarHBondContact O-N 3.35Å; S768-S770 VanDerWaalsContact O-N 3.08Å
771	D	25.3	Very low	28	Very low	124 Å²	124	123.8 Å²	123.8	66%	0.663	71%	0.709	S	S	*	*			trans	-124.7	113.6	-166.5	-62.3	-85.2	0	0	0	112
772	T	28.2	Very low	27.6	Very low	127 Å²	127	130.7 Å²	130.7	78%	0.779	73%	0.725	S	S	*	*			trans	-131.5	49.7	175.7	44.6	0	0	0	0	111.8	W774	T772-W774 VanDerWaalsContact O-CD1 3.32Å; T772-W774 PolarHBondContact O-N 3.21Å
773	T	26.3	Very low	27.1	Very low	116 Å²	116	130.3 Å²	130.3	71%	0.712	72%	0.721	S	S	*	*			trans	-69.9	112.9	167.1	36.9	0	0	0	0	110.2	V775	T773-V775 VanDerWaalsContact C-N 3.27Å; T773-V775 PolarHBondContact O-N 3.05Å
774	W	28.8	Very low	26.8	Very low	165 Å²	165	127.2 Å²	127.2	63%	0.625	71%	0.714	S	S	*	*			trans	-74.4	72.3	-179.1	-72.8	81.7	0	0	0	112.3	D507 T772 C776	D507-W774 HydrophobicContact CB-CZ2 4.08Å; T772-W774 VanDerWaalsContact O-CD1 3.32Å; T772-W774 PolarHBondContact O-N 3.21Å; W774-C776 PolarHBondContact O-N 3.45Å
775	V	24.4	Very low	26.5	Very low	110 Å²	110	132.8 Å²	132.8	67%	0.667	73%	0.73	S	S	*	*			trans	-83.2	94.7	173.8	-175.3	0	0	0	0	109.7	T773	T773-V775 VanDerWaalsContact C-N 3.27Å; T773-V775 PolarHBondContact O-N 3.05Å
776	C	27.8	Very low	26.6	Very low	86 Å²	86	135.8 Å²	135.8	58%	0.581	74%	0.735	S	S	*	*			trans	-102.6	61.4	172.1	-73.3	0	0	0	0	111.3	W774 Y778	W774-C776 PolarHBondContact O-N 3.45Å; C776-Y778 PolarHBondContact O-N 2.94Å; C776-Y778 VanDerWaalsContact O-N 3.13Å
777	D	21.8	Very low	26.5	Very low	134 Å²	134	134.7 Å²	134.7	72%	0.717	74%	0.735	S	S	*	*			trans	-70.7	101	163.5	-96.6	-45.8	0	0	0	109.2
778	Y	28.2	Very low	26.2	Very low	215 Å²	215	133.7 Å²	133.7	84%	0.843	74%	0.737	S	S	*	*			trans	-141.6	64.4	171.7	-131.5	-84.6	0	0	0	111.3	C776 D780	C776-Y778 PolarHBondContact O-N 2.94Å; C776-Y778 VanDerWaalsContact O-N 3.13Å; Y778-D780 VanDerWaalsContact C-N 3.31Å; Y778-D780 PolarHBondContact O-N 3.28Å
779	N	23.4	Very low	26.3	Very low	156 Å²	156	138.3 Å²	138.3	83%	0.834	75%	0.748	S	S	*	*			trans	-67	89.8	160.5	-90	-37.9	0	0	0	109.3
780	D	27.5	Very low	26.2	Very low	118 Å²	118	136.5 Å²	136.5	63%	0.631	74%	0.741	S	S	*	*			trans	-154.6	136.1	144.5	-130.1	-35	0	0	0	116.5	Y778	Y778-D780 VanDerWaalsContact C-N 3.31Å; Y778-D780 PolarHBondContact O-N 3.28Å
781	S	23.3	Very low	26.3	Very low	86 Å²	86	140.6 Å²	140.6	60%	0.601	76%	0.755	S	S	*	*			trans	8.3	99	159.6	47.1	0	0	0	0	121.3
782	Y	27.6	Very low	26.4	Very low	180 Å²	180	140.4 Å²	140.4	71%	0.706	76%	0.761	S	S	*	*			trans	-128.5	72.3	149.6	-78	-78.3	0	0	0	112	K486	K486-Y782 HydrophobicContact CD-CE1 4.38Å; K486-Y782 PolarHBondContact NZ-OH 3.35Å
783	T	22.4	Very low	26.3	Very low	137 Å²	137	144.4 Å²	144.4	84%	0.84	77%	0.767	S	S	*	*			trans	-101.5	107	171.6	37.3	0	0	0	0	110.9
784	V	27.1	Very low	26.4	Very low	122 Å²	122	143.3 Å²	143.3	74%	0.739	77%	0.77	S	S	*	*			trans	-127.3	104.4	175.7	-177	0	0	0	0	109.5
785	F	24.6	Very low	26.5	Very low	186 Å²	186	141.3 Å²	141.3	82%	0.816	78%	0.778	S	S	*	*			trans	40.6	92.2	168.8	-61.4	-72.1	0	0	0	119.2
786	T	28.1	Very low	26.7	Very low	131 Å²	131	145.1 Å²	145.1	80%	0.804	79%	0.789	S	S	*	*			trans	-129.9	124.2	141.5	53.8	0	0	0	0	108.9	T788	T786-T788 PolarHBondContact O-N 2.84Å
787	N	26.8	Very low	26.8	Very low	164 Å²	164	146.3 Å²	146.3	88%	0.877	80%	0.798	S	S	*	*			trans	-59.6	135.9	-176.1	-73.3	-5	0	0	0	111.8
788	T	25.4	Very low	27.2	Very low	135 Å²	135	144.7 Å²	144.7	83%	0.828	80%	0.797	S	S	*	*			trans	-91.8	120.3	177.1	48	0	0	0	0	111.3	T786	T786-T788 PolarHBondContact O-N 2.84Å
789	E	28.8	Very low	27.4	Very low	192 Å²	192	142 Å²	142	90%	0.897	80%	0.798	S	S	*	*			trans	-128.9	134.5	150	-76.9	-165.3	142	0	0	109.8
790	A	28	Very low	27.6	Very low	95 Å²	95	143.5 Å²	143.5	79%	0.785	80%	0.797	S	S	*	*			trans	24.6	117.5	166	0	0	0	0	0	120.7
791	L	27.7	Very low	27.8	Very low	173 Å²	173	146.9 Å²	146.9	91%	0.906	81%	0.808	S	S	*	*				-157.2	153.7	115.2	-96.7	159	0	0	0	108.6
792	P	28.7	Very low	27.8	Very low	121 Å²	121	148.4 Å²	148.4	79%	0.786	82%	0.819	S	S	*	*			trans	-92.6	171.1	-156.1	35.8	-38.1	0	0	0	116.8
793	K	26	Very low	27.9	Very low	210 Å²	210	145.9 Å²	145.9	91%	0.913	83%	0.828	S	S	*	*			trans	-81.9	154.4	174.8	-55.1	173.6	176.8	-179.9	0	112.9
794	A	28.4	Very low	28	Very low	93 Å²	93	144 Å²	144	77%	0.769	83%	0.826	S	S	*	*			trans	167.6	157.5	134.7	0	0	0	0	0	111.1
795	P	31.6	Very low	27.9	Very low	124 Å²	124	143.2 Å²	143.2	81%	0.805	83%	0.825	S	S	*	*			cis	-123.6	-162.2	-22.1	36.7	-18.4	0	0	0	112.2
796	E	28	Very low	27.8	Very low	190 Å²	190	145.3 Å²	145.3	89%	0.888	83%	0.828	S	S	*	*			trans	-91.8	161.1	-166	-59.4	136.4	126.9	0	0	116.1
797	S	30.5	Very low	27.8	Very low	111 Å²	111	148.6 Å²	148.6	78%	0.776	83%	0.831	S	S	*	*			trans	-148.8	144.2	138.8	64.7	0	0	0	0	111.5
798	S	29.2	Very low	27.7	Very low	100 Å²	100	145.6 Å²	145.6	70%	0.699	82%	0.823	S	S	*	*			trans	-31.5	153	168	24.3	0	0	0	0	117.1
799	D	32	Very low	27.7	Very low	159 Å²	159	149.4 Å²	149.4	85%	0.85	83%	0.828	S	S	*	*			cis	-150.7	175.4	11.8	-114.8	-40.9	0	0	0	114.8
800	K	28.6	Very low	27.8	Very low	187 Å²	187	146.7 Å²	146.7	81%	0.813	83%	0.825	S	S	*	*			trans	-112.2	141.2	-175.1	-60.8	169.8	-177.1	165.5	0	113.9
801	Q	30.2	Very low	27.8	Very low	188 Å²	188	145.7 Å²	145.7	88%	0.879	82%	0.824	S	S	*	*				169.6	124.2	127	-91.1	158.1	15.5	0	0	108.3
802	S	25.1	Very low	27.8	Very low	119 Å²	119	147.6 Å²	147.6	83%	0.832	83%	0.825	S	S	*	*			cis	82.5	82.3	37.1	-162.9	0	0	0	0	114.7
803	S	29.9	Very low	28	Very low	127 Å²	127	150.6 Å²	150.6	89%	0.888	83%	0.828	S	S	*	*			trans	-153.3	152	155.2	57.2	0	0	0	0	109.5
804	A	24.5	Very low	28.4	Very low	97 Å²	97	146 Å²	146	80%	0.802	82%	0.82	S	S	*	*			trans	-141.8	144.1	-170	0	0	0	0	0	112.7
805	C	24.5	Very low	28.4	Very low	106 Å²	106	152.3 Å²	152.3	72%	0.716	82%	0.824	S	S	*	*			trans	-168.6	128.5	153.4	-100.7	0	0	0	0	107.2
806	R	22.6	Very low	28.3	Very low	230 Å²	230	152.8 Å²	152.8	87%	0.868	83%	0.825	S	S	*	*				62.4	96	54.4	-169.1	-154.6	-69.9	-172.2	-0.3	112.3
807	F	26.7	Very low	28.3	Very low	200 Å²	200	147.9 Å²	147.9	88%	0.877	82%	0.816	S	S	*	*			trans	-140.5	162.2	163.3	-96.3	-73.8	0	0	0	113.3
808	S	24.5	Very low	28.5	Very low	100 Å²	100	148.4 Å²	148.4	70%	0.699	82%	0.817	S	S	*	*			trans	-121.7	151	-166.4	51.2	0	0	0	0	112.9	T810	S808-T810 PolarHBondContact O-N 3.38Å
809	F	26.8	Very low	28.5	Very low	215 Å²	215	151 Å²	151	94%	0.943	83%	0.828	S	S	*	*			trans	-70.3	113.7	174	-95.2	-96.8	0	0	0	113.1
810	T	30.6	Very low	28.3	Very low	135 Å²	135	154 Å²	154	83%	0.828	83%	0.827	S	S	*	*			trans	-152.2	117.9	149.9	47.8	0	0	0	0	108.7	S808	S808-T810 PolarHBondContact O-N 3.38Å
811	G	28	Very low	28.3	Very low	74 Å²	74	156.5 Å²	156.5	76%	0.763	83%	0.832	S	S	*	*			trans	-95.3	158.2	-178.9	0	0	0	0	0	114.3
812	K	28.3	Very low	28.3	Very low	214 Å²	214	152.5 Å²	152.5	93%	0.93	83%	0.825	S	S	*	*			trans	-158.4	135.1	163.7	-107.6	171.1	-178.1	179.9	0	110.8
813	H	31.6	Very low	28.7	Very low	183 Å²	183	153 Å²	153	85%	0.847	82%	0.823	S	S	*	*			trans	-86.1	157.3	172.2	-90.8	-61.2	0	0	0	111.5
814	P	34.8	Very low	28.7	Very low	114 Å²	114	152.3 Å²	152.3	74%	0.74	82%	0.818	S	S	*	*				-137.6	166.1	86.3	40.3	-24.3	0	0	0	112.4
815	R	27.4	Very low	29	Very low	226 Å²	226	152 Å²	152	85%	0.853	82%	0.816	S	S	*	*				57	131.3	53.5	-73.2	-170.7	-177	-172.6	1.8	112.1
816	T	31	Very low	29.4	Very low	134 Å²	134	154.4 Å²	154.4	82%	0.822	82%	0.821	S	S	*	*			cis	-159.6	179.7	1.5	-13.9	0	0	0	0	107
817	A	28	Very low	29.8	Very low	86 Å²	86	150.5 Å²	150.5	71%	0.711	82%	0.817	S	S	*	*			cis	-157.3	175.8	7.9	0	0	0	0	0	110.6
818	P	33.8	Very low	30	Very low	122 Å²	122	145.6 Å²	145.6	79%	0.792	81%	0.814	S	S	*	*			trans	-104.3	163.3	-172	39.2	-34.1	0	0	0	116.6
819	V	30.5	Very low	30.4	Very low	154 Å²	154	150.2 Å²	150.2	93%	0.933	82%	0.824	S	S	*	*			trans	-133.1	166.5	176.3	-178.8	0	0	0	0	111.4
820	R	26.6	Very low	30.8	Very low	222 Å²	222	148.4 Å²	148.4	84%	0.838	82%	0.818	S	S	*	*			trans	-107.4	147.9	-156.1	-68.3	172.3	166.1	171.6	-5	117.4
821	R	28.8	Very low	31	Very low	240 Å²	240	146.9 Å²	146.9	91%	0.906	81%	0.81	S	S	*	*			trans	37.6	133.2	135.1	-64.9	-177.6	172.9	179.6	-3.6	122.9
822	S	30.9	Very low	31.1	Very low	105 Å²	105	151.9 Å²	151.9	73%	0.734	81%	0.811	S	S	*	*				-144.4	126.2	127.6	40	0	0	0	0	107.1
823	T	31.8	Very low	31.2	Very low	128 Å²	128	150.3 Å²	150.3	79%	0.785	81%	0.807	S	S	*	*				43.5	131	93.1	61.1	0	0	0	0	113.8
824	S	31.4	Very low	31	Very low	114 Å²	114	148 Å²	148	80%	0.797	81%	0.806	S	S	*	*			cis	-173.4	162.2	12.7	22.7	0	0	0	0	109.1
825	A	30.8	Very low	30.7	Very low	91 Å²	91	152.1 Å²	152.1	75%	0.752	81%	0.812	S	S	*	*			cis	-171.1	-155.8	-12.2	0	0	0	0	0	108.5
826	L	32.4	Very low	31	Very low	155 Å²	155	148.6 Å²	148.6	81%	0.812	81%	0.809	S	S	*	*			trans	85.9	129.1	165.9	-65.4	171.4	0	0	0	120.6
827	D	31.4	Very low	30.6	Very low	149 Å²	149	149.9 Å²	149.9	80%	0.797	81%	0.806	S	S	*	*			trans	67.7	111.7	147.8	-51.2	-17.8	0	0	0	121.3
828	A	30.9	Very low	30.5	Very low	97 Å²	97	151.8 Å²	151.8	80%	0.802	80%	0.803	S	S	*	*			trans	-117.3	153.4	165	0	0	0	0	0	108.8
829	E	31.5	Very low	30.1	Very low	197 Å²	197	153.1 Å²	153.1	92%	0.921	80%	0.799	S	S	*	*			trans	-149.2	141.5	137.8	-124.1	175.5	-168.1	0	0	112.6
830	H	36	Very low	30	Very low	176 Å²	176	153.5 Å²	153.5	82%	0.815	79%	0.79	S	S	*	*			trans	-116.6	152.8	172.4	-121.9	8.4	0	0	0	105.5
831	P	35.8	Very low	30	Very low	103 Å²	103	148.1 Å²	148.1	67%	0.669	78%	0.782	S	S	*	*				-156.1	152.5	103.8	35.3	-15.8	0	0	0	118.9
832	K	29.4	Very low	29.9	Very low	179 Å²	179	142.5 Å²	142.5	78%	0.778	77%	0.774	S	S	*	*			trans	63.1	107.2	133.7	-64.6	165.9	-169.8	169.2	0	120.5
833	E	29.6	Very low	29.7	Very low	182 Å²	182	142.9 Å²	142.9	85%	0.85	78%	0.777	S	S	*	*				19.1	132.9	121	-57.8	-177.7	115.7	0	0	119.7
834	T	29.1	Very low	29.6	Very low	134 Å²	134	146.8 Å²	146.8	82%	0.822	78%	0.779	S	S	*	*			trans	-140.9	134.5	139.9	-25.7	0	0	0	0	108.8
835	K	27.6	Very low	29.4	Very low	200 Å²	200	146.4 Å²	146.4	87%	0.87	78%	0.776	S	S	*	*			trans	-118.7	101.1	-171.9	-178.1	-173.6	-178.5	-174.6	0	108.4
836	I	32.8	Very low	29.3	Very low	153 Å²	153	148 Å²	148	79%	0.785	78%	0.779	S	S	*	*			trans	-125.4	150.8	178.6	-61.6	-176.6	0	0	0	109.8
837	E	24.1	Very low	29.4	Very low	161 Å²	161	145.6 Å²	145.6	75%	0.752	78%	0.775	S	S	*	*			trans	-90.8	164.9	-156	-62.7	175.8	96.3	0	0	115.8
838	L	26	Very low	29.5	Very low	125 Å²	125	147.3 Å²	147.3	65%	0.654	78%	0.78	S	S	*	*			trans	58.7	133.4	137	-73.9	164.9	0	0	0	122.5
839	Q	24.2	Very low	29.4	Very low	151 Å²	151	151.7 Å²	151.7	71%	0.706	78%	0.784	S	S	*	*			trans	70.9	175.4	145.1	-68.1	172.1	-1.1	0	0	118.2
840	H	28.7	Very low	29.5	Very low	162 Å²	162	148.1 Å²	148.1	75%	0.75	77%	0.771	S	S	*	*			trans	69.3	133.3	169.3	-64.5	-69.5	0	0	0	119.2
841	T	26.5	Very low	29.5	Very low	109 Å²	109	148 Å²	148	67%	0.669	77%	0.768	S	S	*	*			cis	-151.4	156	-28.1	-39.6	0	0	0	0	108	S843	T841-S843 PolarHBondContact O-N 3.38Å
842	V	26.9	Very low	29.4	Very low	122 Å²	122	154.8 Å²	154.8	74%	0.739	80%	0.798	S	S	*	*			trans	-73.6	101.4	159.3	179.3	0	0	0	0	108.5	Y844	V842-Y844 HydrophobicContact CG1-CD2 3.92Å; V842-Y844 HydrophobicContact CG1-CE2 4.28Å; V842-Y844 PolarHBondContact O-N 3.17Å; V842-Y844 VanDerWaalsContact O-N 3.11Å
843	S	27	Very low	29.4	Very low	113 Å²	113	153.6 Å²	153.6	79%	0.79	80%	0.799	S	S	*	*			trans	-82.8	78	176.8	41.9	0	0	0	0	112	T841	T841-S843 PolarHBondContact O-N 3.38Å
844	Y	29	Very low	29.4	Very low	210 Å²	210	152.1 Å²	152.1	82%	0.824	80%	0.796	S	S	*	*			trans	-63.2	130.8	153	-93.5	-87.5	0	0	0	108.8	V842 P846	V842-Y844 HydrophobicContact CG1-CD2 3.92Å; V842-Y844 HydrophobicContact CG1-CE2 4.28Å; V842-Y844 PolarHBondContact O-N 3.17Å; V842-Y844 VanDerWaalsContact O-N 3.11Å; Y844-P846 VanDerWaalsContact O-CD 3.23Å; Y844-P846 WeakPolarHBondContact O-CD 3.49Å
845	S	28.4	Very low	29.4	Very low	106 Å²	106	153.1 Å²	153.1	74%	0.741	80%	0.795	S	S	*	*			trans	-104.1	94.7	168.2	58.1	0	0	0	0	109.8	S847	S845-S847 PolarHBondContact O-N 3.02Å
846	P	29.1	Very low	29.5	Very low	124 Å²	124	150.4 Å²	150.4	81%	0.805	79%	0.79	S	S	*	*			trans	-77.9	117.7	169.9	31.3	-31.5	0	0	0	109.3	Y844	Y844-P846 VanDerWaalsContact O-CD 3.23Å; Y844-P846 WeakPolarHBondContact O-CD 3.49Å
847	S	34.4	Very low	29.3	Very low	104 Å²	104	150.2 Å²	150.2	73%	0.727	79%	0.791	S	S	*	*			trans	-139.8	98.5	171.3	63.8	0	0	0	0	111.8	S845	S845-S847 PolarHBondContact O-N 3.02Å
848	M	31.8	Very low	29.6	Very low	185 Å²	185	149.5 Å²	149.5	91%	0.911	79%	0.793	S	S	*	*			trans	52.6	108.6	147.4	-67.4	-64.8	-175.2	0	0	118.9
849	E	29.3	Very low	29.9	Very low	190 Å²	190	151.2 Å²	151.2	89%	0.888	80%	0.803	S	S	*	*			trans	-60.2	133.5	144.6	-58.8	160	114.8	0	0	109.6
850	D	33.1	Very low	30.3	Very low	122 Å²	122	151.2 Å²	151.2	65%	0.652	81%	0.811	S	S	*	*			trans	-161.2	131.3	143.9	-149.4	-2.2	0	0	0	111.5
851	K	37.2	Very low	30.4	Very low	173 Å²	173	150.3 Å²	150.3	75%	0.752	82%	0.816	S	S	*	*			trans	56.7	77.3	165.5	-63.5	140	-171.2	156.4	0	119.8
852	L	32.8	Very low	30.8	Very low	246 Å²	246	154.1 Å²	154.1	100%	1.288	83%	0.829	S	S	*	*				-169.2	0	108.4	-118.6	164.1	0	0	0	113.3

Retrieved 852 of 852 residues in 273.8 ms (Link to these results)

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