A0A087X8W5_POEFO Loading...

C-Maf-inducing protein

AlphaFold DB (A0A3B3UL47), UniProt , Accession A0A087X8W5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 811 aa.

						>A0A087X8W5_POEFO|A0A087X8W5
MDYNSGGGGPNELHNNQFYQCEESKPLLGEMSEGNNNTKLGAGPCRRSLHHCSSSGMRYKLLPEGDIQVCVVKHPRTFLSKLLTSKYLRRWEPHHLTLTDSGLSSATPTGYMETTLSYSSIEDLQLLSWDNAPKYCIQLSIPGGTILLQAANSYLRDQWFHSLQWKKKIYKYRKVLNNPSRWDVVLKEIRALVDMALTSPLQDESIHQAPLHIISTLLAENSNLSAQDHENIIVAIAPLLENNHPPPDLCEFFCKHCRERPRSMVVIEVFTPVVQRILKHNMDFGKCPRLRLFTQEYILALNELNGGMEVVKKFIHSMHGPTGQCPHPRVLPNLVAVCLAAIYSCYEEFINSRDNSPSLKEIRNGCQQQNDRKPPMPLRLLRPEPPTPPPSTILPLSSAPQPSPPAPANPAAPSIPICSPTPCLPLSPPPSIVNSSEILVELERNNNTANAKRKGGPAGGDSEPNLIDCLLVSPALNTLSIQLPAQADRVLGCFALILKMLSDYDDWRPALASLLQPIPFPKEALAHAKFTKELKYVIQRFAEDPRQEVHSCLLSVRSGKDGWFQLYSPGGVACDDDGELFASMVHILMGSCYKTKKFLLSLAENKLGPCMLLALRGNQTMVEILCLMLEYNIIENKDTQLQIISTLQSTQVGFRMYEQLCDRQRELKELQRKGGPTRLTLPSKSTDADLARLLSSGSFGNLENLSLAFTNVTSACAEQLIKLPSLKQLNLWSTQFGDAGLRLLSEHLACLQVLNLCETPVTDAGLLALSSMKSLCSLNMNSTKLTADTYEDLKAKLPNLKDVDVRYTEAW
					

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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	30.5	Very low	27.5	Very low	231 Å²	231	135.1 Å²	135.1	100%	1.138	86%	0.862	S	S	*	*				0	107	0	-60.9	168.2	-179	0	0	106.5
2	D	27.6	Very low	27.3	Very low	156 Å²	156	139 Å²	139	83%	0.834	86%	0.861	S	S	*	*			cis	-140.7	155.7	0.9	-76.2	-44.7	0	0	0	112.3
3	Y	26.2	Very low	27.2	Very low	212 Å²	212	141.5 Å²	141.5	83%	0.831	86%	0.864	S	S	*	*			trans	-82.9	146.7	171.9	-89.1	-110.5	0	0	0	110.3
4	N	28	Very low	27	Very low	169 Å²	169	143.7 Å²	143.7	90%	0.904	86%	0.859	S	S	*	*				-155.5	157	122.1	-132.1	-20.4	0	0	0	113.7
5	S	28.2	Very low	26.8	Very low	100 Å²	100	143.2 Å²	143.2	70%	0.699	85%	0.85	S	S	*	*			trans	-122.7	158.8	-160.7	-60.7	0	0	0	0	114.3
6	G	26.2	Very low	26.6	Very low	84 Å²	84	142.3 Å²	142.3	87%	0.866	84%	0.84	S	S	*	*			trans	103	137	156.7	0	0	0	0	0	115.5
7	G	24.8	Very low	26.4	Very low	82 Å²	82	142.7 Å²	142.7	85%	0.845	83%	0.832	S	S	*	*			cis	167.1	163.3	-7.6	0	0	0	0	0	112.4
8	G	24.5	Very low	26.2	Very low	85 Å²	85	145.4 Å²	145.4	88%	0.876	83%	0.832	S	S	*	*			trans	96.2	99.5	155.1	0	0	0	0	0	119.7
9	G	24.6	Very low	26.1	Very low	77 Å²	77	149.3 Å²	149.3	79%	0.794	83%	0.833	S	S	*	*			trans	93.8	145	133.8	0	0	0	0	0	118.5
10	P	37	Very low	25.9	Very low	121 Å²	121	151.3 Å²	151.3	79%	0.786	84%	0.836	S	S	*	*			trans	-103.2	161.1	-167.6	39.8	-34.8	0	0	0	114.3
11	N	24.9	Very low	25.7	Very low	169 Å²	169	150.2 Å²	150.2	90%	0.904	84%	0.837	S	S	*	*			trans	-156.2	141.3	141.5	-103.2	-29.5	0	0	0	111.1
12	E	25.1	Very low	25.4	Very low	182 Å²	182	148 Å²	148	85%	0.85	83%	0.825	S	S	*	*			trans	-70	151.7	173	-54.5	174.5	133.4	0	0	110.7
13	L	25.8	Very low	25.3	Very low	172 Å²	172	149.7 Å²	149.7	90%	0.901	83%	0.827	S	S	*	*			trans	-172.8	143.7	131.7	-101.6	161.2	0	0	0	111.2
14	H	25.2	Very low	25.3	Very low	172 Å²	172	145 Å²	145	80%	0.796	83%	0.826	S	S	*	*			trans	-62.5	139	179.3	-76.5	36.7	0	0	0	111.9
15	N	23.9	Very low	25.3	Very low	136 Å²	136	146 Å²	146	73%	0.727	82%	0.822	S	S	*	*			trans	-121.1	91.4	162.5	-157.3	5.8	0	0	0	110.5	Q17	N15-Q17 VanDerWaalsContact C-N 3.35Å; N15-Q17 PolarHBondContact O-N 2.77Å
16	N	22.7	Very low	25.3	Very low	128 Å²	128	147 Å²	147	68%	0.684	83%	0.826	S	S	*	*			trans	-71	90.1	168.3	-85.6	-18.6	0	0	0	108.9	F18	N16-F18 PolarHBondContact O-N 3.39Å; N16-F18 VanDerWaalsContact O-N 3.12Å
17	Q	23.4	Very low	25.7	Very low	150 Å²	150	147.4 Å²	147.4	70%	0.701	81%	0.808	S	S	*	*			trans	-71	105.2	165.8	-77.3	-175	-19.6	0	0	109.2	N15 Y19	N15-Q17 VanDerWaalsContact C-N 3.35Å; N15-Q17 PolarHBondContact O-N 2.77Å; Q17-Y19 PolarHBondContact O-N 3.17Å; Q17-Y19 VanDerWaalsContact O-N 3.16Å
18	F	22.9	Very low	26	Very low	192 Å²	192	150.9 Å²	150.9	84%	0.842	81%	0.806	S	S	*	*			trans	-62.4	110.1	167.9	-85.2	-101.1	0	0	0	109.4	N16 Q20	N16-F18 PolarHBondContact O-N 3.39Å; N16-F18 VanDerWaalsContact O-N 3.12Å; F18-Q20 PolarHBondContact O-N 2.81Å
19	Y	23.6	Very low	26.1	Very low	218 Å²	218	150.1 Å²	150.1	86%	0.855	80%	0.798	S	S	*	*			trans	-65.3	126.8	162	-83.1	-93.9	0	0	0	109.1	Q17 C21	Q17-Y19 PolarHBondContact O-N 3.17Å; Q17-Y19 VanDerWaalsContact O-N 3.16Å; Y19-C21 PolarHBondContact O-N 2.84Å
20	Q	22	Very low	26.5	Very low	190 Å²	190	155.7 Å²	155.7	89%	0.888	80%	0.804	S	S	*	*			trans	-67	126.7	169.9	-72.8	176.7	-38.7	0	0	108.9	F18	F18-Q20 PolarHBondContact O-N 2.81Å
21	C	22.8	Very low	25.9	Very low	128 Å²	128	159.2 Å²	159.2	87%	0.865	81%	0.812	S	S	*	*			trans	-85.3	113.4	175.4	-159.9	0	0	0	0	108.4	Y19	Y19-C21 PolarHBondContact O-N 2.84Å
22	E	23.9	Very low	26	Very low	186 Å²	186	156.9 Å²	156.9	87%	0.869	81%	0.809	S	S	*	*			trans	-67.2	143.1	175.1	-72.4	-168	132.1	0	0	111.6	S24	E22-S24 PolarHBondContact O-N 2.94Å
23	E	25.2	Very low	26	Very low	190 Å²	190	157.6 Å²	157.6	89%	0.888	81%	0.812	S	S	*	*			trans	-65.5	113.7	-177.8	-66.7	-179.1	123	0	0	112	K25	E23-K25 PolarHBondContact O-N 3.4Å; E23-K25 VanDerWaalsContact O-N 3.13Å
24	S	26.6	Very low	25.9	Very low	114 Å²	114	152.8 Å²	152.8	80%	0.797	81%	0.805	S	S	*	*			trans	-66.1	108.8	170.5	54.6	0	0	0	0	111.2	E22	E22-S24 PolarHBondContact O-N 2.94Å
25	K	28.7	Very low	25.9	Very low	191 Å²	191	152 Å²	152	83%	0.83	81%	0.806	S	S	*	*			trans	-61.5	147	172.9	-71.7	176.7	179	172.7	0	111.6	E23	E23-K25 PolarHBondContact O-N 3.4Å; E23-K25 VanDerWaalsContact O-N 3.13Å
26	P	28.2	Very low	25.9	Very low	121 Å²	121	153 Å²	153	79%	0.786	81%	0.811	S	S	*	*			trans	-67	151.1	176.4	28.3	-34.6	0	0	0	112.5	L28	P26-L28 VanDerWaalsContact C-N 3.26Å; P26-L28 PolarHBondContact O-N 3.36Å
27	L	34.1	Very low	26	Very low	92 Å²	92	154.3 Å²	154.3	48%	0.482	82%	0.818	S	S	.	*	S	Bend	trans	-76	11.3	-164.2	-83.8	167.5	0	0	0	117.1	K313	L27-K313 HydrophobicContact CD2-CB 3.9Å; L27-K313 HydrophobicContact CD2-CD 4.21Å; L27-K313 HydrophobicContact CD2-CG 4.47Å
28	L	31.3	Very low	26.1	Very low	154 Å²	154	154.2 Å²	154.2	81%	0.806	83%	0.828	S	S	*	*			trans	-133.7	110.2	-176.6	-79.6	164.7	0	0	0	111.4	P26	P26-L28 VanDerWaalsContact C-N 3.26Å; P26-L28 PolarHBondContact O-N 3.36Å
29	G	26.8	Very low	26.1	Very low	69 Å²	69	155 Å²	155	71%	0.711	83%	0.831	S	S	*	*			trans	-127	143.1	163.3	0	0	0	0	0	109.3
30	E	32	Very low	26.1	Very low	195 Å²	195	153 Å²	153	91%	0.911	84%	0.835	S	S	*	*			trans	63.4	90.6	172	-57.8	-174.4	171.1	0	0	117.8
31	M	24.9	Very low	26.3	Very low	195 Å²	195	148 Å²	148	96%	0.961	83%	0.833	S	S	*	*			trans	-148.5	134.1	135.2	-81.8	-155.9	167.6	0	0	111.4
32	S	27	Very low	26.3	Very low	119 Å²	119	146.8 Å²	146.8	83%	0.832	83%	0.833	S	S	*	*			trans	75.2	94.8	165.9	-153.9	0	0	0	0	119.3
33	E	24.9	Very low	26.3	Very low	197 Å²	197	140.9 Å²	140.9	92%	0.921	82%	0.822	S	S	*	*			trans	-71.6	144.3	143.1	-69.8	-170.2	131	0	0	110.3
34	G	24.9	Very low	26.3	Very low	72 Å²	72	137.8 Å²	137.8	74%	0.742	82%	0.818	S	S	*	*			trans	170.4	106.7	176.4	0	0	0	0	0	113.3
35	N	23.2	Very low	26.1	Very low	155 Å²	155	138.5 Å²	138.5	83%	0.829	82%	0.822	S	S	*	*			trans	-54.5	135.6	-179.8	-93.5	-14.5	0	0	0	113.9
36	N	25	Very low	25.9	Very low	156 Å²	156	140.7 Å²	140.7	83%	0.834	83%	0.825	S	S	*	*				-172.4	151.3	107.6	-94.2	-36.1	0	0	0	114.2
37	N	24.5	Very low	25.7	Very low	156 Å²	156	146 Å²	146	83%	0.834	83%	0.829	S	S	*	*			trans	-73	131.1	-173.5	-74.7	-59.1	0	0	0	114.1
38	T	24.9	Very low	25.1	Very low	148 Å²	148	146 Å²	146	91%	0.908	84%	0.836	S	S	*	*			trans	-152.7	139.4	134.7	10.7	0	0	0	0	109.7
39	K	23.7	Very low	24.8	Very low	209 Å²	209	146.7 Å²	146.7	91%	0.909	84%	0.84	S	S	*	*			trans	-115.3	97.5	-157.5	-169.1	-178.5	-172.6	178.7	0	111.5
40	L	24.3	Very low	24.6	Very low	177 Å²	177	150.9 Å²	150.9	93%	0.927	84%	0.841	S	S	*	*			trans	-137.2	112	165.3	-93.6	164.6	0	0	0	108.3
41	G	25.6	Very low	24.4	Very low	83 Å²	83	150 Å²	150	86%	0.856	84%	0.836	S	S	*	*			trans	-89.9	127.3	-166.8	0	0	0	0	0	114
42	A	23.7	Very low	24.4	Very low	103 Å²	103	145.9 Å²	145.9	85%	0.851	83%	0.826	S	S	*	*			trans	-136.9	97.6	156.4	0	0	0	0	0	107.6
43	G	23.8	Very low	24.6	Very low	63 Å²	63	145.3 Å²	145.3	65%	0.649	82%	0.822	S	S	*	*			trans	-70.4	148.6	178.7	0	0	0	0	0	111.4	C45	G43-C45 PolarHBondContact O-N 3.46Å
44	P	24.2	Very low	25	Very low	124 Å²	124	141 Å²	141	81%	0.805	81%	0.813	S	S	*	*			trans	-64.8	123.9	177.8	26.8	-33.4	0	0	0	110	R46	P44-R46 PolarHBondContact O-N 2.96Å
45	C	23	Very low	25.5	Very low	129 Å²	129	143.9 Å²	143.9	87%	0.872	82%	0.822	S	S	*	*			trans	-71.1	69.6	176	-78.3	0	0	0	0	111.8	G43 R47	G43-C45 PolarHBondContact O-N 3.46Å; C45-R47 PolarHBondContact O-N 3.11Å
46	R	24.3	Very low	26.9	Very low	238 Å²	238	138.8 Å²	138.8	90%	0.898	81%	0.806	S	S	*	*			trans	-65.2	78.6	152.8	-80.9	-169.4	172.3	-147.1	-2.9	108.3	P44 S48	P44-R46 PolarHBondContact O-N 2.96Å; R46-S48 PolarHBondContact O-N 2.68Å
47	R	23.2	Very low	28.5	Very low	233 Å²	233	137.9 Å²	137.9	88%	0.879	80%	0.799	S	S	*	*			trans	-65.2	113.5	151.8	-86.4	-173.9	174.9	176.7	-1.6	105.8	C45 L49	C45-R47 PolarHBondContact O-N 3.11Å; R47-L49 PolarHBondContact O-N 3.23Å; R47-L49 VanDerWaalsContact O-N 3.14Å
48	S	21.3	Very low	30.8	Very low	90 Å²	90	138 Å²	138	63%	0.629	79%	0.787	S	S	*	*			trans	-48.5	122	157.9	40.4	0	0	0	0	107.6	R46 H50	R46-S48 PolarHBondContact O-N 2.68Å; S48-H50 PolarHBondContact O-N 3.19Å
49	L	25.7	Very low	33.4	Very low	169 Å²	169	131.9 Å²	131.9	89%	0.885	75%	0.748	S	S	*	*			trans	-63.8	87.3	160.2	-86.4	158.1	0	0	0	106.2	R47 H51	R47-L49 PolarHBondContact O-N 3.23Å; R47-L49 VanDerWaalsContact O-N 3.14Å; L49-H51 VanDerWaalsContact C-N 3.25Å; L49-H51 PolarHBondContact O-N 3.11Å
50	H	23.3	Very low	36.1	Very low	157 Å²	157	128 Å²	128	73%	0.727	73%	0.731	S	S	*	*			trans	-55.2	106.6	149.1	-87.6	-74.1	0	0	0	105.2	S48 C52	S48-H50 PolarHBondContact O-N 3.19Å; H50-C52 PolarHBondContact O-N 2.88Å
51	H	27.9	Very low	38.9	Very low	176 Å²	176	120.7 Å²	120.7	82%	0.815	69%	0.693	S	S	*	*			trans	-53.9	92.6	151.5	-94.4	-52.5	0	0	0	106.3	L49 S53	L49-H51 VanDerWaalsContact C-N 3.25Å; L49-H51 PolarHBondContact O-N 3.11Å; H51-S53 PolarHBondContact O-N 3.25Å
52	C	24.7	Very low	41.6	Very low	109 Å²	109	117.6 Å²	117.6	74%	0.736	66%	0.656	S	S	*	*			trans	-66	84.6	155.7	-84.2	0	0	0	0	105.9	H50 S54	H50-C52 PolarHBondContact O-N 2.88Å; C52-S54 PolarHBondContact O-N 2.69Å
53	S	31.2	Very low	44.2	Very low	107 Å²	107	116.9 Å²	116.9	75%	0.748	64%	0.643	S	S	*	*			trans	-61.8	73.2	155.8	-58.6	0	0	0	0	107.7	H51 S55	H51-S53 PolarHBondContact O-N 3.25Å; S53-S55 VanDerWaalsContact C-N 3.28Å; S53-S55 PolarHBondContact O-N 2.82Å
54	S	31.8	Very low	47.1	Very low	106 Å²	106	119.3 Å²	119.3	74%	0.741	64%	0.637	S	S	*	*			trans	-66.3	97.6	166.1	50.5	0	0	0	0	106.6	C52 G56	C52-S54 PolarHBondContact O-N 2.69Å; S54-G56 PolarHBondContact O-N 3.21Å
55	S	36.4	Very low	49.9	Very low	133 Å²	133	114 Å²	114	93%	0.93	61%	0.606	S	S	*	*			trans	-69.5	67.8	174.9	-169.8	0	0	0	0	109.6	S53	S53-S55 VanDerWaalsContact C-N 3.28Å; S53-S55 PolarHBondContact O-N 2.82Å
56	G	51.8	Low	52.8	Low	48 Å²	48	113.9 Å²	113.9	50%	0.495	60%	0.596	S	S	.	*			trans	-126.2	146.8	-179.8	0	0	0	0	0	110.4	S54 R58	S54-G56 PolarHBondContact O-N 3.21Å; G56-R58 PolarHBondContact O-N 3.28Å
57	M	60.2	Low	55.7	Low	138 Å²	138	102.9 Å²	102.9	68%	0.68	56%	0.555	S	S	*	*			trans	-60.8	134.8	172.5	-67.7	-168.9	178.1	0	0	109.8	Y59	M57-Y59 HydrophobicContact CB-CE1 4.34Å; M57-Y59 HydrophobicContact CB-CE2 4.36Å; M57-Y59 WeakPolarHBondContact O-CD2 3.3Å; M57-Y59 WeakPolarHBondContact O-CE2 3.48Å
58	R	72.4	Confident	58.6	Low	158 Å²	158	96 Å²	96	60%	0.596	53%	0.533	S	S	*	.			trans	-102.3	131.3	179.7	-62.8	-159.5	-68.8	156.9	-0	109.8	G56 P200 Q202	G56-R58 PolarHBondContact O-N 3.28Å; R58-P200 WeakPolarHBondContact CA-O 3.42Å; R58-Q202 HydrophobicContact CB-CG 4Å; R58-Q202 VanDerWaalsContact NH1-CD 3.35Å
59	Y	79	Confident	61.5	Low	20 Å²	20	91.8 Å²	91.8	8%	0.078	50%	0.504	C	S	.	.	B	Isolated β-bridge	trans	-111.4	150.8	-169.3	-55.8	-83.2	0	0	0	111.8	M57 Y154 D157 Q158 H161 P200 L201 Q202	M57-Y59 HydrophobicContact CB-CE1 4.34Å; M57-Y59 HydrophobicContact CB-CE2 4.36Å; M57-Y59 WeakPolarHBondContact O-CD2 3.3Å; M57-Y59 WeakPolarHBondContact O-CE2 3.48Å; Y59-Y154 AromaticContact CD1-CD2 3.83Å; Y59-Y154 HydrophobicContact CD1-CD2 3.83Å; Y59-Y154 HydrophobicContact CD1-CE1 4.47Å; Y59-Y154 AromaticContact CD1-CE2 3.51Å; Y59-Y154 HydrophobicContact CD1-CE2 3.51Å; Y59-Y154 HydrophobicContact CD1-CG 4.43Å; Y59-Y154 AromaticContact CD1-CZ 3.87Å; Y59-Y154 AromaticContact CE1-CD2 3.59Å; Y59-Y154 HydrophobicContact CE1-CD2 3.59Å; Y59-Y154 AromaticContact CE1-CE2 3.71Å; Y59-Y154 HydrophobicContact CE1-CE2 3.71Å; Y59-Y154 HydrophobicContact CE1-CG 4.25Å; Y59-D157 HydrophobicContact CE1-CB 3.69Å; Y59-D157 HydrophobicContact CE2-CB 4.12Å; Y59-D157 VanDerWaalsContact CZ-CB 3.45Å; Y59-D157 WeakPolarHBondContact OH-CB 3.26Å; Y59-Q158 HydrophobicContact CD1-CB 3.97Å; Y59-Q158 HydrophobicContact CG-CB 4.41Å; Y59-H161 AromaticContact CD2-CD2 3.55Å; Y59-H161 AromaticContact CE2-CD2 3.59Å; Y59-H161 AromaticContact CE2-NE2 3.88Å; Y59-P200 PolarHBondContact N-O 2.86Å; Y59-L201 CarbonylContact O-C 3.59Å; Y59-L201 WeakPolarHBondContact O-CA 3.43Å; Y59-Q202 PolarHBondContact O-N 3.22Å
60	K	81.4	Confident	64.1	Low	128 Å²	128	84 Å²	84	56%	0.557	46%	0.463	S	S	*	.			trans	-84	143.3	170.9	-174.9	176	177.1	178.4	0	110.5	L62 Q158	K60-L62 PolarHBondContact O-N 2.82Å; K60-Q158 VanDerWaalsContact O-CG 3.26Å; K60-Q158 WeakPolarHBondContact O-CG 3.21Å; K60-Q158 PolarHBondContact O-NE2 3.33Å
61	L	82	Confident	66.6	Low	22 Å²	22	77.7 Å²	77.7	12%	0.115	44%	0.436	C	S	.	.			trans	-60.6	127.2	171.5	-176.6	67	0	0	0	109.8	P63 W165 L201 D203 I206	L61-P63 WeakPolarHBondContact O-CD 3.39Å; L61-W165 HydrophobicContact CD1-CG 4.47Å; L61-L201 HydrophobicContact CD1-CD1 4.24Å; L61-D203 HydrophobicContact CB-CB 3.96Å; L61-I206 HydrophobicContact CB-CD1 4.43Å
62	L	82	Confident	68.8	Low	18 Å²	18	69.7 Å²	69.7	9%	0.094	40%	0.399	C	S	.	.			trans	-100.4	111.6	-177.3	-172.1	141.1	0	0	0	110	K60 E64 L98 Q158 W159 S162	K60-L62 PolarHBondContact O-N 2.82Å; L62-E64 VanDerWaalsContact CD2-O 3.25Å; L62-E64 WeakPolarHBondContact CD2-O 3.48Å; L62-E64 WeakPolarHBondContact CG-O 3.36Å; L62-L98 WeakPolarHBondContact O-CD1 3.43Å; L62-Q158 HydrophobicContact CB-CG 4.17Å; L62-Q158 HydrophobicContact CD1-CG 4.38Å; L62-W159 HydrophobicContact CD2-CD2 3.83Å; L62-W159 VanDerWaalsContact CD2-CE2 3.49Å; L62-W159 HydrophobicContact CD2-CE3 3.94Å; L62-W159 HydrophobicContact CD2-CH2 3.43Å; L62-W159 VanDerWaalsContact CD2-CH2 3.43Å; L62-W159 HydrophobicContact CD2-CZ2 3.32Å; L62-W159 HydrophobicContact CD2-CZ3 3.75Å; L62-S162 PolarHBondContact N-OG 2.79Å; L62-S162 VanDerWaalsContact N-OG 3.08Å
63	P	79	Confident	70.8	Confident	89 Å²	89	71.6 Å²	71.6	58%	0.578	40%	0.395	S	S	*	.	S	Bend	trans	-80.9	-33.5	-179.8	31.6	-33.7	0	0	0	112.3	L61 L98	L61-P63 WeakPolarHBondContact O-CD 3.39Å; P63-L98 PolarHBondContact O-N 3.22Å
64	E	84.8	Confident	72.4	Confident	113 Å²	113	71.4 Å²	71.4	53%	0.528	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.5	157.8	-179.5	69.5	-168.9	179.2	0	0	111.3	L62 L96 T97	L62-E64 VanDerWaalsContact CD2-O 3.25Å; L62-E64 WeakPolarHBondContact CD2-O 3.48Å; L62-E64 WeakPolarHBondContact CG-O 3.36Å; E64-L96 CarbonylContact C-O 3.59Å; E64-L96 WeakPolarHBondContact CA-O 3.39Å; E64-T97 HydrophobicContact CB-CG2 3.8Å
65	G	83.6	Confident	73.7	Confident	13 Å²	13	70.4 Å²	70.4	13%	0.134	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	171.2	166.7	172.8	0	0	0	0	0	114.8	L96	G65-L96 PolarHBondContact N-O 2.94Å; G65-L96 PolarHBondContact O-N 3.35Å
66	D	83.7	Confident	74.8	Confident	127 Å²	127	69.7 Å²	69.7	68%	0.679	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.7	178.4	-56	-51.8	0	0	0	111.5	H95	D66-H95 IonicContact OD1-CE1 2.68Å; D66-H95 IonicContact OD1-CG 2.77Å; D66-H95 IonicContact OD1-ND1 2.7Å; D66-H95 PolarHBondContact OD1-ND1 2.8Å
67	I	85.3	Confident	74.9	Confident	7 Å²	7	72.7 Å²	72.7	4%	0.036	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.6	145.7	178	-163.6	156	0	0	0	110.6	V69 H94 L96 L148 Q149 A150 W159	I67-V69 HydrophobicContact CG2-CG2 4.43Å; I67-H94 PolarHBondContact N-O 3.26Å; I67-H94 PolarHBondContact O-N 2.82Å; I67-L96 HydrophobicContact CG2-CB 4.23Å; I67-L96 HydrophobicContact CG2-CD1 3.5Å; I67-L96 HydrophobicContact CG2-CG 3.64Å; I67-L148 HydrophobicContact CD1-CB 3.63Å; I67-L148 HydrophobicContact CG1-CB 4.09Å; I67-Q149 VanDerWaalsContact CG1-O 3.31Å; I67-Q149 WeakPolarHBondContact CG1-O 3.42Å; I67-A150 HydrophobicContact CD1-CB 4.42Å; I67-W159 HydrophobicContact CB-CZ2 4.23Å; I67-W159 HydrophobicContact CD1-CD2 3.91Å; I67-W159 HydrophobicContact CD1-CG 3.84Å; I67-W159 HydrophobicContact CD1-CZ2 4.47Å; I67-W159 HydrophobicContact CG2-CZ2 4.18Å
68	Q	83.3	Confident	74.9	Confident	89 Å²	89	71.9 Å²	71.9	42%	0.416	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129.6	176.4	-67.3	-179.4	-2.4	0	0	109.4	W91 L148 Q149	Q68-W91 HydrophobicContact CB-CD2 4.47Å; Q68-W91 HydrophobicContact CB-CE3 3.81Å; Q68-W91 HydrophobicContact CB-CZ3 4.49Å; Q68-W91 WeakPolarHBondContact O-CZ3 3.43Å; Q68-L148 CarbonylContact O-C 3.59Å; Q68-L148 WeakPolarHBondContact O-CA 3.42Å; Q68-Q149 HydrophobicContact CB-CB 4.18Å; Q68-Q149 PolarHBondContact N-O 2.85Å; Q68-Q149 VanDerWaalsContact N-O 3.16Å; Q68-Q149 PolarHBondContact O-N 2.97Å
69	V	82.4	Confident	74.4	Confident	1 Å²	1	64.6 Å²	64.6	1%	0.006	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	136.9	-178.8	-170.3	0	0	0	0	109.7	I67 V71 W91 E92 H94 L96 M112 I146 L147 L148	I67-V69 HydrophobicContact CG2-CG2 4.43Å; V69-V71 HydrophobicContact CG1-CG2 4.16Å; V69-W91 WeakPolarHBondContact O-CA 3.25Å; V69-E92 PolarHBondContact N-O 3.43Å; V69-E92 PolarHBondContact O-N 3.2Å; V69-H94 HydrophobicContact CG2-CB 4.03Å; V69-L96 HydrophobicContact CG2-CD1 4.12Å; V69-M112 HydrophobicContact CG1-CG 4.36Å; V69-M112 HydrophobicContact CG1-SD 4.31Å; V69-M112 HydrophobicContact CG2-SD 4.18Å; V69-I146 HydrophobicContact CG1-CG2 3.7Å; V69-L147 WeakPolarHBondContact CA-O 3.33Å; V69-L148 HydrophobicContact CB-CD2 4.36Å; V69-L148 HydrophobicContact CG1-CD2 4.07Å; V69-L148 HydrophobicContact CG2-CD2 3.78Å
70	C	79.8	Confident	73.5	Confident	4 Å²	4	65.9 Å²	65.9	3%	0.027	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	130.2	170	-174.7	0	0	0	0	109.3	R90 W91 L147	C70-R90 PolarHBondContact SG-O 3.05Å; C70-W91 HydrophobicContact CB-CD2 3.71Å; C70-W91 HydrophobicContact CB-CE3 3.44Å; C70-W91 VanDerWaalsContact CB-CE3 3.44Å; C70-W91 HydrophobicContact CB-CG 4.44Å; C70-W91 HydrophobicContact CB-CH2 3.87Å; C70-W91 HydrophobicContact CB-CZ2 4.13Å; C70-W91 HydrophobicContact CB-CZ3 3.52Å; C70-L147 HydrophobicContact CB-CB 4.42Å; C70-L147 PolarHBondContact N-O 3.29Å; C70-L147 PolarHBondContact O-N 3.03Å
71	V	75.6	Confident	72.6	Confident	26 Å²	26	67 Å²	67	16%	0.158	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	123.2	-176.5	-179.8	0	0	0	0	111.1	V69 K73 Y111 I146	V69-V71 HydrophobicContact CG1-CG2 4.16Å; V71-K73 HydrophobicContact CG1-CG 4.42Å; V71-Y111 HydrophobicContact CB-CD1 3.75Å; V71-Y111 HydrophobicContact CB-CD2 4.28Å; V71-Y111 HydrophobicContact CB-CE1 4.35Å; V71-Y111 HydrophobicContact CB-CG 3.72Å; V71-Y111 HydrophobicContact CG1-CD1 4.11Å; V71-Y111 HydrophobicContact CG2-CD1 4.25Å; V71-Y111 HydrophobicContact CG2-CD2 4.43Å; V71-Y111 HydrophobicContact CG2-CG 3.8Å; V71-I146 HydrophobicContact CB-CG1 4.4Å; V71-I146 HydrophobicContact CG1-CG1 4.07Å; V71-I146 HydrophobicContact CG2-CB 4.38Å; V71-I146 HydrophobicContact CG2-CD1 4Å; V71-I146 HydrophobicContact CG2-CG1 3.74Å; V71-I146 HydrophobicContact CG2-CG2 4.16Å
72	V	73.5	Confident	71.7	Confident	7 Å²	7	67.5 Å²	67.5	4%	0.042	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	104.2	-178	175.4	0	0	0	0	109.2	H74 L79 L82 G144 T145 L147	V72-H74 HydrophobicContact CG1-CB 4.03Å; V72-H74 PolarHBondContact O-N 2.98Å; V72-L79 HydrophobicContact CB-CD1 4.13Å; V72-L79 HydrophobicContact CG1-CD1 3.99Å; V72-L79 HydrophobicContact CG2-CD1 4.05Å; V72-L82 HydrophobicContact CB-CD2 4.22Å; V72-L82 HydrophobicContact CG1-CD2 3.47Å; V72-L82 VanDerWaalsContact CG1-CD2 3.47Å; V72-L82 HydrophobicContact CG2-CD2 3.78Å; V72-G144 CarbonylContact O-C 3.59Å; V72-G144 VanDerWaalsContact O-CA 3.26Å; V72-G144 WeakPolarHBondContact O-CA 3.28Å; V72-T145 PolarHBondContact N-O 2.87Å; V72-T145 PolarHBondContact O-N 2.84Å; V72-L147 HydrophobicContact CG2-CD1 4.39Å
73	K	67.4	Low	70.7	Confident	149 Å²	149	67 Å²	67	65%	0.648	34%	0.342	S	S	*	.			trans	-82.6	50.2	178.5	-63.1	-174.1	177.7	-177.8	0	112.4	V71	V71-K73 HydrophobicContact CG1-CG 4.42Å
74	H	65.3	Low	69.8	Low	103 Å²	103	66.7 Å²	66.7	48%	0.477	34%	0.338	S	S	.	.	S	Bend	trans	-137.9	152.4	179.9	-67.8	-55.8	0	0	0	111.5	V72	V72-H74 HydrophobicContact CG1-CB 4.03Å; V72-H74 PolarHBondContact O-N 2.98Å
75	P	59.2	Low	68.6	Low	86 Å²	86	63 Å²	63	56%	0.558	32%	0.324	S	S	*	.			trans	-63	151.5	177.5	25.6	-33.8	0	0	0	112	T77 F78	P75-T77 PolarHBondContact O-N 2.79Å; P75-F78 HydrophobicContact CG-CD2 4.29Å; P75-F78 PolarHBondContact O-N 2.65Å; P75-F78 VanDerWaalsContact O-N 3.13Å
76	R	58.3	Low	67.4	Low	118 Å²	118	71 Å²	71	45%	0.445	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-48.9	-29.1	-170.7	-60.5	-172	-171.3	-157.2	5.9	114.2	F78 L79 E122 D123	R76-F78 VanDerWaalsContact C-N 3.34Å; R76-F78 PolarHBondContact O-N 3.29Å; R76-L79 WeakPolarHBondContact O-CB 3.18Å; R76-L79 PolarHBondContact O-N 2.76Å; R76-E122 IonicContact CZ-OE2 2.78Å; R76-E122 IonicContact NH2-OE2 3.16Å; R76-E122 PolarHBondContact NH2-OE2 3.45Å; R76-D123 IonicContact NH1-OD2 3.99Å; R76-D123 PolarHBondContact NH1-OD2 3.23Å; R76-D123 VanDerWaalsContact NH1-OD2 3.09Å
77	T	55.8	Low	65.8	Low	111 Å²	111	75.3 Å²	75.3	68%	0.681	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-65.4	-23.2	-177.4	48.9	0	0	0	0	115.8	P75	P75-T77 PolarHBondContact O-N 2.79Å
78	F	58.8	Low	64.4	Low	120 Å²	120	80.1 Å²	80.1	53%	0.526	39%	0.389	S	S	.	.	G	3₁₀ helix	trans	-99.8	-4.6	-179.2	-73.5	-88.1	0	0	0	114.2	P75 R76 S80 K81 L82	P75-F78 HydrophobicContact CG-CD2 4.29Å; P75-F78 PolarHBondContact O-N 2.65Å; P75-F78 VanDerWaalsContact O-N 3.13Å; R76-F78 VanDerWaalsContact C-N 3.34Å; R76-F78 PolarHBondContact O-N 3.29Å; F78-S80 VanDerWaalsContact C-N 3.33Å; F78-S80 PolarHBondContact O-N 3.39Å; F78-K81 PolarHBondContact O-N 3.09Å; F78-L82 PolarHBondContact O-N 3.18Å
79	L	63.3	Low	63.5	Low	5 Å²	5	78.4 Å²	78.4	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-59.3	-41.3	-173	-169.8	67.3	0	0	0	112.5	V72 R76 K81 L82 L83 Q138 T145 L147	V72-L79 HydrophobicContact CB-CD1 4.13Å; V72-L79 HydrophobicContact CG1-CD1 3.99Å; V72-L79 HydrophobicContact CG2-CD1 4.05Å; R76-L79 WeakPolarHBondContact O-CB 3.18Å; R76-L79 PolarHBondContact O-N 2.76Å; L79-K81 PolarHBondContact O-N 3.48Å; L79-L82 PolarHBondContact O-N 3.44Å; L79-L83 HydrophobicContact CD1-CD1 3.92Å; L79-L83 HydrophobicContact CD1-CG 4.1Å; L79-L83 HydrophobicContact CD2-CD1 4.39Å; L79-L83 HydrophobicContact CG-CD1 3.77Å; L79-L83 HydrophobicContact CG-CG 4.23Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 VanDerWaalsContact O-CG 3.23Å; L79-L83 WeakPolarHBondContact O-CG 3.37Å; L79-L83 PolarHBondContact O-N 3.26Å; L79-Q138 VanDerWaalsContact CD2-CD 3.5Å; L79-Q138 HydrophobicContact CD2-CG 4.4Å; L79-T145 HydrophobicContact CD1-CG2 4.2Å; L79-T145 HydrophobicContact CD2-CG2 3.97Å; L79-L147 HydrophobicContact CD1-CD1 4.46Å
80	S	58.8	Low	63	Low	48 Å²	48	86.1 Å²	86.1	34%	0.336	41%	0.408	S	S	.	.	H	α-helix	trans	-56.8	-48.4	177.7	56.9	0	0	0	0	112.9	F78 L83 T84	F78-S80 VanDerWaalsContact C-N 3.33Å; F78-S80 PolarHBondContact O-N 3.39Å; S80-L83 PolarHBondContact O-N 3.48Å; S80-T84 PolarHBondContact O-N 3.12Å; S80-T84 PolarHBondContact O-OG1 3.31Å
81	K	62	Low	62.8	Low	152 Å²	152	88.9 Å²	88.9	66%	0.661	42%	0.418	S	S	*	.	H	α-helix	trans	-73.2	-32.4	-178.1	-65.7	-178.7	178.6	179.3	0	112.6	F78 L79 T84	F78-K81 PolarHBondContact O-N 3.09Å; L79-K81 PolarHBondContact O-N 3.48Å; K81-T84 PolarHBondContact O-OG1 3.07Å
82	L	63.2	Low	63	Low	31 Å²	31	88.4 Å²	88.4	16%	0.162	41%	0.414	C	S	.	.	H	α-helix	trans	-70.5	-40.3	175.3	-153.2	84.6	0	0	0	111.2	V72 F78 L79 T84 S85 L88	V72-L82 HydrophobicContact CB-CD2 4.22Å; V72-L82 HydrophobicContact CG1-CD2 3.47Å; V72-L82 VanDerWaalsContact CG1-CD2 3.47Å; V72-L82 HydrophobicContact CG2-CD2 3.78Å; F78-L82 PolarHBondContact O-N 3.18Å; L79-L82 PolarHBondContact O-N 3.44Å; L82-T84 VanDerWaalsContact C-N 3.33Å; L82-T84 PolarHBondContact O-N 3.19Å; L82-S85 PolarHBondContact O-N 3.38Å; L82-L88 HydrophobicContact CD1-CB 4.19Å; L82-L88 HydrophobicContact CD1-CD1 3.65Å; L82-L88 HydrophobicContact CG-CB 4.23Å; L82-L88 HydrophobicContact CG-CD1 4.4Å
83	L	61.8	Low	63.4	Low	9 Å²	9	93 Å²	93	5%	0.047	44%	0.443	C	S	.	.	H	α-helix	trans	-79.3	-5.5	179.6	-62.6	-177.4	0	0	0	114.8	L79 S80 R89 L127 L147	L79-L83 HydrophobicContact CD1-CD1 3.92Å; L79-L83 HydrophobicContact CD1-CG 4.1Å; L79-L83 HydrophobicContact CD2-CD1 4.39Å; L79-L83 HydrophobicContact CG-CD1 3.77Å; L79-L83 HydrophobicContact CG-CG 4.23Å; L79-L83 WeakPolarHBondContact O-CB 3.49Å; L79-L83 VanDerWaalsContact O-CG 3.23Å; L79-L83 WeakPolarHBondContact O-CG 3.37Å; L79-L83 PolarHBondContact O-N 3.26Å; S80-L83 PolarHBondContact O-N 3.48Å; L83-R89 HydrophobicContact CD2-CG 4.17Å; L83-R89 PolarHBondContact O-NH1 2.96Å; L83-R89 PolarHBondContact O-NH2 3.46Å; L83-L127 HydrophobicContact CD1-CD2 3.9Å; L83-L147 HydrophobicContact CD1-CD1 3.7Å; L83-L147 HydrophobicContact CD2-CD1 3.39Å; L83-L147 HydrophobicContact CG-CD1 4.12Å
84	T	59.7	Low	64.1	Low	82 Å²	82	86 Å²	86	50%	0.503	41%	0.413	S	S	.	.	H	α-helix	trans	-85.9	-28.2	164.4	47.5	0	0	0	0	112.4	S80 K81 L82 R89 N131	S80-T84 PolarHBondContact O-N 3.12Å; S80-T84 PolarHBondContact O-OG1 3.31Å; K81-T84 PolarHBondContact O-OG1 3.07Å; L82-T84 VanDerWaalsContact C-N 3.33Å; L82-T84 PolarHBondContact O-N 3.19Å; T84-R89 PolarHBondContact O-NH2 3.39Å; T84-N131 HydrophobicContact CG2-CB 4.12Å
85	S	59.8	Low	65	Low	35 Å²	35	83.6 Å²	83.6	25%	0.245	40%	0.402	C	S	.	.			trans	-72.1	131.4	175.3	-176.8	0	0	0	0	112.1	L82 Y87 R89	L82-S85 PolarHBondContact O-N 3.38Å; S85-Y87 PolarHBondContact OG-N 3.3Å; S85-R89 VanDerWaalsContact O-CZ 3.28Å; S85-R89 PolarHBondContact O-NE 3.43Å; S85-R89 PolarHBondContact O-NH2 3.31Å
86	K	58.1	Low	66.2	Low	180 Å²	180	79.5 Å²	79.5	78%	0.783	38%	0.375	S	S	*	.	S	Bend	trans	-76.3	-25	174.5	-71	-174.6	179.3	178.9	0	112.9
87	Y	51	Low	67.4	Low	218 Å²	218	75.3 Å²	75.3	86%	0.855	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90	-11.8	-169.1	-60.1	-82.2	0	0	0	114.5	S85	S85-Y87 PolarHBondContact OG-N 3.3Å
88	L	55.1	Low	68.7	Low	109 Å²	109	70.4 Å²	70.4	57%	0.571	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	6.8	-176.9	-61.2	174.8	0	0	0	113.5	L82	L82-L88 HydrophobicContact CD1-CB 4.19Å; L82-L88 HydrophobicContact CD1-CD1 3.65Å; L82-L88 HydrophobicContact CG-CB 4.23Å; L82-L88 HydrophobicContact CG-CD1 4.4Å
89	R	65.1	Low	69.8	Low	53 Å²	53	66.9 Å²	66.9	20%	0.2	32%	0.321	C	S	.	.			trans	-110.1	101.2	-178.8	-77.7	178.8	-83.3	-171.5	-9	110.7	L83 T84 S85	L83-R89 HydrophobicContact CD2-CG 4.17Å; L83-R89 PolarHBondContact O-NH1 2.96Å; L83-R89 PolarHBondContact O-NH2 3.46Å; T84-R89 PolarHBondContact O-NH2 3.39Å; S85-R89 VanDerWaalsContact O-CZ 3.28Å; S85-R89 PolarHBondContact O-NE 3.43Å; S85-R89 PolarHBondContact O-NH2 3.31Å
90	R	71.1	Confident	70.3	Confident	163 Å²	163	72.2 Å²	72.2	62%	0.615	35%	0.349	S	S	*	.			trans	-90.6	113.2	164.6	179.8	170.6	167.2	152.5	-4.8	108.2	C70 E92	C70-R90 PolarHBondContact SG-O 3.05Å; R90-E92 HydrophobicContact CG-CG 4.18Å; R90-E92 IonicContact CZ-OE1 2.72Å; R90-E92 IonicContact NE-OE1 2.72Å; R90-E92 PolarHBondContact NE-OE1 3.4Å; R90-E92 IonicContact NH2-OE1 2.67Å; R90-E92 PolarHBondContact NH2-OE1 3.07Å
91	W	76.4	Confident	71.1	Confident	62 Å²	62	73 Å²	73	24%	0.235	36%	0.355	C	S	.	.			trans	-97.6	131	172	-69.5	100.4	0	0	0	109.1	Q68 V69 C70 P133 L147 Q149	Q68-W91 HydrophobicContact CB-CD2 4.47Å; Q68-W91 HydrophobicContact CB-CE3 3.81Å; Q68-W91 HydrophobicContact CB-CZ3 4.49Å; Q68-W91 WeakPolarHBondContact O-CZ3 3.43Å; V69-W91 WeakPolarHBondContact O-CA 3.25Å; C70-W91 HydrophobicContact CB-CD2 3.71Å; C70-W91 HydrophobicContact CB-CE3 3.44Å; C70-W91 VanDerWaalsContact CB-CE3 3.44Å; C70-W91 HydrophobicContact CB-CG 4.44Å; C70-W91 HydrophobicContact CB-CH2 3.87Å; C70-W91 HydrophobicContact CB-CZ2 4.13Å; C70-W91 HydrophobicContact CB-CZ3 3.52Å; W91-P133 HydrophobicContact CZ2-CB 4.39Å; W91-P133 HydrophobicContact CZ2-CG 4.45Å; W91-L147 HydrophobicContact CH2-CB 3.89Å; W91-L147 HydrophobicContact CZ3-CB 4.24Å; W91-Q149 HydrophobicContact CE3-CB 4.09Å; W91-Q149 HydrophobicContact CH2-CB 3.66Å; W91-Q149 HydrophobicContact CZ2-CB 4.35Å; W91-Q149 HydrophobicContact CZ3-CB 3.5Å
92	E	80.3	Confident	72	Confident	16 Å²	16	65.8 Å²	65.8	8%	0.075	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	126.4	177.9	-59.5	-169.3	137.6	0	0	108.6	V69 R90 H94 G110 Y111	V69-E92 PolarHBondContact N-O 3.43Å; V69-E92 PolarHBondContact O-N 3.2Å; R90-E92 HydrophobicContact CG-CG 4.18Å; R90-E92 IonicContact CZ-OE1 2.72Å; R90-E92 IonicContact NE-OE1 2.72Å; R90-E92 PolarHBondContact NE-OE1 3.4Å; R90-E92 IonicContact NH2-OE1 2.67Å; R90-E92 PolarHBondContact NH2-OE1 3.07Å; E92-H94 VanDerWaalsContact CB-NE2 3.34Å; E92-H94 WeakPolarHBondContact CB-NE2 3.49Å; E92-H94 PolarHBondContact O-CD2 2.95Å; E92-H94 VanDerWaalsContact O-CD2 3.29Å; E92-H94 PolarHBondContact O-N 2.99Å; E92-H94 IonicContact OE2-NE2 2.8Å; E92-G110 WeakPolarHBondContact OE2-CA 3.45Å; E92-Y111 VanDerWaalsContact OE2-CD2 3.25Å; E92-Y111 WeakPolarHBondContact OE2-CD2 3.49Å; E92-Y111 PolarHBondContact OE2-N 3.48Å
93	P	81.7	Confident	72.9	Confident	102 Å²	102	64.3 Å²	64.3	66%	0.662	32%	0.316	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.1	120.5	178	30.1	-32.2	0	0	0	109.6
94	H	81.7	Confident	73.9	Confident	4 Å²	4	65 Å²	65	2%	0.019	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	143.1	177.6	-68.1	-74.7	0	0	0	111.8	I67 V69 E92 L96 S105 T107 T109	I67-H94 PolarHBondContact N-O 3.26Å; I67-H94 PolarHBondContact O-N 2.82Å; V69-H94 HydrophobicContact CG2-CB 4.03Å; E92-H94 VanDerWaalsContact CB-NE2 3.34Å; E92-H94 WeakPolarHBondContact CB-NE2 3.49Å; E92-H94 PolarHBondContact O-CD2 2.95Å; E92-H94 VanDerWaalsContact O-CD2 3.29Å; E92-H94 PolarHBondContact O-N 2.99Å; E92-H94 IonicContact OE2-NE2 2.8Å; H94-L96 HydrophobicContact CB-CD2 3.65Å; H94-L96 HydrophobicContact CB-CG 4.17Å; H94-S105 PolarHBondContact ND1-OG 2.99Å; H94-S105 VanDerWaalsContact ND1-OG 3.17Å; H94-T107 PolarHBondContact CE1-O 2.91Å; H94-T107 PolarHBondContact ND1-O 2.97Å; H94-T107 PolarHBondContact ND1-OG1 3.01Å; H94-T109 PolarHBondContact CE1-O 2.77Å; H94-T109 PolarHBondContact CE1-OG1 3.01Å
95	H	83.3	Confident	75	Confident	51 Å²	51	61.7 Å²	61.7	24%	0.236	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	100.6	166.5	-169.2	86.7	0	0	0	107.7	D66 A106	D66-H95 IonicContact OD1-CE1 2.68Å; D66-H95 IonicContact OD1-CG 2.77Å; D66-H95 IonicContact OD1-ND1 2.7Å; D66-H95 PolarHBondContact OD1-ND1 2.8Å; H95-A106 HydrophobicContact CB-CB 4.26Å; H95-A106 PolarHBondContact O-N 2.91Å
96	L	84.1	Confident	75.6	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	139.4	-174.2	-62.3	-168.8	0	0	0	111.6	E64 G65 I67 V69 H94 L103 S104 M112 L148 W159	E64-L96 CarbonylContact C-O 3.59Å; E64-L96 WeakPolarHBondContact CA-O 3.39Å; G65-L96 PolarHBondContact N-O 2.94Å; G65-L96 PolarHBondContact O-N 3.35Å; I67-L96 HydrophobicContact CG2-CB 4.23Å; I67-L96 HydrophobicContact CG2-CD1 3.5Å; I67-L96 HydrophobicContact CG2-CG 3.64Å; V69-L96 HydrophobicContact CG2-CD1 4.12Å; H94-L96 HydrophobicContact CB-CD2 3.65Å; H94-L96 HydrophobicContact CB-CG 4.17Å; L96-L103 HydrophobicContact CD1-CD2 4.39Å; L96-S104 CarbonylContact C-O 3.5Å; L96-S104 WeakPolarHBondContact CA-O 3.5Å; L96-M112 HydrophobicContact CD1-SD 3.99Å; L96-M112 HydrophobicContact CD2-CE 3.9Å; L96-M112 HydrophobicContact CD2-SD 3.44Å; L96-M112 WeakPolarHBondContact CD2-SD 3.46Å; L96-M112 HydrophobicContact CG-SD 4.39Å; L96-L148 HydrophobicContact CD1-CD2 4Å; L96-W159 HydrophobicContact CB-CH2 3.82Å; L96-W159 HydrophobicContact CB-CZ3 4.4Å
97	T	84.1	Confident	76.2	Confident	31 Å²	31	57.4 Å²	57.4	19%	0.19	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	126.5	177.8	51.6	0	0	0	0	110.2	E64 T99 S104	E64-T97 HydrophobicContact CB-CG2 3.8Å; T97-T99 PolarHBondContact O-N 3.33Å; T97-S104 PolarHBondContact N-O 2.87Å; T97-S104 PolarHBondContact O-N 3.01Å; T97-S104 VanDerWaalsContact O-N 3.09Å; T97-S104 PolarHBondContact OG1-O 2.89Å; T97-S104 PolarHBondContact OG1-OG 2.98Å
98	L	83.3	Confident	76.8	Confident	7 Å²	7	50.9 Å²	50.9	4%	0.037	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	77.8	179.8	-63.3	-165	0	0	0	111.1	L62 P63 L103 W159 L163 K166	L62-L98 WeakPolarHBondContact O-CD1 3.43Å; P63-L98 PolarHBondContact O-N 3.22Å; L98-L103 HydrophobicContact CD2-CD2 4.37Å; L98-L103 HydrophobicContact CD2-CG 3.81Å; L98-W159 HydrophobicContact CD1-CZ3 4.26Å; L98-W159 HydrophobicContact CD2-CZ3 3.92Å; L98-W159 HydrophobicContact CG-CZ3 4.02Å; L98-L163 HydrophobicContact CD1-CD2 4.21Å; L98-L163 HydrophobicContact CD1-CG 4.48Å; L98-L163 HydrophobicContact CD2-CD2 3.56Å; L98-K166 HydrophobicContact CB-CG 4.4Å; L98-K166 HydrophobicContact CD1-CG 4.4Å; L98-K166 WeakPolarHBondContact O-CE 3.27Å; L98-K166 PolarHBondContact O-NZ 3.18Å
99	T	81.8	Confident	77.2	Confident	47 Å²	47	49.5 Å²	49.5	29%	0.288	28%	0.277	S	S	.	.			trans	-63.8	174.9	173.3	77	0	0	0	0	111.5	T97 S101 G102 S104 Y118	T97-T99 PolarHBondContact O-N 3.33Å; T99-S101 PolarHBondContact OG1-N 3.28Å; T99-G102 PolarHBondContact N-O 2.66Å; T99-G102 VanDerWaalsContact N-O 3.14Å; T99-G102 PolarHBondContact OG1-N 2.94Å; T99-G102 VanDerWaalsContact OG1-N 3.14Å; T99-G102 PolarHBondContact OG1-O 2.8Å; T99-S104 WeakPolarHBondContact CG2-OG 3.33Å; T99-Y118 VanDerWaalsContact O-CE2 3.23Å; T99-Y118 WeakPolarHBondContact O-CE2 3.47Å; T99-Y118 PolarHBondContact O-OH 3.25Å
100	D	75	Confident	77.3	Confident	116 Å²	116	49.2 Å²	49.2	62%	0.62	29%	0.29	S	S	*	.	S	Bend	trans	-80.2	-14.6	-180	-65.1	-28.9	0	0	0	114.1	K166 Y170	D100-K166 IonicContact OD1-NZ 2.81Å; D100-K166 PolarHBondContact OD1-NZ 3.25Å; D100-Y170 WeakPolarHBondContact O-CD2 3.4Å
101	S	73.9	Confident	76.9	Confident	65 Å²	65	46.1 Å²	46.1	46%	0.455	28%	0.279	S	S	.	.	S	Bend	trans	-108.6	-20	179.5	61.1	0	0	0	0	114.1	T99 S117 Y118	T99-S101 PolarHBondContact OG1-N 3.28Å; S101-S117 VanDerWaalsContact O-CA 3.3Å; S101-S117 WeakPolarHBondContact O-CA 3.2Å; S101-S117 PolarHBondContact O-OG 3.25Å; S101-Y118 VanDerWaalsContact C-CD2 3.48Å; S101-Y118 PolarHBondContact O-N 3.42Å; S101-Y118 VanDerWaalsContact O-N 3.13Å
102	G	82.5	Confident	76.4	Confident	0 Å²	0	43.3 Å²	43.3	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-180	-170.7	-179.8	0	0	0	0	0	115.2	T99 L116 Y118	T99-G102 PolarHBondContact N-O 2.66Å; T99-G102 VanDerWaalsContact N-O 3.14Å; T99-G102 PolarHBondContact OG1-N 2.94Å; T99-G102 VanDerWaalsContact OG1-N 3.14Å; T99-G102 PolarHBondContact OG1-O 2.8Å; G102-L116 CarbonylContact C-O 3.56Å; G102-L116 WeakPolarHBondContact CA-O 3.41Å; G102-Y118 VanDerWaalsContact N-CE2 3.3Å; G102-Y118 PolarHBondContact O-OH 2.57Å
103	L	82.2	Confident	75.6	Confident	1 Å²	1	49.9 Å²	49.9	1%	0.005	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	123.5	170.5	-61.9	73.2	0	0	0	109	L96 L98 M112 T115 L116 Y118 I121 L139 L163	L96-L103 HydrophobicContact CD1-CD2 4.39Å; L98-L103 HydrophobicContact CD2-CD2 4.37Å; L98-L103 HydrophobicContact CD2-CG 3.81Å; L103-M112 HydrophobicContact CB-CE 4.26Å; L103-T115 WeakPolarHBondContact O-CA 3.24Å; L103-T115 WeakPolarHBondContact O-CG2 3.44Å; L103-L116 HydrophobicContact CB-CB 4.34Å; L103-L116 PolarHBondContact N-O 3.49Å; L103-L116 PolarHBondContact O-N 3.03Å; L103-Y118 HydrophobicContact CD1-CD1 4.02Å; L103-Y118 HydrophobicContact CD1-CE1 3.6Å; L103-I121 HydrophobicContact CD1-CD1 3.83Å; L103-L139 HydrophobicContact CD2-CD1 4.34Å; L103-L163 HydrophobicContact CD1-CD2 3.99Å; L103-L163 HydrophobicContact CD2-CD2 3.72Å; L103-L163 HydrophobicContact CG-CD2 3.93Å
104	S	82.1	Confident	75	Confident	22 Å²	22	50.1 Å²	50.1	15%	0.154	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	157.4	168.4	41.4	0	0	0	0	110.9	L96 T97 T99	L96-S104 CarbonylContact C-O 3.5Å; L96-S104 WeakPolarHBondContact CA-O 3.5Å; T97-S104 PolarHBondContact N-O 2.87Å; T97-S104 PolarHBondContact O-N 3.01Å; T97-S104 VanDerWaalsContact O-N 3.09Å; T97-S104 PolarHBondContact OG1-O 2.89Å; T97-S104 PolarHBondContact OG1-OG 2.98Å; T99-S104 WeakPolarHBondContact CG2-OG 3.33Å
105	S	81.7	Confident	74.7	Confident	14 Å²	14	53.8 Å²	53.8	10%	0.098	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	133.4	171.5	-178.4	0	0	0	0	109.8	H94 T107	H94-S105 PolarHBondContact ND1-OG 2.99Å; H94-S105 VanDerWaalsContact ND1-OG 3.17Å; S105-T107 PolarHBondContact O-N 2.91Å; S105-T107 PolarHBondContact OG-N 2.82Å; S105-T107 VanDerWaalsContact OG-N 3.11Å; S105-T107 PolarHBondContact OG-O 3.25Å; S105-T107 PolarHBondContact OG-OG1 3.18Å
106	A	73.8	Confident	74.6	Confident	68 Å²	68	52.7 Å²	52.7	56%	0.562	32%	0.318	S	S	*	.	S	Bend	trans	-72.2	-16.4	168.9	0	0	0	0	0	112.2	H95 P108	H95-A106 HydrophobicContact CB-CB 4.26Å; H95-A106 PolarHBondContact O-N 2.91Å; A106-P108 VanDerWaalsContact C-CD 3.46Å; A106-P108 VanDerWaalsContact O-CD 3.26Å; A106-P108 WeakPolarHBondContact O-CD 3.29Å
107	T	70.4	Confident	74.6	Confident	57 Å²	57	54.6 Å²	54.6	35%	0.35	33%	0.331	S	S	.	.	S	Bend	trans	-109	83	165.4	51.1	0	0	0	0	109.2	H94 S105 T109	H94-T107 PolarHBondContact CE1-O 2.91Å; H94-T107 PolarHBondContact ND1-O 2.97Å; H94-T107 PolarHBondContact ND1-OG1 3.01Å; S105-T107 PolarHBondContact O-N 2.91Å; S105-T107 PolarHBondContact OG-N 2.82Å; S105-T107 VanDerWaalsContact OG-N 3.11Å; S105-T107 PolarHBondContact OG-O 3.25Å; S105-T107 PolarHBondContact OG-OG1 3.18Å; T107-T109 VanDerWaalsContact C-N 3.26Å; T107-T109 PolarHBondContact O-N 2.97Å
108	P	64.5	Low	74.5	Confident	81 Å²	81	53.4 Å²	53.4	53%	0.526	32%	0.323	S	S	.	.			trans	-74.6	81.9	178.7	31.2	-35.2	0	0	0	109.6	A106	A106-P108 VanDerWaalsContact C-CD 3.46Å; A106-P108 VanDerWaalsContact O-CD 3.26Å; A106-P108 WeakPolarHBondContact O-CD 3.29Å
109	T	63.1	Low	74.3	Confident	80 Å²	80	56.3 Å²	56.3	49%	0.491	34%	0.344	S	S	.	.			trans	-131.9	155	177.7	52.8	0	0	0	0	109.7	H94 T107 Y111 M112	H94-T109 PolarHBondContact CE1-O 2.77Å; H94-T109 PolarHBondContact CE1-OG1 3.01Å; T107-T109 VanDerWaalsContact C-N 3.26Å; T107-T109 PolarHBondContact O-N 2.97Å; T109-Y111 PolarHBondContact O-N 2.84Å; T109-Y111 VanDerWaalsContact O-N 3.14Å; T109-M112 PolarHBondContact O-N 2.9Å
110	G	66.4	Low	74.2	Confident	46 Å²	46	55.9 Å²	55.9	47%	0.474	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	53.7	-118.7	174.3	0	0	0	0	0	113	E92 M112	E92-G110 WeakPolarHBondContact OE2-CA 3.45Å; G110-M112 PolarHBondContact O-N 2.81Å
111	Y	62.3	Low	74.5	Confident	98 Å²	98	50.9 Å²	50.9	38%	0.384	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-82.2	-4.4	-171.8	-60.9	-78.6	0	0	0	116	V71 E92 T109	V71-Y111 HydrophobicContact CB-CD1 3.75Å; V71-Y111 HydrophobicContact CB-CD2 4.28Å; V71-Y111 HydrophobicContact CB-CE1 4.35Å; V71-Y111 HydrophobicContact CB-CG 3.72Å; V71-Y111 HydrophobicContact CG1-CD1 4.11Å; V71-Y111 HydrophobicContact CG2-CD1 4.25Å; V71-Y111 HydrophobicContact CG2-CD2 4.43Å; V71-Y111 HydrophobicContact CG2-CG 3.8Å; E92-Y111 VanDerWaalsContact OE2-CD2 3.25Å; E92-Y111 WeakPolarHBondContact OE2-CD2 3.49Å; E92-Y111 PolarHBondContact OE2-N 3.48Å; T109-Y111 PolarHBondContact O-N 2.84Å; T109-Y111 VanDerWaalsContact O-N 3.14Å
112	M	66.8	Low	74.7	Confident	4 Å²	4	53 Å²	53	2%	0.02	32%	0.319	C	S	.	.	G	3₁₀ helix	trans	-118.5	33.6	177.1	-68.4	-144.4	58	0	0	113.5	V69 L96 L103 T109 G110 T114 L116	V69-M112 HydrophobicContact CG1-CG 4.36Å; V69-M112 HydrophobicContact CG1-SD 4.31Å; V69-M112 HydrophobicContact CG2-SD 4.18Å; L96-M112 HydrophobicContact CD1-SD 3.99Å; L96-M112 HydrophobicContact CD2-CE 3.9Å; L96-M112 HydrophobicContact CD2-SD 3.44Å; L96-M112 WeakPolarHBondContact CD2-SD 3.46Å; L96-M112 HydrophobicContact CG-SD 4.39Å; L103-M112 HydrophobicContact CB-CE 4.26Å; T109-M112 PolarHBondContact O-N 2.9Å; G110-M112 PolarHBondContact O-N 2.81Å; M112-T114 PolarHBondContact O-N 2.61Å; M112-L116 HydrophobicContact CE-CD1 3.73Å; M112-L116 HydrophobicContact CE-CG 4.2Å; M112-L116 HydrophobicContact SD-CD1 4.31Å
113	E	63.3	Low	74.5	Confident	153 Å²	153	55.3 Å²	55.3	72%	0.715	33%	0.331	S	S	*	.	S	Bend	trans	-64.6	-24.1	171.9	-171.9	174.3	-152	0	0	113.2
114	T	69.3	Low	74.6	Confident	107 Å²	107	56.4 Å²	56.4	66%	0.656	34%	0.337	S	S	*	.	S	Bend	trans	-122.4	144	175.3	55.4	0	0	0	0	112.2	M112 L116	M112-T114 PolarHBondContact O-N 2.61Å; T114-L116 PolarHBondContact O-N 2.88Å
115	T	76.2	Confident	74.6	Confident	82 Å²	82	59.7 Å²	59.7	50%	0.503	35%	0.35	S	S	.	.			trans	-65.7	125.2	179.4	-55.1	0	0	0	0	111.4	L103 S117	L103-T115 WeakPolarHBondContact O-CA 3.24Å; L103-T115 WeakPolarHBondContact O-CG2 3.44Å; T115-S117 PolarHBondContact O-N 3.21Å
116	L	80.8	Confident	74.5	Confident	27 Å²	27	61.8 Å²	61.8	14%	0.141	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	102.1	179.7	-73.9	170.4	0	0	0	111.1	G102 L103 M112 T114 I141 I146	G102-L116 CarbonylContact C-O 3.56Å; G102-L116 WeakPolarHBondContact CA-O 3.41Å; L103-L116 HydrophobicContact CB-CB 4.34Å; L103-L116 PolarHBondContact N-O 3.49Å; L103-L116 PolarHBondContact O-N 3.03Å; M112-L116 HydrophobicContact CE-CD1 3.73Å; M112-L116 HydrophobicContact CE-CG 4.2Å; M112-L116 HydrophobicContact SD-CD1 4.31Å; T114-L116 PolarHBondContact O-N 2.88Å; L116-I141 HydrophobicContact CD1-CD1 4.41Å; L116-I141 HydrophobicContact CD2-CD1 3.92Å; L116-I146 HydrophobicContact CD1-CD1 3.43Å; L116-I146 VanDerWaalsContact CD1-CD1 3.43Å; L116-I146 HydrophobicContact CD2-CD1 4.17Å; L116-I146 HydrophobicContact CG-CD1 4.44Å
117	S	82.8	Confident	74.6	Confident	40 Å²	40	59.4 Å²	59.4	28%	0.28	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.1	141	177.5	-176.4	0	0	0	0	112.6	S101 T115 S119 S120	S101-S117 VanDerWaalsContact O-CA 3.3Å; S101-S117 WeakPolarHBondContact O-CA 3.2Å; S101-S117 PolarHBondContact O-OG 3.25Å; T115-S117 PolarHBondContact O-N 3.21Å; S117-S119 PolarHBondContact O-N 3.28Å; S117-S119 PolarHBondContact OG-N 3.11Å; S117-S120 PolarHBondContact O-N 3.15Å; S117-S120 PolarHBondContact O-OG 3.21Å
118	Y	83.6	Confident	73.9	Confident	6 Å²	6	61.5 Å²	61.5	2%	0.024	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-59.4	-20	172.1	-59.5	-62.3	0	0	0	113.3	T99 S101 G102 L103 S120 I121 K166 K167 Y170	T99-Y118 VanDerWaalsContact O-CE2 3.23Å; T99-Y118 WeakPolarHBondContact O-CE2 3.47Å; T99-Y118 PolarHBondContact O-OH 3.25Å; S101-Y118 VanDerWaalsContact C-CD2 3.48Å; S101-Y118 PolarHBondContact O-N 3.42Å; S101-Y118 VanDerWaalsContact O-N 3.13Å; G102-Y118 VanDerWaalsContact N-CE2 3.3Å; G102-Y118 PolarHBondContact O-OH 2.57Å; L103-Y118 HydrophobicContact CD1-CD1 4.02Å; L103-Y118 HydrophobicContact CD1-CE1 3.6Å; Y118-S120 VanDerWaalsContact C-N 3.31Å; Y118-S120 PolarHBondContact O-N 3.26Å; Y118-I121 HydrophobicContact CD1-CD1 3.98Å; Y118-K166 HydrophobicContact CE1-CB 4Å; Y118-K166 HydrophobicContact CE2-CB 4.25Å; Y118-K167 HydrophobicContact CD1-CB 4.18Å; Y118-Y170 HydrophobicContact CD2-CD2 4.18Å; Y118-Y170 AromaticContact CD2-CG 3.96Å; Y118-Y170 HydrophobicContact CD2-CG 3.96Å; Y118-Y170 HydrophobicContact CG-CG 4.42Å
119	S	78.1	Confident	73.9	Confident	69 Å²	69	65.6 Å²	65.6	48%	0.483	36%	0.359	S	S	.	.	G	3₁₀ helix	trans	-63.7	-29.7	173.4	-73.7	0	0	0	0	113.9	S117 Y170	S117-S119 PolarHBondContact O-N 3.28Å; S117-S119 PolarHBondContact OG-N 3.11Å; S119-Y170 WeakPolarHBondContact OG-CE1 3.28Å; S119-Y170 PolarHBondContact OG-OH 3.03Å
120	S	79.2	Confident	73.3	Confident	37 Å²	37	70 Å²	70	26%	0.259	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-91.9	-6.8	-176.8	62.7	0	0	0	0	113.7	S117 Y118 E122 P142	S117-S120 PolarHBondContact O-N 3.15Å; S117-S120 PolarHBondContact O-OG 3.21Å; Y118-S120 VanDerWaalsContact C-N 3.31Å; Y118-S120 PolarHBondContact O-N 3.26Å; S120-E122 PolarHBondContact O-N 2.66Å; S120-P142 WeakPolarHBondContact O-CD 3.27Å
121	I	81.1	Confident	72.8	Confident	11 Å²	11	74 Å²	74	6%	0.056	39%	0.39	C	S	.	.			trans	-82.3	105.3	177.3	-53.4	170.8	0	0	0	108.2	L103 Y118 L139 S140 K167	L103-I121 HydrophobicContact CD1-CD1 3.83Å; Y118-I121 HydrophobicContact CD1-CD1 3.98Å; I121-L139 HydrophobicContact CD1-CD2 4.1Å; I121-L139 HydrophobicContact CG1-CD2 4.48Å; I121-L139 HydrophobicContact CG2-CD2 3.67Å; I121-S140 CarbonylContact C-O 3.21Å; I121-K167 HydrophobicContact CB-CD 4.28Å; I121-K167 HydrophobicContact CG2-CD 4.19Å; I121-K167 WeakPolarHBondContact O-CE 3.36Å; I121-K167 PolarHBondContact O-NZ 3.4Å
122	E	78.9	Confident	72.6	Confident	111 Å²	111	70.5 Å²	70.5	52%	0.519	38%	0.382	S	S	.	.			trans	-66.4	-56.1	174.7	-63.7	177.5	172	0	0	110.1	R76 S120 S140 K167	R76-E122 IonicContact CZ-OE2 2.78Å; R76-E122 IonicContact NH2-OE2 3.16Å; R76-E122 PolarHBondContact NH2-OE2 3.45Å; S120-E122 PolarHBondContact O-N 2.66Å; E122-S140 PolarHBondContact N-O 3.22Å; E122-K167 VanDerWaalsContact C-NZ 3.32Å; E122-K167 PolarHBondContact O-NZ 3.39Å
123	D	79.2	Confident	72.3	Confident	48 Å²	48	71 Å²	71	26%	0.257	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.5	-163.3	-164.2	2.7	0	0	0	111.2	R76 Q125 S140	R76-D123 IonicContact NH1-OD2 3.99Å; R76-D123 PolarHBondContact NH1-OD2 3.23Å; R76-D123 VanDerWaalsContact NH1-OD2 3.09Å; D123-Q125 PolarHBondContact OD2-NE2 2.93Å; D123-S140 PolarHBondContact O-N 2.86Å
124	L	83.6	Confident	72.6	Confident	23 Å²	23	71.2 Å²	71.2	12%	0.12	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	113.3	-176.6	178.8	78.4	0	0	0	108.3	I137 Q138 L139 F160 L163 Q164	L124-I137 HydrophobicContact CD1-CG2 3.65Å; L124-I137 HydrophobicContact CG-CG2 4.49Å; L124-Q138 WeakPolarHBondContact CA-O 3.28Å; L124-L139 HydrophobicContact CD1-CD2 3.41Å; L124-L139 VanDerWaalsContact CD1-CD2 3.41Å; L124-L139 HydrophobicContact CD1-CG 4.15Å; L124-F160 HydrophobicContact CD1-CD2 4.39Å; L124-F160 HydrophobicContact CD2-CD2 3.78Å; L124-F160 HydrophobicContact CD2-CE2 3.79Å; L124-F160 HydrophobicContact CG-CD2 3.79Å; L124-F160 HydrophobicContact CG-CE2 3.7Å; L124-L163 HydrophobicContact CD1-CB 4.42Å; L124-L163 HydrophobicContact CD1-CD1 4.43Å; L124-L163 HydrophobicContact CD2-CB 4.24Å; L124-Q164 HydrophobicContact CD2-CB 3.79Å
125	Q	81.8	Confident	73.1	Confident	91 Å²	91	70.4 Å²	70.4	43%	0.425	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	149.1	-175.3	-58.9	-170.5	1.3	0	0	111.8	D123 Q138	D123-Q125 PolarHBondContact OD2-NE2 2.93Å; Q125-Q138 HydrophobicContact CB-CB 4.49Å; Q125-Q138 PolarHBondContact N-O 2.85Å; Q125-Q138 PolarHBondContact O-N 2.68Å
126	L	80.3	Confident	73.3	Confident	58 Å²	58	66.5 Å²	66.5	30%	0.304	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	129.3	168.2	-66.5	177	0	0	0	109	S128 I137 R156 F160	L126-S128 PolarHBondContact O-N 3.27Å; L126-S128 PolarHBondContact O-OG 3.35Å; L126-I137 HydrophobicContact CD2-CG1 4.35Å; L126-R156 HydrophobicContact CD2-CG 4.01Å; L126-F160 HydrophobicContact CD1-CD1 4.34Å; L126-F160 HydrophobicContact CD1-CE1 4.44Å; L126-F160 HydrophobicContact CD1-CG 4.48Å; L126-F160 HydrophobicContact CD2-CB 3.75Å; L126-F160 HydrophobicContact CD2-CD1 4.26Å; L126-F160 HydrophobicContact CD2-CD2 3.59Å; L126-F160 HydrophobicContact CD2-CE2 4.24Å; L126-F160 HydrophobicContact CD2-CG 3.6Å; L126-F160 HydrophobicContact CG-CD1 4.3Å; L126-F160 HydrophobicContact CG-CD2 3.82Å; L126-F160 HydrophobicContact CG-CE1 4.43Å; L126-F160 HydrophobicContact CG-CE2 3.95Å; L126-F160 HydrophobicContact CG-CG 4.01Å; L126-F160 HydrophobicContact CG-CZ 4.27Å
127	L	74.3	Confident	73.4	Confident	19 Å²	19	65.2 Å²	65.2	10%	0.099	34%	0.339	C	S	.	.			trans	-79.5	117.1	-176.5	-161	74.4	0	0	0	110.4	L83 A132 P133 C136	L83-L127 HydrophobicContact CD1-CD2 3.9Å; L127-A132 HydrophobicContact CD2-CB 3.84Å; L127-A132 HydrophobicContact CG-CB 3.94Å; L127-P133 HydrophobicContact CD2-CG 3.89Å; L127-C136 HydrophobicContact CB-CB 4.26Å; L127-C136 HydrophobicContact CD2-CB 4.17Å; L127-C136 PolarHBondContact N-O 3.23Å
128	S	57.4	Low	73.4	Confident	100 Å²	100	64.1 Å²	64.1	70%	0.699	33%	0.329	S	S	*	.			trans	-140	65	-167.3	51.1	0	0	0	0	114.2	L126	L126-S128 PolarHBondContact O-N 3.27Å; L126-S128 PolarHBondContact O-OG 3.35Å
129	W	64.7	Low	73.4	Confident	168 Å²	168	63.9 Å²	63.9	64%	0.636	33%	0.329	S	S	*	.	S	Bend	trans	-128.4	156.6	169.2	-60.9	-31.1	0	0	0	110.5	N131 A132	W129-N131 PolarHBondContact O-N 2.69Å; W129-A132 WeakPolarHBondContact O-CB 3.26Å; W129-A132 PolarHBondContact O-N 2.85Å
130	D	49.3	Very low	73.5	Confident	173 Å²	173	60.7 Å²	60.7	93%	0.925	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-29.8	-170.5	-60.3	-44.5	0	0	0	115.3
131	N	55	Low	73.6	Confident	129 Å²	129	60.2 Å²	60.2	69%	0.69	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.5	12	178.1	-73.5	-49.7	0	0	0	113.8	T84 W129	T84-N131 HydrophobicContact CG2-CB 4.12Å; W129-N131 PolarHBondContact O-N 2.69Å
132	A	58.6	Low	73.1	Confident	25 Å²	25	64 Å²	64	21%	0.207	33%	0.325	C	S	.	.	S	Bend	trans	-67.1	142.5	179.2	0	0	0	0	0	111.7	L127 W129 K134	L127-A132 HydrophobicContact CD2-CB 3.84Å; L127-A132 HydrophobicContact CG-CB 3.94Å; W129-A132 WeakPolarHBondContact O-CB 3.26Å; W129-A132 PolarHBondContact O-N 2.85Å; A132-K134 PolarHBondContact O-N 3.12Å
133	P	61.9	Low	72.5	Confident	15 Å²	15	62 Å²	62	10%	0.097	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-56.6	132.2	168	24.4	-34	0	0	0	110.6	W91 L127 Y135 C136	W91-P133 HydrophobicContact CZ2-CB 4.39Å; W91-P133 HydrophobicContact CZ2-CG 4.45Å; L127-P133 HydrophobicContact CD2-CG 3.89Å; P133-Y135 PolarHBondContact O-N 2.88Å; P133-C136 VanDerWaalsContact CB-SG 3.59Å; P133-C136 HydrophobicContact CG-CB 4.22Å; P133-C136 VanDerWaalsContact CG-SG 3.55Å; P133-C136 PolarHBondContact O-SG 3.05Å
134	K	68.8	Low	72.4	Confident	156 Å²	156	60.5 Å²	60.5	68%	0.678	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	135.3	-174.8	-65.2	-175.8	179.5	-177.5	0	110.5	A132 Q149	A132-K134 PolarHBondContact O-N 3.12Å; K134-Q149 PolarHBondContact O-NE2 3.26Å
135	Y	79.1	Confident	72.1	Confident	90 Å²	90	59.5 Å²	59.5	35%	0.353	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	35.6	173.7	-43.4	-48.6	0	0	0	115.8	P133 A150 S153	P133-Y135 PolarHBondContact O-N 2.88Å; Y135-A150 WeakPolarHBondContact CB-O 3.38Å; Y135-A150 PolarHBondContact O-N 3.17Å; Y135-S153 VanDerWaalsContact CD1-N 3.34Å
136	C	80.3	Confident	72.1	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.007	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	145.7	179.5	-67.2	0	0	0	0	115.2	L127 P133 L148 Q149	L127-C136 HydrophobicContact CB-CB 4.26Å; L127-C136 HydrophobicContact CD2-CB 4.17Å; L127-C136 PolarHBondContact N-O 3.23Å; P133-C136 VanDerWaalsContact CB-SG 3.59Å; P133-C136 HydrophobicContact CG-CB 4.22Å; P133-C136 VanDerWaalsContact CG-SG 3.55Å; P133-C136 PolarHBondContact O-SG 3.05Å; C136-L148 CarbonylContact C-O 3.6Å; C136-L148 VanDerWaalsContact CA-O 3.27Å; C136-L148 WeakPolarHBondContact CA-O 3.28Å; C136-Q149 VanDerWaalsContact SG-CB 3.55Å
137	I	83.6	Confident	72.2	Confident	0 Å²	0	53 Å²	53	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	139.5	171.8	-50.3	167.1	0	0	0	108.3	L124 L126 L147 L148 R156 W159 F160	L124-I137 HydrophobicContact CD1-CG2 3.65Å; L124-I137 HydrophobicContact CG-CG2 4.49Å; L126-I137 HydrophobicContact CD2-CG1 4.35Å; I137-L147 WeakPolarHBondContact O-CA 3.41Å; I137-L148 HydrophobicContact CB-CB 4.34Å; I137-L148 PolarHBondContact N-O 3.04Å; I137-L148 PolarHBondContact O-N 3.38Å; I137-R156 HydrophobicContact CD1-CG 4.33Å; I137-R156 WeakPolarHBondContact CD1-O 3.44Å; I137-R156 HydrophobicContact CG1-CG 3.7Å; I137-W159 HydrophobicContact CD1-CB 3.45Å; I137-W159 VanDerWaalsContact CD1-CB 3.45Å; I137-F160 HydrophobicContact CD1-CB 4.16Å; I137-F160 HydrophobicContact CG1-CB 4.45Å; I137-F160 HydrophobicContact CG2-CD2 4.15Å
138	Q	83.3	Confident	72.6	Confident	16 Å²	16	52.1 Å²	52.1	8%	0.075	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.3	178.7	-173.2	-179.3	-30.8	0	0	111.6	L79 L124 Q125 T145 L147	L79-Q138 VanDerWaalsContact CD2-CD 3.5Å; L79-Q138 HydrophobicContact CD2-CG 4.4Å; L124-Q138 WeakPolarHBondContact CA-O 3.28Å; Q125-Q138 HydrophobicContact CB-CB 4.49Å; Q125-Q138 PolarHBondContact N-O 2.85Å; Q125-Q138 PolarHBondContact O-N 2.68Å; Q138-T145 HydrophobicContact CG-CG2 3.39Å; Q138-L147 HydrophobicContact CB-CD2 4.02Å; Q138-L147 HydrophobicContact CG-CD2 4.02Å
139	L	83.6	Confident	73.9	Confident	2 Å²	2	49.4 Å²	49.4	1%	0.01	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	119	172.2	-71.1	166.4	0	0	0	109.1	L103 I121 L124 T145 I146 L148	L103-L139 HydrophobicContact CD2-CD1 4.34Å; I121-L139 HydrophobicContact CD1-CD2 4.1Å; I121-L139 HydrophobicContact CG1-CD2 4.48Å; I121-L139 HydrophobicContact CG2-CD2 3.67Å; L124-L139 HydrophobicContact CD1-CD2 3.41Å; L124-L139 VanDerWaalsContact CD1-CD2 3.41Å; L124-L139 HydrophobicContact CD1-CG 4.15Å; L139-T145 CarbonylContact O-C 3.6Å; L139-T145 WeakPolarHBondContact O-CA 3.05Å; L139-I146 HydrophobicContact CB-CB 4.12Å; L139-I146 HydrophobicContact CD1-CB 4.47Å; L139-I146 HydrophobicContact CD1-CG2 4.32Å; L139-I146 PolarHBondContact N-O 3.38Å; L139-I146 PolarHBondContact O-N 2.7Å; L139-L148 HydrophobicContact CD1-CD1 3.69Å; L139-L148 HydrophobicContact CD1-CG 4.01Å
140	S	80.4	Confident	74.9	Confident	2 Å²	2	41.6 Å²	41.6	1%	0.014	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	130.3	174.8	-55.6	0	0	0	0	110.7	I121 E122 D123	I121-S140 CarbonylContact C-O 3.21Å; E122-S140 PolarHBondContact N-O 3.22Å; D123-S140 PolarHBondContact O-N 2.86Å
141	I	80.1	Confident	76.5	Confident	27 Å²	27	37.5 Å²	37.5	14%	0.138	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	146.2	-174.4	-68.3	168.8	0	0	0	108.4	L116 G143 G144 I146	L116-I141 HydrophobicContact CD1-CD1 4.41Å; L116-I141 HydrophobicContact CD2-CD1 3.92Å; I141-G143 PolarHBondContact O-N 3.03Å; I141-G144 PolarHBondContact N-O 3.3Å; I141-G144 PolarHBondContact O-N 2.96Å; I141-I146 HydrophobicContact CD1-CD1 3.51Å; I141-I146 HydrophobicContact CD1-CG1 3.88Å
142	P	70.2	Confident	77.8	Confident	89 Å²	89	34.5 Å²	34.5	58%	0.578	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	108.8	173.1	24.7	-34	0	0	0	110.2	S120	S120-P142 WeakPolarHBondContact O-CD 3.27Å
143	G	68	Low	78.9	Confident	71 Å²	71	35.8 Å²	35.8	73%	0.732	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	110.8	-6.1	-176.1	0	0	0	0	0	116.1	I141	I141-G143 PolarHBondContact O-N 3.03Å
144	G	75.9	Confident	80	Confident	16 Å²	16	39.4 Å²	39.4	17%	0.165	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	171.4	-173.9	175.2	0	0	0	0	0	116.1	V72 I141	V72-G144 CarbonylContact O-C 3.59Å; V72-G144 VanDerWaalsContact O-CA 3.26Å; V72-G144 WeakPolarHBondContact O-CA 3.28Å; I141-G144 PolarHBondContact N-O 3.3Å; I141-G144 PolarHBondContact O-N 2.96Å
145	T	78.1	Confident	80.6	Confident	2 Å²	2	34.4 Å²	34.4	1%	0.012	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	131.7	174.4	-59	0	0	0	0	109.6	V72 L79 Q138 L139 L147	V72-T145 PolarHBondContact N-O 2.87Å; V72-T145 PolarHBondContact O-N 2.84Å; L79-T145 HydrophobicContact CD1-CG2 4.2Å; L79-T145 HydrophobicContact CD2-CG2 3.97Å; Q138-T145 HydrophobicContact CG-CG2 3.39Å; L139-T145 CarbonylContact O-C 3.6Å; L139-T145 WeakPolarHBondContact O-CA 3.05Å; T145-L147 HydrophobicContact CG2-CD2 4.25Å; T145-L147 HydrophobicContact CG2-CG 4.48Å
146	I	81.2	Confident	81	Confident	11 Å²	11	32.8 Å²	32.8	6%	0.056	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	133.5	172.4	-59.5	-171.7	0	0	0	108.4	V69 V71 L116 L139 I141 L148	V69-I146 HydrophobicContact CG1-CG2 3.7Å; V71-I146 HydrophobicContact CB-CG1 4.4Å; V71-I146 HydrophobicContact CG1-CG1 4.07Å; V71-I146 HydrophobicContact CG2-CB 4.38Å; V71-I146 HydrophobicContact CG2-CD1 4Å; V71-I146 HydrophobicContact CG2-CG1 3.74Å; V71-I146 HydrophobicContact CG2-CG2 4.16Å; L116-I146 HydrophobicContact CD1-CD1 3.43Å; L116-I146 VanDerWaalsContact CD1-CD1 3.43Å; L116-I146 HydrophobicContact CD2-CD1 4.17Å; L116-I146 HydrophobicContact CG-CD1 4.44Å; L139-I146 HydrophobicContact CB-CB 4.12Å; L139-I146 HydrophobicContact CD1-CB 4.47Å; L139-I146 HydrophobicContact CD1-CG2 4.32Å; L139-I146 PolarHBondContact N-O 3.38Å; L139-I146 PolarHBondContact O-N 2.7Å; I141-I146 HydrophobicContact CD1-CD1 3.51Å; I141-I146 HydrophobicContact CD1-CG1 3.88Å; I146-L148 HydrophobicContact CG2-CD2 4.15Å
147	L	82.1	Confident	81.1	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	130.2	178	-62	168.1	0	0	0	108.8	V69 C70 V72 L79 L83 W91 I137 Q138 T145	V69-L147 WeakPolarHBondContact CA-O 3.33Å; C70-L147 HydrophobicContact CB-CB 4.42Å; C70-L147 PolarHBondContact N-O 3.29Å; C70-L147 PolarHBondContact O-N 3.03Å; V72-L147 HydrophobicContact CG2-CD1 4.39Å; L79-L147 HydrophobicContact CD1-CD1 4.46Å; L83-L147 HydrophobicContact CD1-CD1 3.7Å; L83-L147 HydrophobicContact CD2-CD1 3.39Å; L83-L147 HydrophobicContact CG-CD1 4.12Å; W91-L147 HydrophobicContact CH2-CB 3.89Å; W91-L147 HydrophobicContact CZ3-CB 4.24Å; I137-L147 WeakPolarHBondContact O-CA 3.41Å; Q138-L147 HydrophobicContact CB-CD2 4.02Å; Q138-L147 HydrophobicContact CG-CD2 4.02Å; T145-L147 HydrophobicContact CG2-CD2 4.25Å; T145-L147 HydrophobicContact CG2-CG 4.48Å
148	L	83.8	Confident	81.2	Confident	1 Å²	1	34.7 Å²	34.7	1%	0.005	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	117.7	176.1	-56.2	-179.6	0	0	0	108.4	I67 Q68 V69 L96 C136 I137 L139 I146 L163	I67-L148 HydrophobicContact CD1-CB 3.63Å; I67-L148 HydrophobicContact CG1-CB 4.09Å; Q68-L148 CarbonylContact O-C 3.59Å; Q68-L148 WeakPolarHBondContact O-CA 3.42Å; V69-L148 HydrophobicContact CB-CD2 4.36Å; V69-L148 HydrophobicContact CG1-CD2 4.07Å; V69-L148 HydrophobicContact CG2-CD2 3.78Å; L96-L148 HydrophobicContact CD1-CD2 4Å; C136-L148 CarbonylContact C-O 3.6Å; C136-L148 VanDerWaalsContact CA-O 3.27Å; C136-L148 WeakPolarHBondContact CA-O 3.28Å; I137-L148 HydrophobicContact CB-CB 4.34Å; I137-L148 PolarHBondContact N-O 3.04Å; I137-L148 PolarHBondContact O-N 3.38Å; L139-L148 HydrophobicContact CD1-CD1 3.69Å; L139-L148 HydrophobicContact CD1-CG 4.01Å; I146-L148 HydrophobicContact CG2-CD2 4.15Å; L148-L163 HydrophobicContact CD1-CD1 3.73Å
149	Q	84.5	Confident	81.2	Confident	43 Å²	43	34.1 Å²	34.1	20%	0.201	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	112.5	178.8	-180	166.2	31.2	0	0	110.8	I67 Q68 W91 K134 C136	I67-Q149 VanDerWaalsContact CG1-O 3.31Å; I67-Q149 WeakPolarHBondContact CG1-O 3.42Å; Q68-Q149 HydrophobicContact CB-CB 4.18Å; Q68-Q149 PolarHBondContact N-O 2.85Å; Q68-Q149 VanDerWaalsContact N-O 3.16Å; Q68-Q149 PolarHBondContact O-N 2.97Å; W91-Q149 HydrophobicContact CE3-CB 4.09Å; W91-Q149 HydrophobicContact CH2-CB 3.66Å; W91-Q149 HydrophobicContact CZ2-CB 4.35Å; W91-Q149 HydrophobicContact CZ3-CB 3.5Å; K134-Q149 PolarHBondContact O-NE2 3.26Å; C136-Q149 VanDerWaalsContact SG-CB 3.55Å
150	A	85.1	Confident	81.4	Confident	5 Å²	5	35.2 Å²	35.2	4%	0.041	22%	0.217	C	C	.	.			trans	-84.9	159.2	175.4	0	0	0	0	0	111.8	I67 Y135 N152 L155 R156	I67-A150 HydrophobicContact CD1-CB 4.42Å; Y135-A150 WeakPolarHBondContact CB-O 3.38Å; Y135-A150 PolarHBondContact O-N 3.17Å; A150-N152 VanDerWaalsContact C-N 3.33Å; A150-N152 PolarHBondContact O-N 2.85Å; A150-L155 HydrophobicContact CB-CB 3.91Å; A150-R156 HydrophobicContact CB-CB 4.09Å
151	A	82.4	Confident	81.6	Confident	87 Å²	87	37.1 Å²	37.1	72%	0.719	23%	0.225	S	C	*	.	S	Bend	trans	-70.4	-25.2	-178.6	0	0	0	0	0	114.2	L155	A151-L155 HydrophobicContact CB-CD1 4.1Å
152	N	83.6	Confident	81.9	Confident	65 Å²	65	35.9 Å²	35.9	35%	0.348	22%	0.219	S	C	.	.	S	Bend	trans	-150.3	171.8	178.3	64.6	44.5	0	0	0	111.8	A150 Y154 L155 R156	A150-N152 VanDerWaalsContact C-N 3.33Å; A150-N152 PolarHBondContact O-N 2.85Å; N152-Y154 PolarHBondContact OD1-N 2.65Å; N152-L155 PolarHBondContact O-N 2.98Å; N152-L155 WeakPolarHBondContact OD1-CB 3.49Å; N152-L155 WeakPolarHBondContact OD1-CG 3.14Å; N152-L155 PolarHBondContact OD1-N 3.07Å; N152-R156 PolarHBondContact O-N 2.93Å
153	S	82	Confident	82.6	Confident	53 Å²	53	31.9 Å²	31.9	37%	0.371	19%	0.192	S	C	.	.	H	α-helix	trans	-61.2	-42.8	-179.6	43.8	0	0	0	0	113.2	Y135 L155 R156 D157	Y135-S153 VanDerWaalsContact CD1-N 3.34Å; S153-L155 PolarHBondContact O-N 3.5Å; S153-R156 WeakPolarHBondContact O-CB 3.38Å; S153-R156 PolarHBondContact O-N 3.44Å; S153-D157 PolarHBondContact O-N 3.25Å
154	Y	83.4	Confident	83.4	Confident	91 Å²	91	31.7 Å²	31.7	36%	0.357	17%	0.172	S	C	.	.	H	α-helix	trans	-60.7	-45.4	179.6	178.4	-90.5	0	0	0	111.7	Y59 N152 D157 Q158	Y59-Y154 AromaticContact CD1-CD2 3.83Å; Y59-Y154 HydrophobicContact CD1-CD2 3.83Å; Y59-Y154 HydrophobicContact CD1-CE1 4.47Å; Y59-Y154 AromaticContact CD1-CE2 3.51Å; Y59-Y154 HydrophobicContact CD1-CE2 3.51Å; Y59-Y154 HydrophobicContact CD1-CG 4.43Å; Y59-Y154 AromaticContact CD1-CZ 3.87Å; Y59-Y154 AromaticContact CE1-CD2 3.59Å; Y59-Y154 HydrophobicContact CE1-CD2 3.59Å; Y59-Y154 AromaticContact CE1-CE2 3.71Å; Y59-Y154 HydrophobicContact CE1-CE2 3.71Å; Y59-Y154 HydrophobicContact CE1-CG 4.25Å; N152-Y154 PolarHBondContact OD1-N 2.65Å; Y154-D157 PolarHBondContact O-N 2.82Å; Y154-Q158 VanDerWaalsContact O-CB 3.25Å; Y154-Q158 WeakPolarHBondContact O-CB 3.42Å; Y154-Q158 PolarHBondContact O-N 2.69Å
155	L	83	Confident	83.9	Confident	51 Å²	51	31.6 Å²	31.6	27%	0.267	17%	0.167	S	C	.	.	H	α-helix	trans	-65.3	-38.9	175.5	-72.5	170.6	0	0	0	111.8	A150 A151 N152 S153 D157 Q158 W159	A150-L155 HydrophobicContact CB-CB 3.91Å; A151-L155 HydrophobicContact CB-CD1 4.1Å; N152-L155 PolarHBondContact O-N 2.98Å; N152-L155 WeakPolarHBondContact OD1-CB 3.49Å; N152-L155 WeakPolarHBondContact OD1-CG 3.14Å; N152-L155 PolarHBondContact OD1-N 3.07Å; S153-L155 PolarHBondContact O-N 3.5Å; L155-D157 VanDerWaalsContact C-N 3.35Å; L155-D157 PolarHBondContact O-N 3.2Å; L155-Q158 PolarHBondContact O-N 3.07Å; L155-W159 WeakPolarHBondContact O-CB 3.42Å; L155-W159 PolarHBondContact O-N 2.95Å
156	R	85.8	Confident	84.1	Confident	55 Å²	55	33.2 Å²	33.2	21%	0.208	17%	0.174	C	C	.	.	H	α-helix	trans	-56.7	-50.1	173.4	178.3	-156.3	63	-157.3	-9.4	110.6	L126 I137 A150 N152 S153 W159 F160	L126-R156 HydrophobicContact CD2-CG 4.01Å; I137-R156 HydrophobicContact CD1-CG 4.33Å; I137-R156 WeakPolarHBondContact CD1-O 3.44Å; I137-R156 HydrophobicContact CG1-CG 3.7Å; A150-R156 HydrophobicContact CB-CB 4.09Å; N152-R156 PolarHBondContact O-N 2.93Å; S153-R156 WeakPolarHBondContact O-CB 3.38Å; S153-R156 PolarHBondContact O-N 3.44Å; R156-W159 PolarHBondContact O-N 3.37Å; R156-F160 WeakPolarHBondContact O-CB 3.44Å; R156-F160 PolarHBondContact O-N 3.09Å
157	D	83.4	Confident	84.2	Confident	22 Å²	22	35.1 Å²	35.1	12%	0.118	18%	0.182	C	C	.	.	H	α-helix	trans	-71.9	-35.4	-175.7	-62.8	-25.3	0	0	0	111.4	Y59 S153 Y154 L155 F160 H161	Y59-D157 HydrophobicContact CE1-CB 3.69Å; Y59-D157 HydrophobicContact CE2-CB 4.12Å; Y59-D157 VanDerWaalsContact CZ-CB 3.45Å; Y59-D157 WeakPolarHBondContact OH-CB 3.26Å; S153-D157 PolarHBondContact O-N 3.25Å; Y154-D157 PolarHBondContact O-N 2.82Å; L155-D157 VanDerWaalsContact C-N 3.35Å; L155-D157 PolarHBondContact O-N 3.2Å; D157-F160 PolarHBondContact O-N 3.14Å; D157-H161 WeakPolarHBondContact O-CB 3.4Å; D157-H161 PolarHBondContact O-CD2 3.22Å; D157-H161 PolarHBondContact O-N 3.12Å
158	Q	84.6	Confident	84.3	Confident	19 Å²	19	39.1 Å²	39.1	9%	0.089	20%	0.199	C	C	.	.	H	α-helix	trans	-59.8	-48.4	170.2	-174.3	175.3	19	0	0	112.6	Y59 K60 L62 Y154 L155 S162	Y59-Q158 HydrophobicContact CD1-CB 3.97Å; Y59-Q158 HydrophobicContact CG-CB 4.41Å; K60-Q158 VanDerWaalsContact O-CG 3.26Å; K60-Q158 WeakPolarHBondContact O-CG 3.21Å; K60-Q158 PolarHBondContact O-NE2 3.33Å; L62-Q158 HydrophobicContact CB-CG 4.17Å; L62-Q158 HydrophobicContact CD1-CG 4.38Å; Y154-Q158 VanDerWaalsContact O-CB 3.25Å; Y154-Q158 WeakPolarHBondContact O-CB 3.42Å; Y154-Q158 PolarHBondContact O-N 2.69Å; L155-Q158 PolarHBondContact O-N 3.07Å; Q158-S162 VanDerWaalsContact O-CB 3.23Å; Q158-S162 WeakPolarHBondContact O-CB 3.34Å; Q158-S162 PolarHBondContact O-N 2.81Å; Q158-S162 PolarHBondContact O-OG 3.3Å
159	W	84.9	Confident	84.4	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.015	20%	0.204	C	C	.	.	H	α-helix	trans	-63	-44.4	175.4	-89.2	107.4	0	0	0	111.4	L62 I67 L96 L98 I137 L155 R156 S162 L163	L62-W159 HydrophobicContact CD2-CD2 3.83Å; L62-W159 VanDerWaalsContact CD2-CE2 3.49Å; L62-W159 HydrophobicContact CD2-CE3 3.94Å; L62-W159 HydrophobicContact CD2-CH2 3.43Å; L62-W159 VanDerWaalsContact CD2-CH2 3.43Å; L62-W159 HydrophobicContact CD2-CZ2 3.32Å; L62-W159 HydrophobicContact CD2-CZ3 3.75Å; I67-W159 HydrophobicContact CB-CZ2 4.23Å; I67-W159 HydrophobicContact CD1-CD2 3.91Å; I67-W159 HydrophobicContact CD1-CG 3.84Å; I67-W159 HydrophobicContact CD1-CZ2 4.47Å; I67-W159 HydrophobicContact CG2-CZ2 4.18Å; L96-W159 HydrophobicContact CB-CH2 3.82Å; L96-W159 HydrophobicContact CB-CZ3 4.4Å; L98-W159 HydrophobicContact CD1-CZ3 4.26Å; L98-W159 HydrophobicContact CD2-CZ3 3.92Å; L98-W159 HydrophobicContact CG-CZ3 4.02Å; I137-W159 HydrophobicContact CD1-CB 3.45Å; I137-W159 VanDerWaalsContact CD1-CB 3.45Å; L155-W159 WeakPolarHBondContact O-CB 3.42Å; L155-W159 PolarHBondContact O-N 2.95Å; R156-W159 PolarHBondContact O-N 3.37Å; W159-S162 PolarHBondContact O-N 3.38Å; W159-L163 HydrophobicContact CE3-CD1 4.39Å; W159-L163 HydrophobicContact CE3-CG 4.42Å; W159-L163 VanDerWaalsContact O-CB 3.3Å; W159-L163 WeakPolarHBondContact O-CB 3.38Å; W159-L163 VanDerWaalsContact O-CG 3.25Å; W159-L163 WeakPolarHBondContact O-CG 3.43Å; W159-L163 PolarHBondContact O-N 2.99Å
160	F	86.5	Confident	84.3	Confident	26 Å²	26	40.7 Å²	40.7	11%	0.114	21%	0.205	C	C	.	.	H	α-helix	trans	-59.6	-51	178.9	173.7	-98.9	0	0	0	111.7	L124 L126 I137 R156 D157 L163 Q164	L124-F160 HydrophobicContact CD1-CD2 4.39Å; L124-F160 HydrophobicContact CD2-CD2 3.78Å; L124-F160 HydrophobicContact CD2-CE2 3.79Å; L124-F160 HydrophobicContact CG-CD2 3.79Å; L124-F160 HydrophobicContact CG-CE2 3.7Å; L126-F160 HydrophobicContact CD1-CD1 4.34Å; L126-F160 HydrophobicContact CD1-CE1 4.44Å; L126-F160 HydrophobicContact CD1-CG 4.48Å; L126-F160 HydrophobicContact CD2-CB 3.75Å; L126-F160 HydrophobicContact CD2-CD1 4.26Å; L126-F160 HydrophobicContact CD2-CD2 3.59Å; L126-F160 HydrophobicContact CD2-CE2 4.24Å; L126-F160 HydrophobicContact CD2-CG 3.6Å; L126-F160 HydrophobicContact CG-CD1 4.3Å; L126-F160 HydrophobicContact CG-CD2 3.82Å; L126-F160 HydrophobicContact CG-CE1 4.43Å; L126-F160 HydrophobicContact CG-CE2 3.95Å; L126-F160 HydrophobicContact CG-CG 4.01Å; L126-F160 HydrophobicContact CG-CZ 4.27Å; I137-F160 HydrophobicContact CD1-CB 4.16Å; I137-F160 HydrophobicContact CG1-CB 4.45Å; I137-F160 HydrophobicContact CG2-CD2 4.15Å; R156-F160 WeakPolarHBondContact O-CB 3.44Å; R156-F160 PolarHBondContact O-N 3.09Å; D157-F160 PolarHBondContact O-N 3.14Å; F160-L163 PolarHBondContact O-N 3.48Å; F160-Q164 VanDerWaalsContact O-CB 3.3Å; F160-Q164 WeakPolarHBondContact O-CB 3.43Å; F160-Q164 PolarHBondContact O-N 3.3Å
161	H	85.6	Confident	84.3	Confident	42 Å²	42	46.1 Å²	46.1	19%	0.194	23%	0.228	C	C	.	.	H	α-helix	trans	-66.5	-38.4	178.1	-68.8	-54.2	0	0	0	112.4	Y59 D157 Q164 W165 P200 L201	Y59-H161 AromaticContact CD2-CD2 3.55Å; Y59-H161 AromaticContact CE2-CD2 3.59Å; Y59-H161 AromaticContact CE2-NE2 3.88Å; D157-H161 WeakPolarHBondContact O-CB 3.4Å; D157-H161 PolarHBondContact O-CD2 3.22Å; D157-H161 PolarHBondContact O-N 3.12Å; H161-Q164 PolarHBondContact O-N 2.88Å; H161-W165 VanDerWaalsContact O-CB 3.29Å; H161-W165 WeakPolarHBondContact O-CB 3.47Å; H161-W165 PolarHBondContact O-N 3.48Å; H161-P200 HydrophobicContact CB-CG 4.38Å; H161-L201 HydrophobicContact CB-CD1 4.28Å; H161-L201 HydrophobicContact CB-CD2 3.95Å; H161-L201 HydrophobicContact CB-CG 4.02Å
162	S	85.6	Confident	84.3	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64.2	-42.9	176.8	-59.7	0	0	0	0	112.6	L62 Q158 W159 W165 K166	L62-S162 PolarHBondContact N-OG 2.79Å; L62-S162 VanDerWaalsContact N-OG 3.08Å; Q158-S162 VanDerWaalsContact O-CB 3.23Å; Q158-S162 WeakPolarHBondContact O-CB 3.34Å; Q158-S162 PolarHBondContact O-N 2.81Å; Q158-S162 PolarHBondContact O-OG 3.3Å; W159-S162 PolarHBondContact O-N 3.38Å; S162-W165 PolarHBondContact O-N 2.91Å; S162-K166 PolarHBondContact O-N 3.25Å
163	L	84.4	Confident	84.3	Confident	5 Å²	5	45 Å²	45	3%	0.026	20%	0.2	C	C	.	.	H	α-helix	trans	-66.3	-43.7	175.1	-74.9	168	0	0	0	112	L98 L103 L124 L148 W159 F160 W165 K167	L98-L163 HydrophobicContact CD1-CD2 4.21Å; L98-L163 HydrophobicContact CD1-CG 4.48Å; L98-L163 HydrophobicContact CD2-CD2 3.56Å; L103-L163 HydrophobicContact CD1-CD2 3.99Å; L103-L163 HydrophobicContact CD2-CD2 3.72Å; L103-L163 HydrophobicContact CG-CD2 3.93Å; L124-L163 HydrophobicContact CD1-CB 4.42Å; L124-L163 HydrophobicContact CD1-CD1 4.43Å; L124-L163 HydrophobicContact CD2-CB 4.24Å; L148-L163 HydrophobicContact CD1-CD1 3.73Å; W159-L163 HydrophobicContact CE3-CD1 4.39Å; W159-L163 HydrophobicContact CE3-CG 4.42Å; W159-L163 VanDerWaalsContact O-CB 3.3Å; W159-L163 WeakPolarHBondContact O-CB 3.38Å; W159-L163 VanDerWaalsContact O-CG 3.25Å; W159-L163 WeakPolarHBondContact O-CG 3.43Å; W159-L163 PolarHBondContact O-N 2.99Å; F160-L163 PolarHBondContact O-N 3.48Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.45Å; L163-K167 VanDerWaalsContact O-CB 3.27Å; L163-K167 WeakPolarHBondContact O-CB 3.1Å; L163-K167 PolarHBondContact O-N 2.8Å
164	Q	85.2	Confident	84.2	Confident	67 Å²	67	48.9 Å²	48.9	31%	0.313	21%	0.21	S	C	.	.	H	α-helix	trans	-60.5	-41.9	175.9	-172.8	176	-56.8	0	0	111.2	L124 F160 H161 K168	L124-Q164 HydrophobicContact CD2-CB 3.79Å; F160-Q164 VanDerWaalsContact O-CB 3.3Å; F160-Q164 WeakPolarHBondContact O-CB 3.43Å; F160-Q164 PolarHBondContact O-N 3.3Å; H161-Q164 PolarHBondContact O-N 2.88Å; Q164-K168 WeakPolarHBondContact O-CB 3.49Å; Q164-K168 VanDerWaalsContact O-CG 3.31Å; Q164-K168 WeakPolarHBondContact O-CG 3.48Å; Q164-K168 PolarHBondContact O-N 2.88Å; Q164-K168 VanDerWaalsContact O-N 3.11Å
165	W	85.6	Confident	83.9	Confident	15 Å²	15	47.3 Å²	47.3	6%	0.057	21%	0.21	C	C	.	.	H	α-helix	trans	-62.6	-57.1	176	-179.5	-104.9	0	0	0	111.8	L61 H161 S162 L163 K167 K168 I169 M195 A196 L201 I206 P210	L61-W165 HydrophobicContact CD1-CG 4.47Å; H161-W165 VanDerWaalsContact O-CB 3.29Å; H161-W165 WeakPolarHBondContact O-CB 3.47Å; H161-W165 PolarHBondContact O-N 3.48Å; S162-W165 PolarHBondContact O-N 2.91Å; L163-W165 VanDerWaalsContact C-N 3.3Å; L163-W165 PolarHBondContact O-N 3.45Å; W165-K167 PolarHBondContact O-N 3.03Å; W165-K168 PolarHBondContact O-N 3.5Å; W165-K168 VanDerWaalsContact O-N 3.17Å; W165-I169 HydrophobicContact CD2-CG1 4.19Å; W165-I169 HydrophobicContact CH2-CD1 4.19Å; W165-I169 HydrophobicContact CZ2-CD1 3.69Å; W165-I169 HydrophobicContact CZ2-CG1 3.87Å; W165-I169 WeakPolarHBondContact O-CG1 3.47Å; W165-I169 PolarHBondContact O-N 3.47Å; W165-M195 HydrophobicContact CE3-SD 3.87Å; W165-M195 HydrophobicContact CZ3-CG 4.1Å; W165-M195 HydrophobicContact CZ3-SD 3.66Å; W165-A196 HydrophobicContact CH2-CB 3.85Å; W165-A196 HydrophobicContact CZ3-CB 4.37Å; W165-L201 HydrophobicContact CB-CD1 3.72Å; W165-L201 HydrophobicContact CG-CD1 4.03Å; W165-I206 HydrophobicContact CD2-CG1 4.45Å; W165-I206 HydrophobicContact CE3-CG2 4.41Å; W165-I206 HydrophobicContact CH2-CB 4.41Å; W165-I206 HydrophobicContact CH2-CG2 3.6Å; W165-I206 WeakPolarHBondContact CH2-O 3.4Å; W165-I206 HydrophobicContact CZ2-CB 3.99Å; W165-I206 HydrophobicContact CZ2-CG1 4.23Å; W165-I206 HydrophobicContact CZ2-CG2 3.68Å; W165-I206 WeakPolarHBondContact CZ2-O 3.4Å; W165-I206 HydrophobicContact CZ3-CG2 3.97Å; W165-P210 HydrophobicContact CH2-CG 4.32Å
166	K	83.7	Confident	83.6	Confident	36 Å²	36	45 Å²	45	16%	0.157	20%	0.198	C	C	.	.	H	α-helix	trans	-58.8	-43.6	-180	-82.2	-90.8	-178.7	160.5	0	112.7	L98 D100 Y118 S162 K168 I169 Y170	L98-K166 HydrophobicContact CB-CG 4.4Å; L98-K166 HydrophobicContact CD1-CG 4.4Å; L98-K166 WeakPolarHBondContact O-CE 3.27Å; L98-K166 PolarHBondContact O-NZ 3.18Å; D100-K166 IonicContact OD1-NZ 2.81Å; D100-K166 PolarHBondContact OD1-NZ 3.25Å; Y118-K166 HydrophobicContact CE1-CB 4Å; Y118-K166 HydrophobicContact CE2-CB 4.25Å; S162-K166 PolarHBondContact O-N 3.25Å; K166-K168 PolarHBondContact O-N 2.83Å; K166-I169 PolarHBondContact O-N 2.88Å; K166-Y170 WeakPolarHBondContact O-CB 3.2Å; K166-Y170 PolarHBondContact O-N 3.39Å
167	K	83.9	Confident	82.9	Confident	51 Å²	51	46.3 Å²	46.3	22%	0.222	21%	0.209	C	C	.	.	H	α-helix	trans	-59.7	-44.5	175.1	179.5	-178.3	173.2	-178.5	0	112	Y118 I121 E122 L163 W165 K171	Y118-K167 HydrophobicContact CD1-CB 4.18Å; I121-K167 HydrophobicContact CB-CD 4.28Å; I121-K167 HydrophobicContact CG2-CD 4.19Å; I121-K167 WeakPolarHBondContact O-CE 3.36Å; I121-K167 PolarHBondContact O-NZ 3.4Å; E122-K167 VanDerWaalsContact C-NZ 3.32Å; E122-K167 PolarHBondContact O-NZ 3.39Å; L163-K167 VanDerWaalsContact O-CB 3.27Å; L163-K167 WeakPolarHBondContact O-CB 3.1Å; L163-K167 PolarHBondContact O-N 2.8Å; W165-K167 PolarHBondContact O-N 3.03Å; K167-K171 PolarHBondContact O-N 3.08Å; K167-K171 VanDerWaalsContact O-N 3.15Å
168	K	83.7	Confident	82.3	Confident	84 Å²	84	51 Å²	51	37%	0.365	23%	0.234	S	C	.	.	H	α-helix	trans	-66	-49.1	177.1	-75	-175.8	-178.4	-171.7	0	111	Q164 W165 K166 Y170 K171 Y172 M195	Q164-K168 WeakPolarHBondContact O-CB 3.49Å; Q164-K168 VanDerWaalsContact O-CG 3.31Å; Q164-K168 WeakPolarHBondContact O-CG 3.48Å; Q164-K168 PolarHBondContact O-N 2.88Å; Q164-K168 VanDerWaalsContact O-N 3.11Å; W165-K168 PolarHBondContact O-N 3.5Å; W165-K168 VanDerWaalsContact O-N 3.17Å; K166-K168 PolarHBondContact O-N 2.83Å; K168-Y170 VanDerWaalsContact C-N 3.29Å; K168-Y170 PolarHBondContact O-N 2.89Å; K168-K171 WeakPolarHBondContact O-CA 3.47Å; K168-K171 WeakPolarHBondContact O-CB 3.34Å; K168-K171 PolarHBondContact O-N 3.33Å; K168-Y172 WeakPolarHBondContact O-CD2 3.28Å; K168-Y172 PolarHBondContact O-N 3.06Å; K168-M195 HydrophobicContact CB-CE 3.77Å; K168-M195 HydrophobicContact CB-SD 3.62Å; K168-M195 HydrophobicContact CD-CE 3.92Å; K168-M195 HydrophobicContact CD-CG 4.01Å; K168-M195 HydrophobicContact CD-SD 3.35Å; K168-M195 WeakPolarHBondContact CD-SD 3.41Å; K168-M195 HydrophobicContact CG-CE 4.41Å; K168-M195 HydrophobicContact CG-SD 4.14Å
169	I	84.9	Confident	81.5	Confident	22 Å²	22	52.6 Å²	52.6	11%	0.113	25%	0.246	C	C	.	.	H	α-helix	trans	-53.9	-44.6	177.2	-75.1	-68.7	0	0	0	111.9	W165 K166 K171 Y172 R173 L192 A209 I213	W165-I169 HydrophobicContact CD2-CG1 4.19Å; W165-I169 HydrophobicContact CH2-CD1 4.19Å; W165-I169 HydrophobicContact CZ2-CD1 3.69Å; W165-I169 HydrophobicContact CZ2-CG1 3.87Å; W165-I169 WeakPolarHBondContact O-CG1 3.47Å; W165-I169 PolarHBondContact O-N 3.47Å; K166-I169 PolarHBondContact O-N 2.88Å; I169-K171 PolarHBondContact O-N 2.77Å; I169-Y172 PolarHBondContact O-N 3.07Å; I169-R173 PolarHBondContact O-N 2.64Å; I169-L192 HydrophobicContact CD1-CD1 3.91Å; I169-A209 HydrophobicContact CD1-CB 4.43Å; I169-I213 HydrophobicContact CD1-CD1 4.15Å; I169-I213 HydrophobicContact CG2-CD1 4.05Å
170	Y	83.9	Confident	80.5	Confident	54 Å²	54	57.6 Å²	57.6	21%	0.212	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-43.2	174.7	176.4	-91.1	0	0	0	112.5	D100 Y118 S119 K166 K168 R173 K174	D100-Y170 WeakPolarHBondContact O-CD2 3.4Å; Y118-Y170 HydrophobicContact CD2-CD2 4.18Å; Y118-Y170 AromaticContact CD2-CG 3.96Å; Y118-Y170 HydrophobicContact CD2-CG 3.96Å; Y118-Y170 HydrophobicContact CG-CG 4.42Å; S119-Y170 WeakPolarHBondContact OG-CE1 3.28Å; S119-Y170 PolarHBondContact OG-OH 3.03Å; K166-Y170 WeakPolarHBondContact O-CB 3.2Å; K166-Y170 PolarHBondContact O-N 3.39Å; K168-Y170 VanDerWaalsContact C-N 3.29Å; K168-Y170 PolarHBondContact O-N 2.89Å; Y170-R173 PolarHBondContact O-N 2.81Å; Y170-K174 PolarHBondContact O-N 3.14Å
171	K	84.4	Confident	80	Confident	119 Å²	119	64 Å²	64	52%	0.517	31%	0.305	S	S	.	.	H	α-helix	trans	-58.7	-48.7	173.8	-175.2	-164.9	172.6	-161.6	0	111.1	K167 K168 I169 K174 V175	K167-K171 PolarHBondContact O-N 3.08Å; K167-K171 VanDerWaalsContact O-N 3.15Å; K168-K171 WeakPolarHBondContact O-CA 3.47Å; K168-K171 WeakPolarHBondContact O-CB 3.34Å; K168-K171 PolarHBondContact O-N 3.33Å; I169-K171 PolarHBondContact O-N 2.77Å; K171-K174 PolarHBondContact O-N 2.68Å; K171-V175 HydrophobicContact CG-CG2 4.29Å; K171-V175 WeakPolarHBondContact O-CG2 3.35Å; K171-V175 PolarHBondContact O-N 3.47Å
172	Y	82.9	Confident	79.5	Confident	25 Å²	25	64.7 Å²	64.7	10%	0.098	31%	0.306	C	S	.	.	H	α-helix	trans	-63.8	-43.4	-179.1	-79.8	-79.3	0	0	0	112.2	K168 I169 K174 V175 L176 E188 A191 L192 M195	K168-Y172 WeakPolarHBondContact O-CD2 3.28Å; K168-Y172 PolarHBondContact O-N 3.06Å; I169-Y172 PolarHBondContact O-N 3.07Å; Y172-K174 VanDerWaalsContact C-N 3.3Å; Y172-K174 PolarHBondContact O-N 3.34Å; Y172-V175 PolarHBondContact O-N 3.25Å; Y172-L176 WeakPolarHBondContact O-CB 3.33Å; Y172-L176 VanDerWaalsContact O-CG 3.23Å; Y172-L176 WeakPolarHBondContact O-CG 3.45Å; Y172-L176 PolarHBondContact O-N 2.94Å; Y172-E188 HydrophobicContact CD1-CB 4.29Å; Y172-E188 HydrophobicContact CE1-CB 3.99Å; Y172-E188 WeakPolarHBondContact CE1-O 3.38Å; Y172-E188 WeakPolarHBondContact CE1-OE2 3.48Å; Y172-A191 HydrophobicContact CE1-CB 4.43Å; Y172-L192 HydrophobicContact CD1-CB 3.97Å; Y172-L192 HydrophobicContact CD1-CD1 4.48Å; Y172-L192 HydrophobicContact CD2-CD1 4.01Å; Y172-L192 HydrophobicContact CE1-CB 4.17Å; Y172-L192 HydrophobicContact CG-CB 4.28Å; Y172-L192 HydrophobicContact CG-CD1 3.93Å; Y172-L192 HydrophobicContact CG-CG 4.46Å; Y172-M195 HydrophobicContact CD2-CE 3.51Å; Y172-M195 HydrophobicContact CE2-CE 3.19Å
173	R	82.1	Confident	79.1	Confident	105 Å²	105	69.4 Å²	69.4	40%	0.396	33%	0.331	S	S	.	.	H	α-helix	trans	-55.6	-44.4	172.6	-175.2	-178.2	-79.7	-95.6	7.1	111.4	I169 Y170 N177	I169-R173 PolarHBondContact O-N 2.64Å; Y170-R173 PolarHBondContact O-N 2.81Å; R173-N177 WeakPolarHBondContact O-CB 3.2Å; R173-N177 VanDerWaalsContact O-CG 3.27Å; R173-N177 PolarHBondContact O-N 3Å; R173-N177 VanDerWaalsContact O-N 3.16Å; R173-N177 PolarHBondContact O-OD1 3.33Å
174	K	80.1	Confident	79	Confident	134 Å²	134	72.9 Å²	72.9	58%	0.583	35%	0.352	S	S	*	.	H	α-helix	trans	-69.3	-35.8	178.9	-169.7	174.8	-177.4	177.7	0	113.9	Y170 K171 Y172	Y170-K174 PolarHBondContact O-N 3.14Å; K171-K174 PolarHBondContact O-N 2.68Å; Y172-K174 VanDerWaalsContact C-N 3.3Å; Y172-K174 PolarHBondContact O-N 3.34Å
175	V	78.1	Confident	78.8	Confident	58 Å²	58	70 Å²	70	35%	0.352	34%	0.34	S	S	.	.	H	α-helix	trans	-74	-41.2	179.3	170.3	0	0	0	0	111.4	K171 Y172 N178 E188	K171-V175 HydrophobicContact CG-CG2 4.29Å; K171-V175 WeakPolarHBondContact O-CG2 3.35Å; K171-V175 PolarHBondContact O-N 3.47Å; Y172-V175 PolarHBondContact O-N 3.25Å; V175-N178 PolarHBondContact O-N 2.87Å; V175-E188 HydrophobicContact CG1-CG 4.14Å
176	L	75.3	Confident	78.7	Confident	1 Å²	1	70.5 Å²	70.5	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-71.3	-32.9	-179.5	-65	169.4	0	0	0	111.9	Y172 N178 V185 E188 I189 L192 I213 L217	Y172-L176 WeakPolarHBondContact O-CB 3.33Å; Y172-L176 VanDerWaalsContact O-CG 3.23Å; Y172-L176 WeakPolarHBondContact O-CG 3.45Å; Y172-L176 PolarHBondContact O-N 2.94Å; L176-N178 PolarHBondContact O-N 2.94Å; L176-V185 HydrophobicContact CD2-CG1 3.89Å; L176-E188 HydrophobicContact CD2-CB 4.43Å; L176-I189 HydrophobicContact CD2-CG1 4.17Å; L176-L192 HydrophobicContact CD1-CD2 4.2Å; L176-I213 HydrophobicContact CD1-CG2 3.62Å; L176-L217 HydrophobicContact CB-CD1 4.35Å; L176-L217 HydrophobicContact CD2-CD2 4.19Å; L176-L217 VanDerWaalsContact O-CD1 3.29Å; L176-L217 WeakPolarHBondContact O-CD1 3.45Å
177	N	72.1	Confident	78.7	Confident	83 Å²	83	75.9 Å²	75.9	44%	0.444	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70	-3.1	174.6	-78.2	46.3	0	0	0	115.1	R173	R173-N177 WeakPolarHBondContact O-CB 3.2Å; R173-N177 VanDerWaalsContact O-CG 3.27Å; R173-N177 PolarHBondContact O-N 3Å; R173-N177 VanDerWaalsContact O-N 3.16Å; R173-N177 PolarHBondContact O-OD1 3.33Å
178	N	70	Confident	78.8	Confident	122 Å²	122	75.4 Å²	75.4	65%	0.652	37%	0.365	S	S	*	.	S	Bend	trans	-131.2	68	174.1	-169.2	11.6	0	0	0	111.3	V175 L176 S180	V175-N178 PolarHBondContact O-N 2.87Å; L176-N178 PolarHBondContact O-N 2.94Å; N178-S180 PolarHBondContact O-N 2.97Å
179	P	67.8	Low	78.9	Confident	52 Å²	52	71.5 Å²	71.5	34%	0.338	35%	0.348	S	S	.	.			trans	-74.7	107.4	-171.1	30.3	-34.6	0	0	0	111.7	V185	P179-V185 HydrophobicContact CB-CG2 3.79Å
180	S	64.3	Low	78.9	Confident	109 Å²	109	76.4 Å²	76.4	76%	0.762	37%	0.365	S	S	*	.	S	Bend	trans	-83.4	-34.7	174.4	-41.8	0	0	0	0	113.5	N178	N178-S180 PolarHBondContact O-N 2.97Å
181	R	77	Confident	79.1	Confident	160 Å²	160	75.5 Å²	75.5	60%	0.604	37%	0.369	S	S	*	.			trans	-153.9	136.7	179.1	-78.1	-177.9	61	167	-0.5	111.2	D183 V184 V185	R181-D183 VanDerWaalsContact C-N 3.33Å; R181-D183 IonicContact CZ-OD2 3.54Å; R181-D183 IonicContact NE-OD2 2.77Å; R181-D183 PolarHBondContact NE-OD2 3.44Å; R181-D183 IonicContact NH2-OD2 3.79Å; R181-D183 PolarHBondContact NH2-OD2 3.07Å; R181-D183 PolarHBondContact O-N 3.11Å; R181-V184 HydrophobicContact CB-CG2 4.16Å; R181-V184 PolarHBondContact O-N 3.11Å; R181-V184 VanDerWaalsContact O-N 3.12Å; R181-V185 WeakPolarHBondContact O-CG2 3.2Å; R181-V185 PolarHBondContact O-N 3.39Å; R181-V185 VanDerWaalsContact O-N 3.17Å
182	W	74.7	Confident	79.1	Confident	57 Å²	57	69.8 Å²	69.8	22%	0.216	34%	0.344	C	S	.	.	H	α-helix	trans	-62.4	-32.2	179.6	-81.9	109.4	0	0	0	114.4	V184 V185 L186 L217 N221 L224 I232	W182-V184 PolarHBondContact O-N 3.39Å; W182-V185 HydrophobicContact CE3-CB 3.92Å; W182-V185 HydrophobicContact CE3-CG1 3.69Å; W182-V185 HydrophobicContact CH2-CG1 4.46Å; W182-V185 HydrophobicContact CZ3-CB 4.27Å; W182-V185 HydrophobicContact CZ3-CG1 3.53Å; W182-V185 PolarHBondContact O-N 2.99Å; W182-L186 WeakPolarHBondContact O-CB 3.39Å; W182-L186 PolarHBondContact O-N 2.99Å; W182-L217 HydrophobicContact CH2-CD2 4.39Å; W182-L217 HydrophobicContact CH2-CG 4.32Å; W182-L217 HydrophobicContact CZ3-CD2 4.27Å; W182-N221 HydrophobicContact CH2-CB 4.15Å; W182-N221 HydrophobicContact CZ2-CB 3.75Å; W182-L224 HydrophobicContact CD2-CD2 3.61Å; W182-L224 VanDerWaalsContact CE2-CD2 3.45Å; W182-L224 HydrophobicContact CE3-CD2 3.8Å; W182-L224 HydrophobicContact CG-CD2 4.28Å; W182-L224 HydrophobicContact CH2-CD1 4.18Å; W182-L224 HydrophobicContact CH2-CD2 3.8Å; W182-L224 HydrophobicContact CH2-CG 4.22Å; W182-L224 HydrophobicContact CZ2-CD1 4.32Å; W182-L224 HydrophobicContact CZ2-CD2 3.58Å; W182-L224 HydrophobicContact CZ2-CG 3.92Å; W182-L224 HydrophobicContact CZ3-CD2 3.88Å; W182-I232 HydrophobicContact CE3-CD1 4.2Å; W182-I232 HydrophobicContact CZ3-CD1 3.89Å
183	D	77.8	Confident	79.2	Confident	98 Å²	98	69 Å²	69	52%	0.524	34%	0.341	S	S	.	.	H	α-helix	trans	-56.6	-40	173.6	-49.9	-67.4	0	0	0	112.5	R181 K187	R181-D183 VanDerWaalsContact C-N 3.33Å; R181-D183 IonicContact CZ-OD2 3.54Å; R181-D183 IonicContact NE-OD2 2.77Å; R181-D183 PolarHBondContact NE-OD2 3.44Å; R181-D183 IonicContact NH2-OD2 3.79Å; R181-D183 PolarHBondContact NH2-OD2 3.07Å; R181-D183 PolarHBondContact O-N 3.11Å; D183-K187 PolarHBondContact O-N 3.29Å; D183-K187 VanDerWaalsContact O-N 3.17Å
184	V	81.1	Confident	79.4	Confident	78 Å²	78	68.7 Å²	68.7	47%	0.473	35%	0.348	S	S	.	.	H	α-helix	trans	-74.7	-44.9	-179	-177.9	0	0	0	0	109.5	R181 W182 L186 K187 E188	R181-V184 HydrophobicContact CB-CG2 4.16Å; R181-V184 PolarHBondContact O-N 3.11Å; R181-V184 VanDerWaalsContact O-N 3.12Å; W182-V184 PolarHBondContact O-N 3.39Å; V184-L186 VanDerWaalsContact C-N 3.33Å; V184-L186 PolarHBondContact O-N 3.05Å; V184-K187 WeakPolarHBondContact O-CB 3.4Å; V184-K187 PolarHBondContact O-N 3.07Å; V184-K187 VanDerWaalsContact O-N 3.16Å; V184-E188 WeakPolarHBondContact O-CG 3.38Å; V184-E188 PolarHBondContact O-N 3.17Å
185	V	81.9	Confident	79.7	Confident	7 Å²	7	63.1 Å²	63.1	4%	0.042	32%	0.324	C	S	.	.	H	α-helix	trans	-56.9	-45.9	175.3	174.4	0	0	0	0	111	L176 P179 R181 W182 K187 E188 I189 L217	L176-V185 HydrophobicContact CD2-CG1 3.89Å; P179-V185 HydrophobicContact CB-CG2 3.79Å; R181-V185 WeakPolarHBondContact O-CG2 3.2Å; R181-V185 PolarHBondContact O-N 3.39Å; R181-V185 VanDerWaalsContact O-N 3.17Å; W182-V185 HydrophobicContact CE3-CB 3.92Å; W182-V185 HydrophobicContact CE3-CG1 3.69Å; W182-V185 HydrophobicContact CH2-CG1 4.46Å; W182-V185 HydrophobicContact CZ3-CB 4.27Å; W182-V185 HydrophobicContact CZ3-CG1 3.53Å; W182-V185 PolarHBondContact O-N 2.99Å; V185-K187 PolarHBondContact O-N 3.18Å; V185-E188 PolarHBondContact O-N 3.44Å; V185-I189 HydrophobicContact CG1-CD1 3.87Å; V185-I189 HydrophobicContact CG1-CG1 4.45Å; V185-I189 WeakPolarHBondContact O-CB 3.43Å; V185-I189 VanDerWaalsContact O-CG1 3.3Å; V185-I189 WeakPolarHBondContact O-CG1 3.34Å; V185-I189 PolarHBondContact O-N 3.37Å; V185-L217 HydrophobicContact CG1-CD2 3.73Å
186	L	82.9	Confident	80	Confident	25 Å²	25	60.4 Å²	60.4	13%	0.131	31%	0.308	C	S	.	.	H	α-helix	trans	-62.4	-39.6	176.9	-179	65	0	0	0	112.4	W182 V184 I189 R190 N231 I232 A235	W182-L186 WeakPolarHBondContact O-CB 3.39Å; W182-L186 PolarHBondContact O-N 2.99Å; V184-L186 VanDerWaalsContact C-N 3.33Å; V184-L186 PolarHBondContact O-N 3.05Å; L186-I189 PolarHBondContact O-N 3.32Å; L186-R190 WeakPolarHBondContact O-CG 3.13Å; L186-R190 PolarHBondContact O-N 3.01Å; L186-N231 HydrophobicContact CD1-CB 4.18Å; L186-N231 WeakPolarHBondContact CD1-O 3.28Å; L186-N231 HydrophobicContact CD2-CB 3.84Å; L186-I232 HydrophobicContact CD1-CG1 4.22Å; L186-A235 HydrophobicContact CD1-CB 4.08Å
187	K	84.6	Confident	80.3	Confident	149 Å²	149	64.2 Å²	64.2	65%	0.648	33%	0.328	S	S	*	.	H	α-helix	trans	-64.9	-43	175.4	-174.3	-179.8	177.4	-177.1	0	111.8	D183 V184 V185 R190 A191	D183-K187 PolarHBondContact O-N 3.29Å; D183-K187 VanDerWaalsContact O-N 3.17Å; V184-K187 WeakPolarHBondContact O-CB 3.4Å; V184-K187 PolarHBondContact O-N 3.07Å; V184-K187 VanDerWaalsContact O-N 3.16Å; V185-K187 PolarHBondContact O-N 3.18Å; K187-R190 PolarHBondContact O-N 3.04Å; K187-A191 PolarHBondContact O-N 3.1Å
188	E	85.1	Confident	80.8	Confident	42 Å²	42	64.8 Å²	64.8	20%	0.196	34%	0.335	C	S	.	.	H	α-helix	trans	-69.7	-34.9	176.8	-65	-57.7	133.1	0	0	112.1	Y172 V175 L176 V184 V185 A191 L192	Y172-E188 HydrophobicContact CD1-CB 4.29Å; Y172-E188 HydrophobicContact CE1-CB 3.99Å; Y172-E188 WeakPolarHBondContact CE1-O 3.38Å; Y172-E188 WeakPolarHBondContact CE1-OE2 3.48Å; V175-E188 HydrophobicContact CG1-CG 4.14Å; L176-E188 HydrophobicContact CD2-CB 4.43Å; V184-E188 WeakPolarHBondContact O-CG 3.38Å; V184-E188 PolarHBondContact O-N 3.17Å; V185-E188 PolarHBondContact O-N 3.44Å; E188-A191 PolarHBondContact O-N 3.28Å; E188-L192 VanDerWaalsContact O-CB 3.31Å; E188-L192 WeakPolarHBondContact O-CB 3.29Å; E188-L192 PolarHBondContact O-N 3.08Å
189	I	85.2	Confident	81.3	Confident	1 Å²	1	60.3 Å²	60.3	1%	0.005	31%	0.313	C	S	.	.	H	α-helix	trans	-60.2	-48.1	170.6	-73.5	168.5	0	0	0	110.6	L176 V185 L186 A191 L192 V193 I214 L217 A235 I236	L176-I189 HydrophobicContact CD2-CG1 4.17Å; V185-I189 HydrophobicContact CG1-CD1 3.87Å; V185-I189 HydrophobicContact CG1-CG1 4.45Å; V185-I189 WeakPolarHBondContact O-CB 3.43Å; V185-I189 VanDerWaalsContact O-CG1 3.3Å; V185-I189 WeakPolarHBondContact O-CG1 3.34Å; V185-I189 PolarHBondContact O-N 3.37Å; L186-I189 PolarHBondContact O-N 3.32Å; I189-A191 VanDerWaalsContact C-N 3.32Å; I189-A191 PolarHBondContact O-N 3Å; I189-L192 WeakPolarHBondContact O-CB 3.24Å; I189-L192 PolarHBondContact O-N 3.48Å; I189-V193 WeakPolarHBondContact O-CG2 3.41Å; I189-V193 PolarHBondContact O-N 2.95Å; I189-I214 HydrophobicContact CG1-CD1 4.37Å; I189-I214 HydrophobicContact CG1-CG1 4.28Å; I189-I214 HydrophobicContact CG2-CD1 3.82Å; I189-L217 HydrophobicContact CD1-CD2 4.07Å; I189-A235 HydrophobicContact CG2-CB 4.07Å; I189-I236 HydrophobicContact CG2-CG2 4.23Å
190	R	86.1	Confident	81.8	Confident	126 Å²	126	60 Å²	60	48%	0.475	31%	0.311	S	S	.	.	H	α-helix	trans	-60.8	-40.8	176.7	-71.9	176	-176.3	-164	1	111.9	L186 K187 V193 D194 A235	L186-R190 WeakPolarHBondContact O-CG 3.13Å; L186-R190 PolarHBondContact O-N 3.01Å; K187-R190 PolarHBondContact O-N 3.04Å; R190-V193 PolarHBondContact O-N 2.9Å; R190-D194 WeakPolarHBondContact O-CB 3.43Å; R190-D194 PolarHBondContact O-N 3.22Å; R190-A235 HydrophobicContact CG-CB 3.8Å
191	A	86.7	Confident	82.5	Confident	34 Å²	34	55.2 Å²	55.2	28%	0.281	28%	0.276	S	S	.	.	H	α-helix	trans	-67.2	-33.9	175.6	0	0	0	0	0	113.1	Y172 K187 E188 I189 M195	Y172-A191 HydrophobicContact CE1-CB 4.43Å; K187-A191 PolarHBondContact O-N 3.1Å; E188-A191 PolarHBondContact O-N 3.28Å; I189-A191 VanDerWaalsContact C-N 3.32Å; I189-A191 PolarHBondContact O-N 3Å; A191-M195 WeakPolarHBondContact O-CB 3.3Å; A191-M195 PolarHBondContact O-N 3.1Å
192	L	86.1	Confident	82.3	Confident	0 Å²	0	52 Å²	52	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-68.8	-41.3	174.8	176.9	61.6	0	0	0	111.8	I169 Y172 L176 E188 I189 M195 A196 P210	I169-L192 HydrophobicContact CD1-CD1 3.91Å; Y172-L192 HydrophobicContact CD1-CB 3.97Å; Y172-L192 HydrophobicContact CD1-CD1 4.48Å; Y172-L192 HydrophobicContact CD2-CD1 4.01Å; Y172-L192 HydrophobicContact CE1-CB 4.17Å; Y172-L192 HydrophobicContact CG-CB 4.28Å; Y172-L192 HydrophobicContact CG-CD1 3.93Å; Y172-L192 HydrophobicContact CG-CG 4.46Å; L176-L192 HydrophobicContact CD1-CD2 4.2Å; E188-L192 VanDerWaalsContact O-CB 3.31Å; E188-L192 WeakPolarHBondContact O-CB 3.29Å; E188-L192 PolarHBondContact O-N 3.08Å; I189-L192 WeakPolarHBondContact O-CB 3.24Å; I189-L192 PolarHBondContact O-N 3.48Å; L192-M195 HydrophobicContact CD1-CE 3.9Å; L192-A196 PolarHBondContact O-N 3.28Å; L192-A196 VanDerWaalsContact O-N 3.16Å; L192-P210 HydrophobicContact CD1-CB 4.44Å; L192-P210 HydrophobicContact CD1-CG 4.25Å; L192-P210 HydrophobicContact CD2-CB 4.11Å; L192-P210 HydrophobicContact CG-CB 3.96Å; L192-P210 HydrophobicContact CG-CG 4.26Å
193	V	85.3	Confident	82.2	Confident	7 Å²	7	51.5 Å²	51.5	4%	0.042	27%	0.27	C	S	.	.	H	α-helix	trans	-64.6	-49.5	174.3	169.7	0	0	0	0	111	I189 R190 M195 A196 L197 A235 I236 P238 L239	I189-V193 WeakPolarHBondContact O-CG2 3.41Å; I189-V193 PolarHBondContact O-N 2.95Å; R190-V193 PolarHBondContact O-N 2.9Å; V193-M195 VanDerWaalsContact C-N 3.29Å; V193-M195 PolarHBondContact O-N 3.25Å; V193-A196 WeakPolarHBondContact O-CB 3.43Å; V193-A196 PolarHBondContact O-N 2.77Å; V193-L197 HydrophobicContact CG1-CD1 3.98Å; V193-L197 WeakPolarHBondContact O-CG 3.21Å; V193-L197 PolarHBondContact O-N 2.79Å; V193-L197 VanDerWaalsContact O-N 3.1Å; V193-A235 WeakPolarHBondContact CG2-O 3.42Å; V193-I236 HydrophobicContact CG2-CG2 4.49Å; V193-P238 HydrophobicContact CG1-CB 4.43Å; V193-L239 HydrophobicContact CB-CD1 4.44Å; V193-L239 HydrophobicContact CG1-CD1 4.45Å; V193-L239 HydrophobicContact CG1-CD2 4.24Å; V193-L239 HydrophobicContact CG1-CG 3.99Å; V193-L239 HydrophobicContact CG2-CD1 3.8Å; V193-L239 HydrophobicContact CG2-CG 4.17Å
194	D	86	Confident	81.8	Confident	100 Å²	100	52.4 Å²	52.4	54%	0.535	27%	0.271	S	S	.	.	H	α-helix	trans	-58.2	-41	177.3	-175.4	51.9	0	0	0	111.8	R190 A196 L197 T198	R190-D194 WeakPolarHBondContact O-CB 3.43Å; R190-D194 PolarHBondContact O-N 3.22Å; D194-A196 VanDerWaalsContact C-N 3.35Å; D194-A196 PolarHBondContact O-N 3.01Å; D194-L197 PolarHBondContact O-N 2.86Å; D194-T198 WeakPolarHBondContact O-CB 3.25Å; D194-T198 WeakPolarHBondContact O-CG2 3.12Å; D194-T198 PolarHBondContact O-N 2.88Å; D194-T198 PolarHBondContact O-OG1 3.44Å
195	M	85.8	Confident	81.5	Confident	16 Å²	16	50.6 Å²	50.6	8%	0.079	26%	0.262	C	S	.	.	H	α-helix	trans	-62.1	-38.2	174.3	-167.9	-148.9	-37.6	0	0	113.4	W165 K168 Y172 A191 L192 V193 S199	W165-M195 HydrophobicContact CE3-SD 3.87Å; W165-M195 HydrophobicContact CZ3-CG 4.1Å; W165-M195 HydrophobicContact CZ3-SD 3.66Å; K168-M195 HydrophobicContact CB-CE 3.77Å; K168-M195 HydrophobicContact CB-SD 3.62Å; K168-M195 HydrophobicContact CD-CE 3.92Å; K168-M195 HydrophobicContact CD-CG 4.01Å; K168-M195 HydrophobicContact CD-SD 3.35Å; K168-M195 WeakPolarHBondContact CD-SD 3.41Å; K168-M195 HydrophobicContact CG-CE 4.41Å; K168-M195 HydrophobicContact CG-SD 4.14Å; Y172-M195 HydrophobicContact CD2-CE 3.51Å; Y172-M195 HydrophobicContact CE2-CE 3.19Å; A191-M195 WeakPolarHBondContact O-CB 3.3Å; A191-M195 PolarHBondContact O-N 3.1Å; L192-M195 HydrophobicContact CD1-CE 3.9Å; V193-M195 VanDerWaalsContact C-N 3.29Å; V193-M195 PolarHBondContact O-N 3.25Å; M195-S199 WeakPolarHBondContact O-CB 3.31Å; M195-S199 PolarHBondContact O-N 3.47Å
196	A	83.7	Confident	81.5	Confident	2 Å²	2	50.3 Å²	50.3	2%	0.017	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-45.5	178.6	0	0	0	0	0	110.9	W165 L192 V193 D194 S199 P210 L239	W165-A196 HydrophobicContact CH2-CB 3.85Å; W165-A196 HydrophobicContact CZ3-CB 4.37Å; L192-A196 PolarHBondContact O-N 3.28Å; L192-A196 VanDerWaalsContact O-N 3.16Å; V193-A196 WeakPolarHBondContact O-CB 3.43Å; V193-A196 PolarHBondContact O-N 2.77Å; D194-A196 VanDerWaalsContact C-N 3.35Å; D194-A196 PolarHBondContact O-N 3.01Å; A196-S199 WeakPolarHBondContact O-CB 3.37Å; A196-S199 PolarHBondContact O-N 2.79Å; A196-P210 HydrophobicContact CB-CG 4Å; A196-L239 HydrophobicContact CB-CD2 3.97Å
197	L	82.4	Confident	81.3	Confident	81 Å²	81	51.3 Å²	51.3	42%	0.424	26%	0.264	S	S	.	.	H	α-helix	trans	-69.6	-32.5	179.8	-62.1	170.9	0	0	0	113.5	V193 D194 P238 L239	V193-L197 HydrophobicContact CG1-CD1 3.98Å; V193-L197 WeakPolarHBondContact O-CG 3.21Å; V193-L197 PolarHBondContact O-N 2.79Å; V193-L197 VanDerWaalsContact O-N 3.1Å; D194-L197 PolarHBondContact O-N 2.86Å; L197-P238 HydrophobicContact CD1-CB 3.76Å; L197-L239 HydrophobicContact CD2-CD2 3.98Å; L197-L239 HydrophobicContact CG-CD2 4.16Å
198	T	82.8	Confident	81.2	Confident	95 Å²	95	48.1 Å²	48.1	58%	0.583	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89	0.5	178.9	56.8	0	0	0	0	113.8	D194	D194-T198 WeakPolarHBondContact O-CB 3.25Å; D194-T198 WeakPolarHBondContact O-CG2 3.12Å; D194-T198 PolarHBondContact O-N 2.88Å; D194-T198 PolarHBondContact O-OG1 3.44Å
199	S	80.9	Confident	81.1	Confident	28 Å²	28	47.5 Å²	47.5	20%	0.196	25%	0.254	C	S	.	.			trans	-71.9	133.8	-178.9	-168.7	0	0	0	0	111.7	M195 A196 L201	M195-S199 WeakPolarHBondContact O-CB 3.31Å; M195-S199 PolarHBondContact O-N 3.47Å; A196-S199 WeakPolarHBondContact O-CB 3.37Å; A196-S199 PolarHBondContact O-N 2.79Å; S199-L201 PolarHBondContact O-N 2.98Å; S199-L201 VanDerWaalsContact O-N 3.16Å; S199-L201 PolarHBondContact OG-N 3.25Å
200	P	76.8	Confident	81.1	Confident	45 Å²	45	47.5 Å²	47.5	29%	0.292	25%	0.253	S	S	.	.	S	Bend	trans	-76.1	6	173.7	33.3	-36.1	0	0	0	113.1	R58 Y59 H161	R58-P200 WeakPolarHBondContact CA-O 3.42Å; Y59-P200 PolarHBondContact N-O 2.86Å; H161-P200 HydrophobicContact CB-CG 4.38Å
201	L	80.1	Confident	81	Confident	8 Å²	8	41.5 Å²	41.5	4%	0.042	23%	0.231	C	C	.	.	B	Isolated β-bridge	trans	-92.2	133.7	-176.6	-68	163.8	0	0	0	111.5	Y59 L61 H161 W165 S199 I206	Y59-L201 CarbonylContact O-C 3.59Å; Y59-L201 WeakPolarHBondContact O-CA 3.43Å; L61-L201 HydrophobicContact CD1-CD1 4.24Å; H161-L201 HydrophobicContact CB-CD1 4.28Å; H161-L201 HydrophobicContact CB-CD2 3.95Å; H161-L201 HydrophobicContact CB-CG 4.02Å; W165-L201 HydrophobicContact CB-CD1 3.72Å; W165-L201 HydrophobicContact CG-CD1 4.03Å; S199-L201 PolarHBondContact O-N 2.98Å; S199-L201 VanDerWaalsContact O-N 3.16Å; S199-L201 PolarHBondContact OG-N 3.25Å; L201-I206 HydrophobicContact CB-CD1 3.26Å; L201-I206 HydrophobicContact CB-CG1 4.33Å; L201-I206 HydrophobicContact CD1-CD1 4.33Å; L201-I206 HydrophobicContact CG-CD1 4.4Å
202	Q	71.4	Confident	80.9	Confident	92 Å²	92	44.8 Å²	44.8	43%	0.43	24%	0.24	S	C	.	.			trans	-105.2	96.3	173.5	-77.4	-174.4	97.4	0	0	110.6	R58 Y59	R58-Q202 HydrophobicContact CB-CG 4Å; R58-Q202 VanDerWaalsContact NH1-CD 3.35Å; Y59-Q202 PolarHBondContact O-N 3.22Å
203	D	74.1	Confident	80.7	Confident	47 Å²	47	45.2 Å²	45.2	25%	0.251	24%	0.242	S	C	.	.			trans	-155.7	144.6	170.3	-156.9	-68.2	0	0	0	108.2	L61 S205 I206	L61-D203 HydrophobicContact CB-CB 3.96Å; D203-S205 PolarHBondContact O-N 3.05Å; D203-S205 WeakPolarHBondContact OD1-CB 3.45Å; D203-S205 PolarHBondContact OD1-N 3.46Å; D203-S205 PolarHBondContact OD1-OG 3.32Å; D203-I206 HydrophobicContact CB-CD1 3.5Å; D203-I206 HydrophobicContact CB-CG1 4.19Å; D203-I206 PolarHBondContact O-N 2.86Å
204	E	68.7	Low	80.7	Confident	117 Å²	117	44.9 Å²	44.9	55%	0.547	24%	0.24	S	C	.	.	H	α-helix	trans	-64.4	-34.2	177.4	-160.5	-177.2	164.5	0	0	110.6	I206 H207 Q208	E204-I206 PolarHBondContact O-N 3.19Å; E204-I206 VanDerWaalsContact O-N 3.08Å; E204-H207 PolarHBondContact O-N 3.36Å; E204-H207 VanDerWaalsContact O-N 3.13Å; E204-Q208 HydrophobicContact CG-CG 4.26Å; E204-Q208 WeakPolarHBondContact O-CG 3.27Å; E204-Q208 PolarHBondContact O-N 3.08Å; E204-Q208 PolarHBondContact OE1-NE2 3.41Å
205	S	75.8	Confident	80.6	Confident	41 Å²	41	40.1 Å²	40.1	29%	0.287	22%	0.215	S	C	.	.	H	α-helix	trans	-58.2	-23.8	178	60.9	0	0	0	0	114.4	D203 A209	D203-S205 PolarHBondContact O-N 3.05Å; D203-S205 WeakPolarHBondContact OD1-CB 3.45Å; D203-S205 PolarHBondContact OD1-N 3.46Å; D203-S205 PolarHBondContact OD1-OG 3.32Å; S205-A209 WeakPolarHBondContact O-CB 3.35Å; S205-A209 PolarHBondContact O-N 2.87Å
206	I	80.8	Confident	80.5	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-72.2	-33.8	-179.8	-70.5	149.2	0	0	0	111.9	L61 W165 L201 D203 E204 P210	L61-I206 HydrophobicContact CB-CD1 4.43Å; W165-I206 HydrophobicContact CD2-CG1 4.45Å; W165-I206 HydrophobicContact CE3-CG2 4.41Å; W165-I206 HydrophobicContact CH2-CB 4.41Å; W165-I206 HydrophobicContact CH2-CG2 3.6Å; W165-I206 WeakPolarHBondContact CH2-O 3.4Å; W165-I206 HydrophobicContact CZ2-CB 3.99Å; W165-I206 HydrophobicContact CZ2-CG1 4.23Å; W165-I206 HydrophobicContact CZ2-CG2 3.68Å; W165-I206 WeakPolarHBondContact CZ2-O 3.4Å; W165-I206 HydrophobicContact CZ3-CG2 3.97Å; L201-I206 HydrophobicContact CB-CD1 3.26Å; L201-I206 HydrophobicContact CB-CG1 4.33Å; L201-I206 HydrophobicContact CD1-CD1 4.33Å; L201-I206 HydrophobicContact CG-CD1 4.4Å; D203-I206 HydrophobicContact CB-CD1 3.5Å; D203-I206 HydrophobicContact CB-CG1 4.19Å; D203-I206 PolarHBondContact O-N 2.86Å; E204-I206 PolarHBondContact O-N 3.19Å; E204-I206 VanDerWaalsContact O-N 3.08Å; I206-P210 WeakPolarHBondContact O-CD 3.37Å; I206-P210 WeakPolarHBondContact O-CG 3.43Å
207	H	79.4	Confident	80.4	Confident	46 Å²	46	41.1 Å²	41.1	21%	0.213	22%	0.222	C	C	.	.	H	α-helix	trans	-91.8	-32	178.7	-54.5	88.1	0	0	0	111.1	E204 N243	E204-H207 PolarHBondContact O-N 3.36Å; E204-H207 VanDerWaalsContact O-N 3.13Å; H207-N243 WeakPolarHBondContact CB-ND2 3.43Å; H207-N243 WeakPolarHBondContact CB-OD1 3.36Å
208	Q	81.8	Confident	80.3	Confident	83 Å²	83	37.8 Å²	37.8	39%	0.388	20%	0.204	S	C	.	.	H	α-helix	trans	-70.6	-37.9	173.5	-68	-174.3	2.6	0	0	113.5	E204 L211 H212	E204-Q208 HydrophobicContact CG-CG 4.26Å; E204-Q208 WeakPolarHBondContact O-CG 3.27Å; E204-Q208 PolarHBondContact O-N 3.08Å; E204-Q208 PolarHBondContact OE1-NE2 3.41Å; Q208-L211 WeakPolarHBondContact O-CB 3.38Å; Q208-L211 PolarHBondContact O-N 3.28Å; Q208-L211 VanDerWaalsContact O-N 3.15Å; Q208-H212 PolarHBondContact O-N 3.01Å
209	A	82.8	Confident	80.2	Confident	29 Å²	29	36.2 Å²	36.2	24%	0.24	20%	0.201	C	C	.	.	H	α-helix	trans	-61.5	-44.4	-175.6	0	0	0	0	0	114	I169 S205 L211 H212 I213	I169-A209 HydrophobicContact CD1-CB 4.43Å; S205-A209 WeakPolarHBondContact O-CB 3.35Å; S205-A209 PolarHBondContact O-N 2.87Å; A209-L211 PolarHBondContact O-N 3.18Å; A209-H212 PolarHBondContact O-N 3.14Å; A209-I213 WeakPolarHBondContact O-CD1 3.4Å; A209-I213 VanDerWaalsContact O-CG1 3.3Å; A209-I213 WeakPolarHBondContact O-CG1 3.27Å; A209-I213 PolarHBondContact O-N 3.14Å
210	P	84.6	Confident	80	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-54.7	-48.1	168.9	-29.1	36.5	0	0	0	113.2	W165 L192 A196 I206 H212 I213 I214 L239	W165-P210 HydrophobicContact CH2-CG 4.32Å; L192-P210 HydrophobicContact CD1-CB 4.44Å; L192-P210 HydrophobicContact CD1-CG 4.25Å; L192-P210 HydrophobicContact CD2-CB 4.11Å; L192-P210 HydrophobicContact CG-CB 3.96Å; L192-P210 HydrophobicContact CG-CG 4.26Å; A196-P210 HydrophobicContact CB-CG 4Å; I206-P210 WeakPolarHBondContact O-CD 3.37Å; I206-P210 WeakPolarHBondContact O-CG 3.43Å; P210-H212 VanDerWaalsContact C-N 3.29Å; P210-H212 PolarHBondContact O-N 3.08Å; P210-I213 PolarHBondContact O-N 3.3Å; P210-I214 WeakPolarHBondContact O-CD1 3.49Å; P210-I214 VanDerWaalsContact O-CG1 3.25Å; P210-I214 WeakPolarHBondContact O-CG1 3.1Å; P210-I214 PolarHBondContact O-N 2.86Å; P210-L239 HydrophobicContact CB-CD1 3.62Å; P210-L239 HydrophobicContact CG-CD1 4.21Å
211	L	84.9	Confident	79.7	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-60.6	-39.5	179.3	-67.1	173.8	0	0	0	111.4	Q208 A209 I214 S215 I236 L239 L240 N243 P246 L249	Q208-L211 WeakPolarHBondContact O-CB 3.38Å; Q208-L211 PolarHBondContact O-N 3.28Å; Q208-L211 VanDerWaalsContact O-N 3.15Å; A209-L211 PolarHBondContact O-N 3.18Å; L211-I214 PolarHBondContact O-N 2.82Å; L211-S215 VanDerWaalsContact O-CB 3.32Å; L211-S215 WeakPolarHBondContact O-CB 3.37Å; L211-S215 PolarHBondContact O-N 2.88Å; L211-I236 HydrophobicContact CD2-CB 4.3Å; L211-L239 HydrophobicContact CD1-CB 4.25Å; L211-L239 HydrophobicContact CD2-CB 4.01Å; L211-L239 HydrophobicContact CD2-CD1 4.25Å; L211-L239 HydrophobicContact CG-CB 4.15Å; L211-L239 HydrophobicContact CG-CD1 4.21Å; L211-L240 HydrophobicContact CD1-CD2 4.1Å; L211-L240 HydrophobicContact CD2-CD2 3.81Å; L211-L240 HydrophobicContact CD2-CG 4.36Å; L211-N243 HydrophobicContact CD1-CB 4Å; L211-P246 HydrophobicContact CB-CG 3.85Å; L211-L249 HydrophobicContact CD2-CD2 4.14Å
212	H	84.1	Confident	78.9	Confident	104 Å²	104	44 Å²	44	48%	0.481	24%	0.241	S	C	.	.	H	α-helix	trans	-70.1	-37.4	178.9	-157.7	-39.8	0	0	0	112.7	Q208 A209 P210 S215 T216	Q208-H212 PolarHBondContact O-N 3.01Å; A209-H212 PolarHBondContact O-N 3.14Å; P210-H212 VanDerWaalsContact C-N 3.29Å; P210-H212 PolarHBondContact O-N 3.08Å; H212-S215 WeakPolarHBondContact O-CB 3.49Å; H212-S215 PolarHBondContact O-N 3.22Å; H212-T216 PolarHBondContact O-N 3.31Å; H212-T216 VanDerWaalsContact O-N 3.07Å; H212-T216 PolarHBondContact O-OG1 3.09Å; H212-T216 VanDerWaalsContact O-OG1 3.13Å
213	I	82.8	Confident	78.6	Confident	8 Å²	8	47.2 Å²	47.2	4%	0.041	26%	0.261	C	S	.	.	H	α-helix	trans	-65.7	-41.9	174.8	-65.8	162.4	0	0	0	110.3	I169 L176 A209 P210 T216 L217	I169-I213 HydrophobicContact CD1-CD1 4.15Å; I169-I213 HydrophobicContact CG2-CD1 4.05Å; L176-I213 HydrophobicContact CD1-CG2 3.62Å; A209-I213 WeakPolarHBondContact O-CD1 3.4Å; A209-I213 VanDerWaalsContact O-CG1 3.3Å; A209-I213 WeakPolarHBondContact O-CG1 3.27Å; A209-I213 PolarHBondContact O-N 3.14Å; P210-I213 PolarHBondContact O-N 3.3Å; I213-T216 PolarHBondContact O-N 3.5Å; I213-L217 PolarHBondContact O-N 3.5Å
214	I	84.9	Confident	78.7	Confident	0 Å²	0	46 Å²	46	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.2	-37.7	176.7	-63.7	165.8	0	0	0	110.8	I189 P210 L211 T216 L217 L218 I232 I236	I189-I214 HydrophobicContact CG1-CD1 4.37Å; I189-I214 HydrophobicContact CG1-CG1 4.28Å; I189-I214 HydrophobicContact CG2-CD1 3.82Å; P210-I214 WeakPolarHBondContact O-CD1 3.49Å; P210-I214 VanDerWaalsContact O-CG1 3.25Å; P210-I214 WeakPolarHBondContact O-CG1 3.1Å; P210-I214 PolarHBondContact O-N 2.86Å; L211-I214 PolarHBondContact O-N 2.82Å; I214-T216 PolarHBondContact O-N 3.29Å; I214-L217 PolarHBondContact O-N 3.29Å; I214-L218 HydrophobicContact CG2-CD1 3.83Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 VanDerWaalsContact O-CG 3.27Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.05Å; I214-I232 HydrophobicContact CG2-CG2 4.48Å; I214-I236 HydrophobicContact CD1-CG2 3.56Å; I214-I236 HydrophobicContact CG2-CG2 4.37Å
215	S	84.9	Confident	79.1	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-56.3	-48.5	172.6	-161.7	0	0	0	0	111.4	L211 H212 L218 A219 D248 L249	L211-S215 VanDerWaalsContact O-CB 3.32Å; L211-S215 WeakPolarHBondContact O-CB 3.37Å; L211-S215 PolarHBondContact O-N 2.88Å; H212-S215 WeakPolarHBondContact O-CB 3.49Å; H212-S215 PolarHBondContact O-N 3.22Å; S215-L218 PolarHBondContact O-N 3.11Å; S215-A219 WeakPolarHBondContact O-CB 3.5Å; S215-A219 PolarHBondContact O-N 3.07Å; S215-D248 VanDerWaalsContact OG-CB 3.3Å; S215-D248 WeakPolarHBondContact OG-CB 3.47Å; S215-D248 PolarHBondContact OG-OD2 3.08Å; S215-L249 PolarHBondContact OG-N 3.18Å; S215-L249 VanDerWaalsContact OG-N 3.11Å
216	T	83.1	Confident	79	Confident	37 Å²	37	42.7 Å²	42.7	23%	0.227	25%	0.246	C	C	.	.	H	α-helix	trans	-63.5	-45.7	176.7	-55.2	0	0	0	0	112	H212 I213 I214 L218 A219 E220	H212-T216 PolarHBondContact O-N 3.31Å; H212-T216 VanDerWaalsContact O-N 3.07Å; H212-T216 PolarHBondContact O-OG1 3.09Å; H212-T216 VanDerWaalsContact O-OG1 3.13Å; I213-T216 PolarHBondContact O-N 3.5Å; I214-T216 PolarHBondContact O-N 3.29Å; T216-L218 VanDerWaalsContact C-N 3.33Å; T216-L218 PolarHBondContact O-N 3.17Å; T216-A219 PolarHBondContact O-N 2.99Å; T216-E220 WeakPolarHBondContact O-CG 3.46Å; T216-E220 PolarHBondContact O-N 2.88Å; T216-E220 VanDerWaalsContact O-N 3.07Å
217	L	81.5	Confident	78.8	Confident	2 Å²	2	47.6 Å²	47.6	1%	0.01	27%	0.269	C	S	.	.	H	α-helix	trans	-57.2	-43.9	177.1	178.1	71.8	0	0	0	112.6	L176 W182 V185 I189 I213 I214 E220 N221	L176-L217 HydrophobicContact CB-CD1 4.35Å; L176-L217 HydrophobicContact CD2-CD2 4.19Å; L176-L217 VanDerWaalsContact O-CD1 3.29Å; L176-L217 WeakPolarHBondContact O-CD1 3.45Å; W182-L217 HydrophobicContact CH2-CD2 4.39Å; W182-L217 HydrophobicContact CH2-CG 4.32Å; W182-L217 HydrophobicContact CZ3-CD2 4.27Å; V185-L217 HydrophobicContact CG1-CD2 3.73Å; I189-L217 HydrophobicContact CD1-CD2 4.07Å; I213-L217 PolarHBondContact O-N 3.5Å; I214-L217 PolarHBondContact O-N 3.29Å; L217-E220 PolarHBondContact O-N 2.88Å; L217-N221 WeakPolarHBondContact O-CB 3.26Å; L217-N221 PolarHBondContact O-N 2.89Å; L217-N221 PolarHBondContact O-ND2 3.48Å
218	L	80.4	Confident	78.8	Confident	12 Å²	12	47.1 Å²	47.1	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-71.5	-35.4	-179.7	-69.3	172.7	0	0	0	112.2	I214 S215 T216 E220 N221 L224 I232 L249 F252	I214-L218 HydrophobicContact CG2-CD1 3.83Å; I214-L218 HydrophobicContact CG2-CG 4.25Å; I214-L218 WeakPolarHBondContact O-CB 3.47Å; I214-L218 VanDerWaalsContact O-CG 3.27Å; I214-L218 WeakPolarHBondContact O-CG 3.32Å; I214-L218 PolarHBondContact O-N 3.05Å; S215-L218 PolarHBondContact O-N 3.11Å; T216-L218 VanDerWaalsContact C-N 3.33Å; T216-L218 PolarHBondContact O-N 3.17Å; L218-E220 VanDerWaalsContact C-N 3.31Å; L218-E220 PolarHBondContact O-N 3.4Å; L218-N221 PolarHBondContact O-N 3.1Å; L218-L224 HydrophobicContact CD2-CD1 3.57Å; L218-I232 HydrophobicContact CD1-CG2 4.38Å; L218-I232 HydrophobicContact CD2-CD1 4.13Å; L218-I232 HydrophobicContact CD2-CG2 4.46Å; L218-L249 HydrophobicContact CD1-CD1 3.65Å; L218-F252 HydrophobicContact CB-CD2 4.43Å; L218-F252 HydrophobicContact CD1-CD1 3.82Å; L218-F252 HydrophobicContact CD1-CD2 4.3Å; L218-F252 HydrophobicContact CD1-CE1 4.01Å; L218-F252 HydrophobicContact CD1-CE2 4.47Å; L218-F252 HydrophobicContact CD1-CG 3.96Å; L218-F252 HydrophobicContact CD1-CZ 4.32Å; L218-F252 HydrophobicContact CD2-CD2 4.26Å; L218-F252 HydrophobicContact CD2-CE1 4.47Å; L218-F252 HydrophobicContact CD2-CE2 3.88Å; L218-F252 HydrophobicContact CD2-CZ 3.98Å
219	A	79.5	Confident	78.7	Confident	62 Å²	62	43.4 Å²	43.4	51%	0.512	25%	0.251	S	S	.	.	H	α-helix	trans	-65.4	-33	174.1	0	0	0	0	0	112.7	S215 T216 D248	S215-A219 WeakPolarHBondContact O-CB 3.5Å; S215-A219 PolarHBondContact O-N 3.07Å; T216-A219 PolarHBondContact O-N 2.99Å; A219-D248 HydrophobicContact CB-CB 4.32Å
220	E	76.9	Confident	78.7	Confident	115 Å²	115	43.5 Å²	43.5	54%	0.537	25%	0.246	S	C	.	.	H	α-helix	trans	-79.3	-15.5	177.4	-70.6	174.3	-174.6	0	0	113.5	T216 L217 L218	T216-E220 WeakPolarHBondContact O-CG 3.46Å; T216-E220 PolarHBondContact O-N 2.88Å; T216-E220 VanDerWaalsContact O-N 3.07Å; L217-E220 PolarHBondContact O-N 2.88Å; L218-E220 VanDerWaalsContact C-N 3.31Å; L218-E220 PolarHBondContact O-N 3.4Å
221	N	71.6	Confident	78.6	Confident	44 Å²	44	45.7 Å²	45.7	24%	0.235	26%	0.258	C	S	.	.			trans	-129.2	80.4	-169.4	-69.4	-89.1	0	0	0	114	W182 L217 L218 N223	W182-N221 HydrophobicContact CH2-CB 4.15Å; W182-N221 HydrophobicContact CZ2-CB 3.75Å; L217-N221 WeakPolarHBondContact O-CB 3.26Å; L217-N221 PolarHBondContact O-N 2.89Å; L217-N221 PolarHBondContact O-ND2 3.48Å; L218-N221 PolarHBondContact O-N 3.1Å; N221-N223 VanDerWaalsContact C-N 3.33Å; N221-N223 PolarHBondContact O-N 2.95Å
222	S	63.6	Low	78.6	Confident	85 Å²	85	45.9 Å²	45.9	59%	0.594	26%	0.259	S	S	*	.			trans	-71.7	-16.8	-177.1	-50.4	0	0	0	0	116.2	L224	S222-L224 PolarHBondContact O-N 3.33Å
223	N	65.3	Low	78.6	Confident	160 Å²	160	40.9 Å²	40.9	86%	0.856	24%	0.236	S	C	*	.			trans	-100.6	54.3	-170.5	-68	-21.8	0	0	0	112.8	N221	N221-N223 VanDerWaalsContact C-N 3.33Å; N221-N223 PolarHBondContact O-N 2.95Å
224	L	74.2	Confident	78.7	Confident	21 Å²	21	44.3 Å²	44.3	11%	0.11	26%	0.257	C	S	.	.			trans	-90	147.6	176.3	-85.9	158.5	0	0	0	111.7	W182 L218 S222 D228 H229 I232 F252	W182-L224 HydrophobicContact CD2-CD2 3.61Å; W182-L224 VanDerWaalsContact CE2-CD2 3.45Å; W182-L224 HydrophobicContact CE3-CD2 3.8Å; W182-L224 HydrophobicContact CG-CD2 4.28Å; W182-L224 HydrophobicContact CH2-CD1 4.18Å; W182-L224 HydrophobicContact CH2-CD2 3.8Å; W182-L224 HydrophobicContact CH2-CG 4.22Å; W182-L224 HydrophobicContact CZ2-CD1 4.32Å; W182-L224 HydrophobicContact CZ2-CD2 3.58Å; W182-L224 HydrophobicContact CZ2-CG 3.92Å; W182-L224 HydrophobicContact CZ3-CD2 3.88Å; L218-L224 HydrophobicContact CD2-CD1 3.57Å; S222-L224 PolarHBondContact O-N 3.33Å; L224-D228 HydrophobicContact CD2-CB 3.74Å; L224-H229 VanDerWaalsContact CB-CD2 3.41Å; L224-H229 WeakPolarHBondContact CB-CD2 3.41Å; L224-H229 VanDerWaalsContact CB-NE2 3.33Å; L224-H229 WeakPolarHBondContact CB-NE2 3.41Å; L224-I232 HydrophobicContact CD1-CD1 4.3Å; L224-I232 HydrophobicContact CD2-CD1 3.98Å; L224-F252 HydrophobicContact CD1-CE2 4.07Å
225	S	77.8	Confident	78.7	Confident	56 Å²	56	44.8 Å²	44.8	39%	0.392	26%	0.261	S	S	.	.			trans	-75	152.1	169.2	91.2	0	0	0	0	110.4	Q227 D228 H229	S225-Q227 PolarHBondContact O-N 3.02Å; S225-Q227 PolarHBondContact OG-N 3.48Å; S225-D228 VanDerWaalsContact CB-OD2 3.24Å; S225-D228 WeakPolarHBondContact CB-OD2 3.32Å; S225-D228 WeakPolarHBondContact O-CB 3.43Å; S225-D228 PolarHBondContact O-N 2.93Å; S225-D228 PolarHBondContact OG-N 3.3Å; S225-D228 PolarHBondContact OG-OD2 3.49Å; S225-H229 PolarHBondContact O-N 3.26Å
226	A	73	Confident	78.7	Confident	33 Å²	33	44.8 Å²	44.8	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-68.8	-15.9	-179.4	0	0	0	0	0	113.6	R260	A226-R260 VanDerWaalsContact CB-CZ 3.49Å; A226-R260 VanDerWaalsContact CB-NH2 3.35Å; A226-R260 PolarHBondContact O-NH1 3.17Å
227	Q	77	Confident	78.8	Confident	103 Å²	103	43.7 Å²	43.7	48%	0.481	26%	0.256	S	S	.	.	H	α-helix	trans	-78.3	-36.8	168.9	-170.8	61	57.6	0	0	111.5	S225 H229 E230 N231	S225-Q227 PolarHBondContact O-N 3.02Å; S225-Q227 PolarHBondContact OG-N 3.48Å; Q227-H229 VanDerWaalsContact C-N 3.34Å; Q227-E230 PolarHBondContact O-N 3.13Å; Q227-N231 WeakPolarHBondContact O-CB 3.49Å; Q227-N231 VanDerWaalsContact O-CG 3.23Å; Q227-N231 PolarHBondContact O-N 2.69Å; Q227-N231 PolarHBondContact O-ND2 3.3Å
228	D	79.2	Confident	78.9	Confident	36 Å²	36	45.7 Å²	45.7	19%	0.193	27%	0.269	C	S	.	.	H	α-helix	trans	-67.4	-36.3	175	-59.7	-49.1	0	0	0	111.2	L224 S225 E230 N231 I232	L224-D228 HydrophobicContact CD2-CB 3.74Å; S225-D228 VanDerWaalsContact CB-OD2 3.24Å; S225-D228 WeakPolarHBondContact CB-OD2 3.32Å; S225-D228 WeakPolarHBondContact O-CB 3.43Å; S225-D228 PolarHBondContact O-N 2.93Å; S225-D228 PolarHBondContact OG-N 3.3Å; S225-D228 PolarHBondContact OG-OD2 3.49Å; D228-E230 PolarHBondContact O-N 2.82Å; D228-N231 PolarHBondContact O-N 3.23Å; D228-I232 WeakPolarHBondContact O-CB 3.43Å; D228-I232 WeakPolarHBondContact O-CD1 3.49Å; D228-I232 WeakPolarHBondContact O-CG1 3.49Å; D228-I232 PolarHBondContact O-N 3.37Å
229	H	79.8	Confident	79	Confident	5 Å²	5	45.1 Å²	45.1	2%	0.023	27%	0.266	C	S	.	.	H	α-helix	trans	-51.3	-54.8	170.7	-72.3	176.5	0	0	0	111.7	L224 S225 Q227 I232 I233 F252 E259	L224-H229 VanDerWaalsContact CB-CD2 3.41Å; L224-H229 WeakPolarHBondContact CB-CD2 3.41Å; L224-H229 VanDerWaalsContact CB-NE2 3.33Å; L224-H229 WeakPolarHBondContact CB-NE2 3.41Å; S225-H229 PolarHBondContact O-N 3.26Å; Q227-H229 VanDerWaalsContact C-N 3.34Å; H229-I232 PolarHBondContact O-N 3.2Å; H229-I233 WeakPolarHBondContact O-CD1 3.42Å; H229-I233 VanDerWaalsContact O-CG1 3.24Å; H229-I233 WeakPolarHBondContact O-CG1 3.32Å; H229-I233 PolarHBondContact O-N 2.89Å; H229-F252 HydrophobicContact CB-CZ 4.15Å; H229-F252 AromaticContact CD2-CE2 3.47Å; H229-F252 VanDerWaalsContact CD2-CE2 3.47Å; H229-F252 WeakPolarHBondContact CD2-CE2 3.15Å; H229-F252 AromaticContact CD2-CZ 3.51Å; H229-F252 AromaticContact CG-CZ 3.93Å; H229-F252 AromaticContact NE2-CE2 3.67Å; H229-E259 IonicContact CE1-OE2 3.87Å; H229-E259 IonicContact ND1-OE2 2.74Å
230	E	82.6	Confident	79.1	Confident	30 Å²	30	42.1 Å²	42.1	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-65.8	-43.2	-178.9	-68.3	175.6	174.5	0	0	111.8	Q227 D228 I232 I233 V234 H256 R260 S263 V265	Q227-E230 PolarHBondContact O-N 3.13Å; D228-E230 PolarHBondContact O-N 2.82Å; E230-I232 VanDerWaalsContact C-N 3.29Å; E230-I232 PolarHBondContact O-N 3.13Å; E230-I233 PolarHBondContact O-N 3.34Å; E230-V234 WeakPolarHBondContact O-CB 3.2Å; E230-V234 WeakPolarHBondContact O-CG2 3.35Å; E230-V234 PolarHBondContact O-N 2.9Å; E230-H256 VanDerWaalsContact CG-CE1 3.47Å; E230-H256 WeakPolarHBondContact CG-CE1 3.46Å; E230-H256 IonicContact OE1-CE1 2.7Å; E230-R260 VanDerWaalsContact OE1-CD 3.28Å; E230-R260 WeakPolarHBondContact OE1-CD 3.38Å; E230-R260 IonicContact OE1-CZ 3.18Å; E230-R260 IonicContact OE1-NE 3.35Å; E230-R260 IonicContact OE1-NH1 3.17Å; E230-R260 PolarHBondContact OE1-NH1 3.46Å; E230-R260 IonicContact OE2-NH1 3.29Å; E230-R260 PolarHBondContact OE2-NH1 2.9Å; E230-R260 VanDerWaalsContact OE2-NH1 3.15Å; E230-S263 WeakPolarHBondContact OE1-CB 3.44Å; E230-S263 PolarHBondContact OE1-OG 3.4Å; E230-V265 HydrophobicContact CB-CG2 4.07Å; E230-V265 HydrophobicContact CG-CG2 3.98Å
231	N	83.8	Confident	79	Confident	47 Å²	47	41.8 Å²	41.8	25%	0.251	24%	0.24	S	C	.	.	H	α-helix	trans	-59.5	-38.1	178	-77	-27.4	0	0	0	112.9	L186 Q227 D228 A235	L186-N231 HydrophobicContact CD1-CB 4.18Å; L186-N231 WeakPolarHBondContact CD1-O 3.28Å; L186-N231 HydrophobicContact CD2-CB 3.84Å; Q227-N231 WeakPolarHBondContact O-CB 3.49Å; Q227-N231 VanDerWaalsContact O-CG 3.23Å; Q227-N231 PolarHBondContact O-N 2.69Å; Q227-N231 PolarHBondContact O-ND2 3.3Å; D228-N231 PolarHBondContact O-N 3.23Å; N231-A235 WeakPolarHBondContact O-CB 3.45Å; N231-A235 PolarHBondContact O-N 3.44Å; N231-A235 VanDerWaalsContact O-N 3.13Å
232	I	84	Confident	78.9	Confident	3 Å²	3	44.8 Å²	44.8	2%	0.015	26%	0.256	C	S	.	.	H	α-helix	trans	-71.2	-45.8	176.6	-68.3	165.6	0	0	0	110.3	W182 L186 I214 L218 L224 D228 H229 E230 V234 A235 I236	W182-I232 HydrophobicContact CE3-CD1 4.2Å; W182-I232 HydrophobicContact CZ3-CD1 3.89Å; L186-I232 HydrophobicContact CD1-CG1 4.22Å; I214-I232 HydrophobicContact CG2-CG2 4.48Å; L218-I232 HydrophobicContact CD1-CG2 4.38Å; L218-I232 HydrophobicContact CD2-CD1 4.13Å; L218-I232 HydrophobicContact CD2-CG2 4.46Å; L224-I232 HydrophobicContact CD1-CD1 4.3Å; L224-I232 HydrophobicContact CD2-CD1 3.98Å; D228-I232 WeakPolarHBondContact O-CB 3.43Å; D228-I232 WeakPolarHBondContact O-CD1 3.49Å; D228-I232 WeakPolarHBondContact O-CG1 3.49Å; D228-I232 PolarHBondContact O-N 3.37Å; H229-I232 PolarHBondContact O-N 3.2Å; E230-I232 VanDerWaalsContact C-N 3.29Å; E230-I232 PolarHBondContact O-N 3.13Å; I232-V234 PolarHBondContact O-N 3.29Å; I232-A235 WeakPolarHBondContact O-CB 3.43Å; I232-A235 PolarHBondContact O-N 3.33Å; I232-A235 VanDerWaalsContact O-N 3.11Å; I232-I236 WeakPolarHBondContact O-CG1 3.49Å; I232-I236 PolarHBondContact O-N 2.89Å; I232-I236 VanDerWaalsContact O-N 3.1Å
233	I	84.7	Confident	79.6	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.1	-44	179.9	-60.6	159.9	0	0	0	110.9	H229 E230 A235 I236 A237 F252 F253 H256 V265 V269 F270	H229-I233 WeakPolarHBondContact O-CD1 3.42Å; H229-I233 VanDerWaalsContact O-CG1 3.24Å; H229-I233 WeakPolarHBondContact O-CG1 3.32Å; H229-I233 PolarHBondContact O-N 2.89Å; E230-I233 PolarHBondContact O-N 3.34Å; I233-A235 VanDerWaalsContact C-N 3.29Å; I233-A235 PolarHBondContact O-N 3.49Å; I233-I236 VanDerWaalsContact O-CG1 3.24Å; I233-I236 WeakPolarHBondContact O-CG1 3.34Å; I233-I236 PolarHBondContact O-N 3.47Å; I233-A237 PolarHBondContact O-N 2.98Å; I233-F252 HydrophobicContact CD1-CE1 4.12Å; I233-F252 HydrophobicContact CG1-CE1 3.89Å; I233-F253 HydrophobicContact CG1-CD1 4.34Å; I233-F253 HydrophobicContact CG1-CE1 4.07Å; I233-F253 HydrophobicContact CG2-CE1 4.41Å; I233-H256 HydrophobicContact CD1-CB 4.15Å; I233-V265 HydrophobicContact CB-CG1 3.85Å; I233-V265 HydrophobicContact CD1-CG1 3.98Å; I233-V265 HydrophobicContact CG2-CG1 3.33Å; I233-V269 HydrophobicContact CG2-CG1 3.98Å; I233-F270 HydrophobicContact CD1-CZ 4Å; I233-F270 HydrophobicContact CG2-CD1 4.47Å; I233-F270 HydrophobicContact CG2-CE1 3.65Å; I233-F270 HydrophobicContact CG2-CZ 4.17Å
234	V	85.3	Confident	80.2	Confident	79 Å²	79	36.5 Å²	36.5	48%	0.479	20%	0.202	S	C	.	.	H	α-helix	trans	-63.8	-34.6	175.3	173	0	0	0	0	111.6	E230 I232 V265	E230-V234 WeakPolarHBondContact O-CB 3.2Å; E230-V234 WeakPolarHBondContact O-CG2 3.35Å; E230-V234 PolarHBondContact O-N 2.9Å; I232-V234 PolarHBondContact O-N 3.29Å; V234-V265 HydrophobicContact CG2-CG2 4.08Å
235	A	84	Confident	80.6	Confident	10 Å²	10	35.7 Å²	35.7	8%	0.083	20%	0.198	C	C	.	.	H	α-helix	trans	-67.9	-32.6	176.8	0	0	0	0	0	113.2	L186 I189 R190 V193 N231 I232 I233	L186-A235 HydrophobicContact CD1-CB 4.08Å; I189-A235 HydrophobicContact CG2-CB 4.07Å; R190-A235 HydrophobicContact CG-CB 3.8Å; V193-A235 WeakPolarHBondContact CG2-O 3.42Å; N231-A235 WeakPolarHBondContact O-CB 3.45Å; N231-A235 PolarHBondContact O-N 3.44Å; N231-A235 VanDerWaalsContact O-N 3.13Å; I232-A235 WeakPolarHBondContact O-CB 3.43Å; I232-A235 PolarHBondContact O-N 3.33Å; I232-A235 VanDerWaalsContact O-N 3.11Å; I233-A235 VanDerWaalsContact C-N 3.29Å; I233-A235 PolarHBondContact O-N 3.49Å
236	I	86.2	Confident	80.9	Confident	0 Å²	0	33.8 Å²	33.8	0%	0	19%	0.185	C	C	.	.	H	α-helix	trans	-92.9	-12.7	180	63.9	177.7	0	0	0	114.3	I189 V193 L211 I214 I232 I233 P238 L239 L240 L249 F253	I189-I236 HydrophobicContact CG2-CG2 4.23Å; V193-I236 HydrophobicContact CG2-CG2 4.49Å; L211-I236 HydrophobicContact CD2-CB 4.3Å; I214-I236 HydrophobicContact CD1-CG2 3.56Å; I214-I236 HydrophobicContact CG2-CG2 4.37Å; I232-I236 WeakPolarHBondContact O-CG1 3.49Å; I232-I236 PolarHBondContact O-N 2.89Å; I232-I236 VanDerWaalsContact O-N 3.1Å; I233-I236 VanDerWaalsContact O-CG1 3.24Å; I233-I236 WeakPolarHBondContact O-CG1 3.34Å; I233-I236 PolarHBondContact O-N 3.47Å; I236-P238 VanDerWaalsContact C-N 3.3Å; I236-P238 VanDerWaalsContact O-N 3.16Å; I236-L239 PolarHBondContact O-N 3.32Å; I236-L240 HydrophobicContact CD1-CD1 4.05Å; I236-L240 HydrophobicContact CG1-CD1 3.92Å; I236-L240 HydrophobicContact CG1-CG 4.47Å; I236-L240 PolarHBondContact O-N 3.19Å; I236-L249 HydrophobicContact CD1-CD1 3.88Å; I236-L249 HydrophobicContact CD1-CD2 4.03Å; I236-L249 HydrophobicContact CD1-CG 4.49Å; I236-F253 HydrophobicContact CD1-CE1 4.01Å; I236-F253 HydrophobicContact CD1-CZ 3.87Å
237	A	84.2	Confident	81.2	Confident	15 Å²	15	35.4 Å²	35.4	12%	0.124	19%	0.192	C	C	.	.	H	α-helix	trans	-45.8	-44.5	-178.7	0	0	0	0	0	114.1	I233 L239 L240 E241 V269	I233-A237 PolarHBondContact O-N 2.98Å; A237-L239 PolarHBondContact O-N 3.37Å; A237-L239 VanDerWaalsContact O-N 3.16Å; A237-L240 PolarHBondContact O-N 3.35Å; A237-L240 VanDerWaalsContact O-N 3.08Å; A237-E241 PolarHBondContact O-N 3.21Å; A237-V269 HydrophobicContact CB-CB 4.43Å; A237-V269 HydrophobicContact CB-CG1 3.54Å; A237-V269 HydrophobicContact CB-CG2 4.02Å
238	P	84.3	Confident	81.5	Confident	43 Å²	43	33 Å²	33	28%	0.279	18%	0.183	S	C	.	.	H	α-helix	trans	-63	-22.4	178.8	-26.1	37.9	0	0	0	115.5	V193 L197 I236	V193-P238 HydrophobicContact CG1-CB 4.43Å; L197-P238 HydrophobicContact CD1-CB 3.76Å; I236-P238 VanDerWaalsContact C-N 3.3Å; I236-P238 VanDerWaalsContact O-N 3.16Å
239	L	81.8	Confident	81.7	Confident	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-83.2	-36.4	174	-60.5	-174	0	0	0	111.5	V193 A196 L197 P210 L211 I236 A237 E241 N242 N243	V193-L239 HydrophobicContact CB-CD1 4.44Å; V193-L239 HydrophobicContact CG1-CD1 4.45Å; V193-L239 HydrophobicContact CG1-CD2 4.24Å; V193-L239 HydrophobicContact CG1-CG 3.99Å; V193-L239 HydrophobicContact CG2-CD1 3.8Å; V193-L239 HydrophobicContact CG2-CG 4.17Å; A196-L239 HydrophobicContact CB-CD2 3.97Å; L197-L239 HydrophobicContact CD2-CD2 3.98Å; L197-L239 HydrophobicContact CG-CD2 4.16Å; P210-L239 HydrophobicContact CB-CD1 3.62Å; P210-L239 HydrophobicContact CG-CD1 4.21Å; L211-L239 HydrophobicContact CD1-CB 4.25Å; L211-L239 HydrophobicContact CD2-CB 4.01Å; L211-L239 HydrophobicContact CD2-CD1 4.25Å; L211-L239 HydrophobicContact CG-CB 4.15Å; L211-L239 HydrophobicContact CG-CD1 4.21Å; I236-L239 PolarHBondContact O-N 3.32Å; A237-L239 PolarHBondContact O-N 3.37Å; A237-L239 VanDerWaalsContact O-N 3.16Å; L239-E241 PolarHBondContact O-N 3.25Å; L239-N242 PolarHBondContact O-N 3.36Å; L239-N243 WeakPolarHBondContact O-CB 3.32Å; L239-N243 PolarHBondContact O-N 3.47Å; L239-N243 PolarHBondContact O-ND2 2.88Å
240	L	81.1	Confident	82	Confident	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	H	α-helix	trans	-69	-24.4	176.6	-57.3	173.9	0	0	0	112.1	L211 I236 A237 N242 P245 L249 F253 V273	L211-L240 HydrophobicContact CD1-CD2 4.1Å; L211-L240 HydrophobicContact CD2-CD2 3.81Å; L211-L240 HydrophobicContact CD2-CG 4.36Å; I236-L240 HydrophobicContact CD1-CD1 4.05Å; I236-L240 HydrophobicContact CG1-CD1 3.92Å; I236-L240 HydrophobicContact CG1-CG 4.47Å; I236-L240 PolarHBondContact O-N 3.19Å; A237-L240 PolarHBondContact O-N 3.35Å; A237-L240 VanDerWaalsContact O-N 3.08Å; L240-N242 PolarHBondContact O-N 3.2Å; L240-N242 VanDerWaalsContact O-N 3.09Å; L240-P245 HydrophobicContact CD2-CB 4.11Å; L240-L249 HydrophobicContact CD2-CD2 4.16Å; L240-F253 HydrophobicContact CD1-CE2 4.04Å; L240-F253 HydrophobicContact CD1-CZ 3.65Å; L240-F253 HydrophobicContact CD2-CE2 4.47Å; L240-F253 HydrophobicContact CD2-CZ 4.43Å; L240-V273 HydrophobicContact CB-CG2 3.66Å; L240-V273 HydrophobicContact CD1-CG2 4.47Å
241	E	74.9	Confident	82	Confident	108 Å²	108	35 Å²	35	51%	0.505	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18.3	170.9	-85	-178.5	-147.5	0	0	114.3	A237 L239 R276	A237-E241 PolarHBondContact O-N 3.21Å; L239-E241 PolarHBondContact O-N 3.25Å; E241-R276 VanDerWaalsContact C-NH1 3.31Å; E241-R276 PolarHBondContact O-NH1 3.16Å; E241-R276 PolarHBondContact O-NH2 2.89Å
242	N	70.9	Confident	82	Confident	107 Å²	107	33.7 Å²	33.7	57%	0.572	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	-132	-4.8	-179.5	-70.4	-64.3	0	0	0	114.8	L239 L240	L239-N242 PolarHBondContact O-N 3.36Å; L240-N242 PolarHBondContact O-N 3.2Å; L240-N242 VanDerWaalsContact O-N 3.09Å
243	N	77.4	Confident	82.2	Confident	9 Å²	9	33.6 Å²	33.6	5%	0.048	18%	0.183	C	C	.	.	S	Bend	trans	-136.8	153.8	-170.5	-60.9	-94.5	0	0	0	112	H207 L211 L239	H207-N243 WeakPolarHBondContact CB-ND2 3.43Å; H207-N243 WeakPolarHBondContact CB-OD1 3.36Å; L211-N243 HydrophobicContact CD1-CB 4Å; L239-N243 WeakPolarHBondContact O-CB 3.32Å; L239-N243 PolarHBondContact O-N 3.47Å; L239-N243 PolarHBondContact O-ND2 2.88Å
244	H	77.8	Confident	82.3	Confident	61 Å²	61	33.7 Å²	33.7	28%	0.282	18%	0.183	S	C	.	.	P	Polyproline II helix	trans	-77.9	138.9	173.9	-61.6	157.2	0	0	0	111.3	M282	H244-M282 PolarHBondContact CE1-SD 3.46Å
245	P	83	Confident	82.2	Confident	4 Å²	4	33.4 Å²	33.4	3%	0.026	18%	0.176	C	C	.	.	P	Polyproline II helix	trans	-68	137.8	177.5	25.6	-32.8	0	0	0	111.9	L240 L249 F253 V273 I277 L290	L240-P245 HydrophobicContact CD2-CB 4.11Å; P245-L249 HydrophobicContact CB-CD2 4.06Å; P245-F253 HydrophobicContact CB-CD2 4.46Å; P245-F253 HydrophobicContact CB-CE2 3.84Å; P245-F253 HydrophobicContact CG-CE2 4.4Å; P245-V273 HydrophobicContact CG-CG1 4.22Å; P245-I277 HydrophobicContact CG-CD1 4.47Å; P245-L290 HydrophobicContact CG-CD2 3.94Å
246	P	83.7	Confident	82.3	Confident	17 Å²	17	33 Å²	33	11%	0.11	17%	0.172	C	C	.	.	P	Polyproline II helix	trans	-59.9	160.3	172.4	-27.1	36.1	0	0	0	113.7	L211 D248 L249 C250	L211-P246 HydrophobicContact CB-CG 3.85Å; P246-D248 PolarHBondContact O-N 3.27Å; P246-L249 HydrophobicContact CB-CB 4.41Å; P246-L249 WeakPolarHBondContact O-CB 3.43Å; P246-L249 PolarHBondContact O-N 3Å; P246-C250 PolarHBondContact O-N 2.93Å; P246-C250 PolarHBondContact O-SG 3.34Å
247	P	79.9	Confident	82.2	Confident	66 Å²	66	33 Å²	33	43%	0.429	17%	0.173	S	C	.	.	H	α-helix	trans	-59.8	-40.3	-174.1	-26.6	36.2	0	0	0	115.4	C250 E251 R289	P247-C250 WeakPolarHBondContact O-CB 3.08Å; P247-C250 PolarHBondContact O-N 3.23Å; P247-E251 PolarHBondContact O-N 3.37Å; P247-R289 WeakPolarHBondContact O-CD 3.13Å; P247-R289 PolarHBondContact O-NH1 2.69Å
248	D	82.3	Confident	82.2	Confident	52 Å²	52	38.9 Å²	38.9	28%	0.278	19%	0.191	S	C	.	.	H	α-helix	trans	-76.8	-33.8	-179.8	-25	-74.8	0	0	0	111.2	S215 A219 P246 C250 E251 F252 R289	S215-D248 VanDerWaalsContact OG-CB 3.3Å; S215-D248 WeakPolarHBondContact OG-CB 3.47Å; S215-D248 PolarHBondContact OG-OD2 3.08Å; A219-D248 HydrophobicContact CB-CB 4.32Å; P246-D248 PolarHBondContact O-N 3.27Å; D248-C250 VanDerWaalsContact C-N 3.25Å; D248-C250 PolarHBondContact O-N 3.31Å; D248-E251 WeakPolarHBondContact O-CB 3.47Å; D248-E251 PolarHBondContact O-N 2.97Å; D248-F252 PolarHBondContact O-N 3.4Å; D248-R289 IonicContact OD1-CZ 3.98Å; D248-R289 IonicContact OD1-NH1 3.9Å; D248-R289 PolarHBondContact OD1-NH1 2.94Å; D248-R289 IonicContact OD1-NH2 3.15Å
249	L	84.9	Confident	82.2	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-60.3	-35.4	170.8	-170.9	67.5	0	0	0	112	L211 S215 L218 I236 L240 P245 P246 E251 F252 F253	L211-L249 HydrophobicContact CD2-CD2 4.14Å; S215-L249 PolarHBondContact OG-N 3.18Å; S215-L249 VanDerWaalsContact OG-N 3.11Å; L218-L249 HydrophobicContact CD1-CD1 3.65Å; I236-L249 HydrophobicContact CD1-CD1 3.88Å; I236-L249 HydrophobicContact CD1-CD2 4.03Å; I236-L249 HydrophobicContact CD1-CG 4.49Å; L240-L249 HydrophobicContact CD2-CD2 4.16Å; P245-L249 HydrophobicContact CB-CD2 4.06Å; P246-L249 HydrophobicContact CB-CB 4.41Å; P246-L249 WeakPolarHBondContact O-CB 3.43Å; P246-L249 PolarHBondContact O-N 3Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.15Å; L249-F252 HydrophobicContact CD1-CD1 4.4Å; L249-F252 WeakPolarHBondContact O-CB 3.27Å; L249-F252 PolarHBondContact O-N 3.22Å; L249-F253 HydrophobicContact CD1-CD1 4.47Å; L249-F253 HydrophobicContact CD1-CE1 3.69Å; L249-F253 HydrophobicContact CD1-CZ 3.84Å; L249-F253 HydrophobicContact CD2-CE1 4.36Å; L249-F253 HydrophobicContact CD2-CE2 4.1Å; L249-F253 HydrophobicContact CD2-CZ 3.64Å; L249-F253 HydrophobicContact CG-CD1 4.46Å; L249-F253 HydrophobicContact CG-CE1 3.76Å; L249-F253 HydrophobicContact CG-CE2 3.92Å; L249-F253 HydrophobicContact CG-CZ 3.45Å; L249-F253 VanDerWaalsContact CG-CZ 3.45Å; L249-F253 WeakPolarHBondContact O-CD1 3.47Å; L249-F253 VanDerWaalsContact O-CG 3.24Å; L249-F253 WeakPolarHBondContact O-CG 3.4Å; L249-F253 PolarHBondContact O-N 3.49Å
250	C	84.9	Confident	82.2	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-63.6	-37.4	172.1	-65.6	0	0	0	0	112.7	P246 P247 D248 F253 C254 R289 F293	P246-C250 PolarHBondContact O-N 2.93Å; P246-C250 PolarHBondContact O-SG 3.34Å; P247-C250 WeakPolarHBondContact O-CB 3.08Å; P247-C250 PolarHBondContact O-N 3.23Å; D248-C250 VanDerWaalsContact C-N 3.25Å; D248-C250 PolarHBondContact O-N 3.31Å; C250-F253 PolarHBondContact O-N 2.73Å; C250-C254 PolarHBondContact O-N 3.47Å; C250-C254 PolarHBondContact O-SG 2.84Å; C250-R289 HydrophobicContact CB-CB 4.13Å; C250-F293 HydrophobicContact CB-CB 4.15Å
251	E	83.9	Confident	82.2	Confident	113 Å²	113	46.7 Å²	46.7	53%	0.528	22%	0.222	S	C	.	.	H	α-helix	trans	-68	-39.6	176.5	-175.6	166.3	-175.8	0	0	111.4	P247 D248 L249 F253 C254 K255 R289	P247-E251 PolarHBondContact O-N 3.37Å; D248-E251 WeakPolarHBondContact O-CB 3.47Å; D248-E251 PolarHBondContact O-N 2.97Å; L249-E251 VanDerWaalsContact C-N 3.33Å; L249-E251 PolarHBondContact O-N 3.15Å; E251-F253 PolarHBondContact O-N 2.63Å; E251-C254 WeakPolarHBondContact O-CB 3.4Å; E251-C254 PolarHBondContact O-N 3.06Å; E251-K255 PolarHBondContact O-N 3.41Å; E251-R289 IonicContact OE2-CZ 3.09Å; E251-R289 IonicContact OE2-NE 3.57Å; E251-R289 IonicContact OE2-NH1 2.72Å
252	F	83.9	Confident	82.4	Confident	21 Å²	21	49.6 Å²	49.6	9%	0.092	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-42.4	170.1	-178	-102.2	0	0	0	112.3	L218 L224 H229 I233 D248 L249 K255 H256	L218-F252 HydrophobicContact CB-CD2 4.43Å; L218-F252 HydrophobicContact CD1-CD1 3.82Å; L218-F252 HydrophobicContact CD1-CD2 4.3Å; L218-F252 HydrophobicContact CD1-CE1 4.01Å; L218-F252 HydrophobicContact CD1-CE2 4.47Å; L218-F252 HydrophobicContact CD1-CG 3.96Å; L218-F252 HydrophobicContact CD1-CZ 4.32Å; L218-F252 HydrophobicContact CD2-CD2 4.26Å; L218-F252 HydrophobicContact CD2-CE1 4.47Å; L218-F252 HydrophobicContact CD2-CE2 3.88Å; L218-F252 HydrophobicContact CD2-CZ 3.98Å; L224-F252 HydrophobicContact CD1-CE2 4.07Å; H229-F252 HydrophobicContact CB-CZ 4.15Å; H229-F252 AromaticContact CD2-CE2 3.47Å; H229-F252 VanDerWaalsContact CD2-CE2 3.47Å; H229-F252 WeakPolarHBondContact CD2-CE2 3.15Å; H229-F252 AromaticContact CD2-CZ 3.51Å; H229-F252 AromaticContact CG-CZ 3.93Å; H229-F252 AromaticContact NE2-CE2 3.67Å; I233-F252 HydrophobicContact CD1-CE1 4.12Å; I233-F252 HydrophobicContact CG1-CE1 3.89Å; D248-F252 PolarHBondContact O-N 3.4Å; L249-F252 HydrophobicContact CD1-CD1 4.4Å; L249-F252 WeakPolarHBondContact O-CB 3.27Å; L249-F252 PolarHBondContact O-N 3.22Å; F252-K255 WeakPolarHBondContact O-CB 3.26Å; F252-K255 PolarHBondContact O-N 2.88Å; F252-H256 PolarHBondContact O-N 2.97Å; F252-H256 VanDerWaalsContact O-N 3.08Å
253	F	87.6	Confident	83	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-67.1	-39	174.6	-61.5	-16.6	0	0	0	112.8	I233 I236 L240 P245 L249 C250 E251 K255 H256 C257 F270 F293	I233-F253 HydrophobicContact CG1-CD1 4.34Å; I233-F253 HydrophobicContact CG1-CE1 4.07Å; I233-F253 HydrophobicContact CG2-CE1 4.41Å; I236-F253 HydrophobicContact CD1-CE1 4.01Å; I236-F253 HydrophobicContact CD1-CZ 3.87Å; L240-F253 HydrophobicContact CD1-CE2 4.04Å; L240-F253 HydrophobicContact CD1-CZ 3.65Å; L240-F253 HydrophobicContact CD2-CE2 4.47Å; L240-F253 HydrophobicContact CD2-CZ 4.43Å; P245-F253 HydrophobicContact CB-CD2 4.46Å; P245-F253 HydrophobicContact CB-CE2 3.84Å; P245-F253 HydrophobicContact CG-CE2 4.4Å; L249-F253 HydrophobicContact CD1-CD1 4.47Å; L249-F253 HydrophobicContact CD1-CE1 3.69Å; L249-F253 HydrophobicContact CD1-CZ 3.84Å; L249-F253 HydrophobicContact CD2-CE1 4.36Å; L249-F253 HydrophobicContact CD2-CE2 4.1Å; L249-F253 HydrophobicContact CD2-CZ 3.64Å; L249-F253 HydrophobicContact CG-CD1 4.46Å; L249-F253 HydrophobicContact CG-CE1 3.76Å; L249-F253 HydrophobicContact CG-CE2 3.92Å; L249-F253 HydrophobicContact CG-CZ 3.45Å; L249-F253 VanDerWaalsContact CG-CZ 3.45Å; L249-F253 WeakPolarHBondContact O-CD1 3.47Å; L249-F253 VanDerWaalsContact O-CG 3.24Å; L249-F253 WeakPolarHBondContact O-CG 3.4Å; L249-F253 PolarHBondContact O-N 3.49Å; C250-F253 PolarHBondContact O-N 2.73Å; E251-F253 PolarHBondContact O-N 2.63Å; F253-K255 VanDerWaalsContact C-N 3.3Å; F253-K255 PolarHBondContact O-N 2.71Å; F253-H256 PolarHBondContact O-N 3.4Å; F253-C257 PolarHBondContact O-N 2.92Å; F253-C257 PolarHBondContact O-SG 3.33Å; F253-C257 VanDerWaalsContact O-SG 3.38Å; F253-F270 HydrophobicContact CB-CE1 4.17Å; F253-F270 HydrophobicContact CB-CE2 4.21Å; F253-F270 HydrophobicContact CB-CZ 3.7Å; F253-F270 AromaticContact CD1-CE1 3.66Å; F253-F270 HydrophobicContact CD1-CE1 3.66Å; F253-F270 AromaticContact CD1-CZ 3.6Å; F253-F270 HydrophobicContact CD1-CZ 3.6Å; F253-F270 AromaticContact CD2-CE1 3.89Å; F253-F270 HydrophobicContact CD2-CE1 3.89Å; F253-F270 HydrophobicContact CD2-CZ 4.29Å; F253-F270 AromaticContact CE1-CE1 3.95Å; F253-F270 HydrophobicContact CE1-CE1 3.95Å; F253-F270 HydrophobicContact CE1-CZ 4.29Å; F253-F270 HydrophobicContact CE2-CE1 4.14Å; F253-F270 AromaticContact CG-CE1 3.65Å; F253-F270 HydrophobicContact CG-CE1 3.65Å; F253-F270 AromaticContact CG-CZ 3.61Å; F253-F270 HydrophobicContact CG-CZ 3.61Å; F253-F270 HydrophobicContact CZ-CE1 4.17Å; F253-F293 HydrophobicContact CB-CD2 3.48Å; F253-F293 VanDerWaalsContact CB-CD2 3.48Å; F253-F293 HydrophobicContact CB-CE2 3.45Å; F253-F293 VanDerWaalsContact CB-CE2 3.45Å; F253-F293 HydrophobicContact CB-CG 4.34Å; F253-F293 HydrophobicContact CB-CZ 4.27Å; F253-F293 HydrophobicContact CD2-CD2 4.27Å; F253-F293 HydrophobicContact CD2-CE1 4.2Å; F253-F293 AromaticContact CD2-CE2 3.93Å; F253-F293 HydrophobicContact CD2-CE2 3.93Å; F253-F293 AromaticContact CD2-CZ 3.88Å; F253-F293 HydrophobicContact CD2-CZ 3.88Å; F253-F293 HydrophobicContact CG-CD2 4.4Å; F253-F293 HydrophobicContact CG-CE2 4.11Å; F253-F293 HydrophobicContact CG-CZ 4.47Å
254	C	85.7	Confident	83.1	Confident	2 Å²	2	50.8 Å²	50.8	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-56.8	-44.9	172.8	-67.6	0	0	0	0	111.3	C250 E251 C257 R258 F293 E296	C250-C254 PolarHBondContact O-N 3.47Å; C250-C254 PolarHBondContact O-SG 2.84Å; E251-C254 WeakPolarHBondContact O-CB 3.4Å; E251-C254 PolarHBondContact O-N 3.06Å; C254-C257 PolarHBondContact O-N 2.72Å; C254-R258 WeakPolarHBondContact O-CG 3.27Å; C254-R258 PolarHBondContact O-N 2.92Å; C254-R258 VanDerWaalsContact O-N 3.17Å; C254-F293 WeakPolarHBondContact SG-CA 3.26Å; C254-F293 PolarHBondContact SG-N 3.33Å; C254-E296 HydrophobicContact CB-CB 4.49Å; C254-E296 HydrophobicContact CB-CG 4.01Å
255	K	84.6	Confident	83.2	Confident	73 Å²	73	48.4 Å²	48.4	32%	0.317	22%	0.223	S	C	.	.	H	α-helix	trans	-59.2	-46.6	175.6	-175.6	-179.5	175.3	-174.3	0	111.1	E251 F252 F253 R258 E259	E251-K255 PolarHBondContact O-N 3.41Å; F252-K255 WeakPolarHBondContact O-CB 3.26Å; F252-K255 PolarHBondContact O-N 2.88Å; F253-K255 VanDerWaalsContact C-N 3.3Å; F253-K255 PolarHBondContact O-N 2.71Å; K255-R258 PolarHBondContact O-N 2.69Å; K255-E259 WeakPolarHBondContact CE-OE1 3.38Å; K255-E259 HydrophobicContact CG-CG 4.37Å; K255-E259 WeakPolarHBondContact CG-OE1 3.23Å; K255-E259 IonicContact NZ-OE1 2.73Å; K255-E259 WeakPolarHBondContact O-CB 3.44Å; K255-E259 WeakPolarHBondContact O-CG 3.45Å; K255-E259 PolarHBondContact O-N 2.78Å
256	H	84.8	Confident	83.1	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-62.3	-43.3	177.8	-170.5	73.4	0	0	0	113	E230 I233 F252 F253 R258 E259 R260 F270	E230-H256 VanDerWaalsContact CG-CE1 3.47Å; E230-H256 WeakPolarHBondContact CG-CE1 3.46Å; E230-H256 IonicContact OE1-CE1 2.7Å; I233-H256 HydrophobicContact CD1-CB 4.15Å; F252-H256 PolarHBondContact O-N 2.97Å; F252-H256 VanDerWaalsContact O-N 3.08Å; F253-H256 PolarHBondContact O-N 3.4Å; H256-R258 VanDerWaalsContact C-N 3.31Å; H256-R258 PolarHBondContact O-N 3.06Å; H256-E259 PolarHBondContact O-N 3.41Å; H256-R260 PolarHBondContact O-N 3.29Å; H256-F270 AromaticContact CD2-CE2 3.96Å
257	C	85.4	Confident	82.8	Confident	2 Å²	2	50.6 Å²	50.6	1%	0.014	23%	0.233	C	C	.	.	H	α-helix	trans	-58.6	-39.8	176.4	-70.8	0	0	0	0	112.7	F253 C254 P261 E296 A300	F253-C257 PolarHBondContact O-N 2.92Å; F253-C257 PolarHBondContact O-SG 3.33Å; F253-C257 VanDerWaalsContact O-SG 3.38Å; C254-C257 PolarHBondContact O-N 2.72Å; C257-P261 WeakPolarHBondContact O-CA 3.43Å; C257-P261 WeakPolarHBondContact O-CD 3.42Å; C257-E296 HydrophobicContact CB-CB 4.01Å; C257-A300 HydrophobicContact CB-CB 4.09Å
258	R	83.9	Confident	82.9	Confident	137 Å²	137	53.6 Å²	53.6	52%	0.517	24%	0.241	S	C	.	.	H	α-helix	trans	-74.4	-39	178.1	-66.2	175.1	-168.4	141.5	1.2	113.5	C254 K255 H256 E296	C254-R258 WeakPolarHBondContact O-CG 3.27Å; C254-R258 PolarHBondContact O-N 2.92Å; C254-R258 VanDerWaalsContact O-N 3.17Å; K255-R258 PolarHBondContact O-N 2.69Å; H256-R258 VanDerWaalsContact C-N 3.31Å; H256-R258 PolarHBondContact O-N 3.06Å; R258-E296 WeakPolarHBondContact CG-OE2 3.44Å; R258-E296 IonicContact CZ-OE1 3.76Å; R258-E296 VanDerWaalsContact CZ-OE1 3.31Å; R258-E296 IonicContact CZ-OE2 2.71Å; R258-E296 IonicContact NE-OE1 3.97Å; R258-E296 PolarHBondContact NE-OE1 3.19Å; R258-E296 VanDerWaalsContact NE-OE1 3.14Å; R258-E296 IonicContact NE-OE2 3.97Å; R258-E296 PolarHBondContact NE-OE2 3.09Å; R258-E296 VanDerWaalsContact NH2-CD 3.26Å; R258-E296 IonicContact NH2-OE1 3.98Å; R258-E296 PolarHBondContact NH2-OE1 2.83Å; R258-E296 IonicContact NH2-OE2 3.86Å
259	E	83.5	Confident	82.9	Confident	102 Å²	102	52 Å²	52	48%	0.477	23%	0.234	S	C	.	.	H	α-helix	trans	-79.5	-33	-177.5	-71.3	176.3	173.7	0	0	112.7	H229 K255 H256	H229-E259 IonicContact CE1-OE2 3.87Å; H229-E259 IonicContact ND1-OE2 2.74Å; K255-E259 WeakPolarHBondContact CE-OE1 3.38Å; K255-E259 HydrophobicContact CG-CG 4.37Å; K255-E259 WeakPolarHBondContact CG-OE1 3.23Å; K255-E259 IonicContact NZ-OE1 2.73Å; K255-E259 WeakPolarHBondContact O-CB 3.44Å; K255-E259 WeakPolarHBondContact O-CG 3.45Å; K255-E259 PolarHBondContact O-N 2.78Å; H256-E259 PolarHBondContact O-N 3.41Å
260	R	82	Confident	83	Confident	87 Å²	87	52 Å²	52	33%	0.328	23%	0.234	S	C	.	.			trans	-141.9	64	-175.2	-67.8	-169.2	168.4	-168.7	-0.9	112.6	A226 E230 H256 R262 S263	A226-R260 VanDerWaalsContact CB-CZ 3.49Å; A226-R260 VanDerWaalsContact CB-NH2 3.35Å; A226-R260 PolarHBondContact O-NH1 3.17Å; E230-R260 VanDerWaalsContact OE1-CD 3.28Å; E230-R260 WeakPolarHBondContact OE1-CD 3.38Å; E230-R260 IonicContact OE1-CZ 3.18Å; E230-R260 IonicContact OE1-NE 3.35Å; E230-R260 IonicContact OE1-NH1 3.17Å; E230-R260 PolarHBondContact OE1-NH1 3.46Å; E230-R260 IonicContact OE2-NH1 3.29Å; E230-R260 PolarHBondContact OE2-NH1 2.9Å; E230-R260 VanDerWaalsContact OE2-NH1 3.15Å; H256-R260 PolarHBondContact O-N 3.29Å; R260-R262 PolarHBondContact O-N 2.98Å; R260-R262 VanDerWaalsContact O-N 3.08Å; R260-S263 WeakPolarHBondContact O-CB 3.47Å; R260-S263 PolarHBondContact O-N 3.24Å
261	P	80.3	Confident	83.2	Confident	18 Å²	18	53.2 Å²	53.2	12%	0.117	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.6	179.9	25.6	-37.2	0	0	0	113.5	C257 A300 E303 L304	C257-P261 WeakPolarHBondContact O-CA 3.43Å; C257-P261 WeakPolarHBondContact O-CD 3.42Å; P261-A300 HydrophobicContact CB-CB 3.78Å; P261-E303 HydrophobicContact CB-CB 4.02Å; P261-E303 HydrophobicContact CG-CB 4.22Å; P261-E303 WeakPolarHBondContact CG-OE2 3.32Å; P261-L304 WeakPolarHBondContact O-CD2 3.41Å
262	R	80.6	Confident	83.3	Confident	170 Å²	170	50.1 Å²	50.1	64%	0.642	23%	0.231	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.4	7.6	-179.3	-62.8	177.4	-177.5	165.7	1.1	114.6	R260 E303 L304	R260-R262 PolarHBondContact O-N 2.98Å; R260-R262 VanDerWaalsContact O-N 3.08Å; R262-E303 PolarHBondContact NE-O 2.8Å; R262-E303 PolarHBondContact NH2-O 3.46Å; R262-L304 HydrophobicContact CB-CD2 4.33Å; R262-L304 HydrophobicContact CG-CD2 4.01Å
263	S	83	Confident	83.4	Confident	16 Å²	16	49.4 Å²	49.4	11%	0.112	23%	0.228	C	C	.	.			trans	-69.8	142.5	177.1	-170.4	0	0	0	0	111.1	E230 R260 V265 V266	E230-S263 WeakPolarHBondContact OE1-CB 3.44Å; E230-S263 PolarHBondContact OE1-OG 3.4Å; R260-S263 WeakPolarHBondContact O-CB 3.47Å; R260-S263 PolarHBondContact O-N 3.24Å; S263-V265 PolarHBondContact O-N 3.48Å; S263-V265 VanDerWaalsContact O-N 3.15Å; S263-V266 WeakPolarHBondContact O-CB 3.45Å; S263-V266 PolarHBondContact O-N 3.25Å
264	M	79.4	Confident	83.4	Confident	125 Å²	125	49.4 Å²	49.4	62%	0.616	23%	0.228	S	C	*	.	H	α-helix	trans	-61	-24	175.3	-60.9	-161	75	0	0	112	V266 I267 E268	M264-V266 VanDerWaalsContact C-N 3.28Å; M264-V266 PolarHBondContact O-N 3.4Å; M264-I267 PolarHBondContact O-N 3Å; M264-I267 VanDerWaalsContact O-N 3.15Å; M264-E268 WeakPolarHBondContact O-CB 3.4Å; M264-E268 PolarHBondContact O-N 3Å
265	V	80.6	Confident	83.5	Confident	10 Å²	10	51.1 Å²	51.1	6%	0.061	24%	0.235	C	C	.	.	H	α-helix	trans	-57.3	-39.5	172.5	177.2	0	0	0	0	112.2	E230 I233 V234 S263 V269 F270	E230-V265 HydrophobicContact CB-CG2 4.07Å; E230-V265 HydrophobicContact CG-CG2 3.98Å; I233-V265 HydrophobicContact CB-CG1 3.85Å; I233-V265 HydrophobicContact CD1-CG1 3.98Å; I233-V265 HydrophobicContact CG2-CG1 3.33Å; V234-V265 HydrophobicContact CG2-CG2 4.08Å; S263-V265 PolarHBondContact O-N 3.48Å; S263-V265 VanDerWaalsContact O-N 3.15Å; V265-V269 HydrophobicContact CG1-CB 4.25Å; V265-V269 HydrophobicContact CG1-CG2 4.46Å; V265-V269 WeakPolarHBondContact O-CA 3.17Å; V265-V269 WeakPolarHBondContact O-CB 3.41Å; V265-V269 PolarHBondContact O-N 3.37Å; V265-F270 HydrophobicContact CG1-CE1 4.36Å; V265-F270 HydrophobicContact CG1-CZ 4.29Å; V265-F270 PolarHBondContact O-N 2.84Å; V265-F270 VanDerWaalsContact O-N 3.08Å
266	V	79.2	Confident	83.5	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-64.4	-45.3	176.8	-178.7	0	0	0	0	109.9	S263 M264 F270 T271 Y297 A300	S263-V266 WeakPolarHBondContact O-CB 3.45Å; S263-V266 PolarHBondContact O-N 3.25Å; M264-V266 VanDerWaalsContact C-N 3.28Å; M264-V266 PolarHBondContact O-N 3.4Å; V266-F270 HydrophobicContact CB-CD2 4.43Å; V266-F270 HydrophobicContact CG2-CD2 4.22Å; V266-F270 HydrophobicContact CG2-CE2 4.47Å; V266-T271 PolarHBondContact O-N 2.94Å; V266-T271 PolarHBondContact O-OG1 3.39Å; V266-Y297 HydrophobicContact CG1-CD2 3.94Å; V266-Y297 HydrophobicContact CG1-CE2 4.04Å; V266-Y297 WeakPolarHBondContact O-CE2 3.42Å; V266-A300 HydrophobicContact CG1-CB 4.1Å
267	I	77.9	Confident	83.6	Confident	67 Å²	67	50.6 Å²	50.6	34%	0.344	23%	0.231	S	C	.	.	I	π-helix	trans	-75.2	-43.3	-174.1	-60.7	172.6	0	0	0	111.9	M264 T271 L304	M264-I267 PolarHBondContact O-N 3Å; M264-I267 VanDerWaalsContact O-N 3.15Å; I267-T271 VanDerWaalsContact O-CB 3.27Å; I267-T271 WeakPolarHBondContact O-CB 3.5Å; I267-T271 PolarHBondContact O-OG1 3.3Å; I267-L304 HydrophobicContact CD1-CD1 4Å; I267-L304 HydrophobicContact CD1-CD2 4.17Å; I267-L304 HydrophobicContact CG1-CD1 4.04Å
268	E	81.7	Confident	83.6	Confident	130 Å²	130	50.5 Å²	50.5	61%	0.607	23%	0.231	S	C	*	.	I	π-helix	trans	-92.9	-41.9	-172.9	-62.2	-172.9	160.8	0	0	113.2	M264 P272	M264-E268 WeakPolarHBondContact O-CB 3.4Å; M264-E268 PolarHBondContact O-N 3Å; E268-P272 VanDerWaalsContact O-CD 3.28Å; E268-P272 WeakPolarHBondContact O-CD 3.42Å
269	V	83.4	Confident	83.6	Confident	19 Å²	19	46.8 Å²	46.8	12%	0.115	22%	0.219	C	C	.	.	I	π-helix	trans	-93.3	-46	-173.4	-178	0	0	0	0	112.2	I233 A237 V265 P272 V273	I233-V269 HydrophobicContact CG2-CG1 3.98Å; A237-V269 HydrophobicContact CB-CB 4.43Å; A237-V269 HydrophobicContact CB-CG1 3.54Å; A237-V269 HydrophobicContact CB-CG2 4.02Å; V265-V269 HydrophobicContact CG1-CB 4.25Å; V265-V269 HydrophobicContact CG1-CG2 4.46Å; V265-V269 WeakPolarHBondContact O-CA 3.17Å; V265-V269 WeakPolarHBondContact O-CB 3.41Å; V265-V269 PolarHBondContact O-N 3.37Å; V269-P272 WeakPolarHBondContact O-CD 3.46Å; V269-P272 WeakPolarHBondContact O-CG 3.37Å; V269-V273 WeakPolarHBondContact O-CG2 3.24Å
270	F	87.5	Confident	83.5	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.216	C	C	.	.	I	π-helix	trans	-75.7	-29.7	-176.1	-66.4	-18.6	0	0	0	113.5	I233 F253 H256 V265 V266 V273 V274 F293 Y297	I233-F270 HydrophobicContact CD1-CZ 4Å; I233-F270 HydrophobicContact CG2-CD1 4.47Å; I233-F270 HydrophobicContact CG2-CE1 3.65Å; I233-F270 HydrophobicContact CG2-CZ 4.17Å; F253-F270 HydrophobicContact CB-CE1 4.17Å; F253-F270 HydrophobicContact CB-CE2 4.21Å; F253-F270 HydrophobicContact CB-CZ 3.7Å; F253-F270 AromaticContact CD1-CE1 3.66Å; F253-F270 HydrophobicContact CD1-CE1 3.66Å; F253-F270 AromaticContact CD1-CZ 3.6Å; F253-F270 HydrophobicContact CD1-CZ 3.6Å; F253-F270 AromaticContact CD2-CE1 3.89Å; F253-F270 HydrophobicContact CD2-CE1 3.89Å; F253-F270 HydrophobicContact CD2-CZ 4.29Å; F253-F270 AromaticContact CE1-CE1 3.95Å; F253-F270 HydrophobicContact CE1-CE1 3.95Å; F253-F270 HydrophobicContact CE1-CZ 4.29Å; F253-F270 HydrophobicContact CE2-CE1 4.14Å; F253-F270 AromaticContact CG-CE1 3.65Å; F253-F270 HydrophobicContact CG-CE1 3.65Å; F253-F270 AromaticContact CG-CZ 3.61Å; F253-F270 HydrophobicContact CG-CZ 3.61Å; F253-F270 HydrophobicContact CZ-CE1 4.17Å; H256-F270 AromaticContact CD2-CE2 3.96Å; V265-F270 HydrophobicContact CG1-CE1 4.36Å; V265-F270 HydrophobicContact CG1-CZ 4.29Å; V265-F270 PolarHBondContact O-N 2.84Å; V265-F270 VanDerWaalsContact O-N 3.08Å; V266-F270 HydrophobicContact CB-CD2 4.43Å; V266-F270 HydrophobicContact CG2-CD2 4.22Å; V266-F270 HydrophobicContact CG2-CE2 4.47Å; F270-V273 PolarHBondContact O-N 3.16Å; F270-V274 WeakPolarHBondContact O-CG2 3.32Å; F270-V274 PolarHBondContact O-N 2.76Å; F270-F293 HydrophobicContact CB-CE2 4.5Å; F270-F293 HydrophobicContact CB-CZ 4.02Å; F270-F293 HydrophobicContact CD1-CE2 4.28Å; F270-F293 AromaticContact CD1-CZ 3.93Å; F270-F293 HydrophobicContact CD1-CZ 3.93Å; F270-F293 AromaticContact CD2-CE2 3.91Å; F270-F293 HydrophobicContact CD2-CE2 3.91Å; F270-F293 HydrophobicContact CD2-CZ 4.2Å; F270-F293 HydrophobicContact CE1-CE2 4.46Å; F270-F293 HydrophobicContact CE1-CZ 4.41Å; F270-F293 HydrophobicContact CE2-CE2 4.11Å; F270-F293 HydrophobicContact CG-CE2 4.01Å; F270-F293 AromaticContact CG-CZ 3.81Å; F270-F293 HydrophobicContact CG-CZ 3.81Å; F270-F293 HydrophobicContact CZ-CE2 4.38Å; F270-Y297 HydrophobicContact CB-CD2 3.69Å; F270-Y297 HydrophobicContact CB-CE2 3.84Å
271	T	87.9	Confident	83.2	Confident	24 Å²	24	48.1 Å²	48.1	15%	0.147	23%	0.232	C	C	.	.	H	α-helix	trans	-51.8	-60.2	177.2	-57.2	0	0	0	0	113.5	V266 I267 V273 V274 Q275 Y297 F314	V266-T271 PolarHBondContact O-N 2.94Å; V266-T271 PolarHBondContact O-OG1 3.39Å; I267-T271 VanDerWaalsContact O-CB 3.27Å; I267-T271 WeakPolarHBondContact O-CB 3.5Å; I267-T271 PolarHBondContact O-OG1 3.3Å; T271-V273 PolarHBondContact O-N 3.48Å; T271-V274 PolarHBondContact O-N 3.04Å; T271-Q275 HydrophobicContact CG2-CG 4.34Å; T271-Q275 WeakPolarHBondContact O-CB 3.39Å; T271-Q275 VanDerWaalsContact O-CG 3.28Å; T271-Q275 WeakPolarHBondContact O-CG 3.34Å; T271-Q275 PolarHBondContact O-N 3.29Å; T271-Y297 VanDerWaalsContact CA-OH 3.31Å; T271-Y297 WeakPolarHBondContact CA-OH 3.27Å; T271-Y297 WeakPolarHBondContact CB-OH 3.15Å; T271-Y297 PolarHBondContact OG1-OH 3.47Å; T271-F314 HydrophobicContact CG2-CD2 4.26Å; T271-F314 HydrophobicContact CG2-CE2 4.21Å
272	P	86.1	Confident	83	Confident	49 Å²	49	48.4 Å²	48.4	32%	0.318	23%	0.232	S	C	.	.	H	α-helix	trans	-61.9	-30.4	-180	24.5	-34.9	0	0	0	113.3	E268 V269 R276	E268-P272 VanDerWaalsContact O-CD 3.28Å; E268-P272 WeakPolarHBondContact O-CD 3.42Å; V269-P272 WeakPolarHBondContact O-CD 3.46Å; V269-P272 WeakPolarHBondContact O-CG 3.37Å; P272-R276 WeakPolarHBondContact O-CB 3.48Å; P272-R276 PolarHBondContact O-N 2.86Å
273	V	86.6	Confident	82.6	Confident	5 Å²	5	43.8 Å²	43.8	3%	0.03	22%	0.22	C	C	.	.	H	α-helix	trans	-67.9	-47.5	176.7	-178.8	0	0	0	0	111	L240 P245 V269 F270 T271 R276 I277 F293	L240-V273 HydrophobicContact CB-CG2 3.66Å; L240-V273 HydrophobicContact CD1-CG2 4.47Å; P245-V273 HydrophobicContact CG-CG1 4.22Å; V269-V273 WeakPolarHBondContact O-CG2 3.24Å; F270-V273 PolarHBondContact O-N 3.16Å; T271-V273 PolarHBondContact O-N 3.48Å; V273-R276 WeakPolarHBondContact O-CB 3.15Å; V273-R276 PolarHBondContact O-N 3.45Å; V273-I277 HydrophobicContact CG1-CD1 4.08Å; V273-I277 WeakPolarHBondContact O-CG1 3.4Å; V273-I277 PolarHBondContact O-N 3.02Å; V273-F293 HydrophobicContact CG1-CE1 4.15Å
274	V	87.7	Confident	82.4	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.1	-37.9	178.3	177.4	0	0	0	0	111.4	F270 T271 R276 I277 L278 F293 T294 Y297 F314	F270-V274 WeakPolarHBondContact O-CG2 3.32Å; F270-V274 PolarHBondContact O-N 2.76Å; T271-V274 PolarHBondContact O-N 3.04Å; V274-R276 VanDerWaalsContact C-N 3.27Å; V274-R276 PolarHBondContact O-N 3.37Å; V274-I277 PolarHBondContact O-N 3.34Å; V274-L278 HydrophobicContact CG1-CD1 4.06Å; V274-L278 HydrophobicContact CG1-CG 4.3Å; V274-L278 WeakPolarHBondContact O-CG 3.46Å; V274-L278 PolarHBondContact O-N 2.94Å; V274-F293 HydrophobicContact CG2-CD1 4.33Å; V274-F293 HydrophobicContact CG2-CE1 3.61Å; V274-F293 HydrophobicContact CG2-CZ 3.85Å; V274-T294 HydrophobicContact CG1-CG2 3.81Å; V274-Y297 HydrophobicContact CB-CD1 3.96Å; V274-Y297 HydrophobicContact CB-CE1 4.01Å; V274-Y297 HydrophobicContact CB-CG 4.42Å; V274-Y297 HydrophobicContact CG1-CD1 3.77Å; V274-Y297 HydrophobicContact CG1-CE1 3.97Å; V274-Y297 HydrophobicContact CG2-CD1 3.78Å; V274-Y297 HydrophobicContact CG2-CD2 4.22Å; V274-Y297 HydrophobicContact CG2-CE1 4.24Å; V274-Y297 HydrophobicContact CG2-CG 3.76Å; V274-F314 HydrophobicContact CG1-CZ 4.05Å
275	Q	87.8	Confident	81.9	Confident	38 Å²	38	40.7 Å²	40.7	18%	0.178	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-40.9	170.3	-69.4	-168.8	-18.1	0	0	111.7	T271 K279 F314 S317 M318	T271-Q275 HydrophobicContact CG2-CG 4.34Å; T271-Q275 WeakPolarHBondContact O-CB 3.39Å; T271-Q275 VanDerWaalsContact O-CG 3.28Å; T271-Q275 WeakPolarHBondContact O-CG 3.34Å; T271-Q275 PolarHBondContact O-N 3.29Å; Q275-K279 WeakPolarHBondContact O-CB 3.28Å; Q275-K279 WeakPolarHBondContact O-CD 3.28Å; Q275-K279 VanDerWaalsContact O-CG 3.25Å; Q275-K279 WeakPolarHBondContact O-CG 3.34Å; Q275-K279 PolarHBondContact O-N 2.8Å; Q275-F314 HydrophobicContact CG-CE2 3.78Å; Q275-F314 HydrophobicContact CG-CZ 4.31Å; Q275-S317 PolarHBondContact NE2-OG 2.74Å; Q275-S317 VanDerWaalsContact NE2-OG 3.15Å; Q275-M318 HydrophobicContact CB-CE 4.25Å; Q275-M318 HydrophobicContact CB-SD 3.67Å; Q275-M318 HydrophobicContact CG-SD 3.43Å; Q275-M318 WeakPolarHBondContact CG-SD 3.5Å; Q275-M318 WeakPolarHBondContact O-CE 3.27Å
276	R	84.9	Confident	81.7	Confident	63 Å²	63	48 Å²	48	24%	0.238	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-47.2	174.5	177.1	169.4	-75.2	104.3	-8	112.4	E241 P272 V273 V274 L278 K279 H280	E241-R276 VanDerWaalsContact C-NH1 3.31Å; E241-R276 PolarHBondContact O-NH1 3.16Å; E241-R276 PolarHBondContact O-NH2 2.89Å; P272-R276 WeakPolarHBondContact O-CB 3.48Å; P272-R276 PolarHBondContact O-N 2.86Å; V273-R276 WeakPolarHBondContact O-CB 3.15Å; V273-R276 PolarHBondContact O-N 3.45Å; V274-R276 VanDerWaalsContact C-N 3.27Å; V274-R276 PolarHBondContact O-N 3.37Å; R276-L278 VanDerWaalsContact C-N 3.25Å; R276-L278 PolarHBondContact O-N 3.28Å; R276-K279 PolarHBondContact O-N 3.35Å; R276-K279 VanDerWaalsContact O-N 3.14Å; R276-H280 PolarHBondContact O-CD2 3.24Å; R276-H280 PolarHBondContact O-N 3.08Å
277	I	85.4	Confident	81.6	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-55.9	-42.5	177.4	-68.3	162.5	0	0	0	110.7	P245 V273 V274 M282 F284 L290 F293	P245-I277 HydrophobicContact CG-CD1 4.47Å; V273-I277 HydrophobicContact CG1-CD1 4.08Å; V273-I277 WeakPolarHBondContact O-CG1 3.4Å; V273-I277 PolarHBondContact O-N 3.02Å; V274-I277 PolarHBondContact O-N 3.34Å; I277-M282 HydrophobicContact CG2-CG 4.33Å; I277-M282 WeakPolarHBondContact O-CG 3.45Å; I277-F284 HydrophobicContact CG2-CE1 3.88Å; I277-F284 HydrophobicContact CG2-CZ 3.89Å; I277-L290 HydrophobicContact CD1-CD2 3.78Å; I277-L290 HydrophobicContact CG1-CD2 4Å; I277-F293 HydrophobicContact CD1-CD1 3.99Å; I277-F293 HydrophobicContact CD1-CE1 4.05Å
278	L	85.8	Confident	81.8	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74	-31.3	178.6	-67.2	175.3	0	0	0	113.4	V274 R276 T294 F314 M318 R329 V330 N333 L334	V274-L278 HydrophobicContact CG1-CD1 4.06Å; V274-L278 HydrophobicContact CG1-CG 4.3Å; V274-L278 WeakPolarHBondContact O-CG 3.46Å; V274-L278 PolarHBondContact O-N 2.94Å; R276-L278 VanDerWaalsContact C-N 3.25Å; R276-L278 PolarHBondContact O-N 3.28Å; L278-T294 HydrophobicContact CD2-CG2 4.14Å; L278-F314 HydrophobicContact CD1-CE1 3.95Å; L278-F314 HydrophobicContact CD1-CZ 3.94Å; L278-M318 HydrophobicContact CB-CE 3.71Å; L278-M318 HydrophobicContact CD1-CE 4.33Å; L278-R329 CarbonylContact O-C 3.54Å; L278-V330 WeakPolarHBondContact O-CA 3.36Å; L278-V330 PolarHBondContact O-N 3.3Å; L278-N333 HydrophobicContact CD2-CB 3.82Å; L278-N333 PolarHBondContact O-ND2 3.5Å; L278-L334 HydrophobicContact CD1-CD2 3.6Å; L278-L334 HydrophobicContact CD1-CG 4.11Å; L278-L334 HydrophobicContact CD2-CD2 3.88Å; L278-L334 HydrophobicContact CD2-CG 4.06Å; L278-L334 HydrophobicContact CG-CD2 4.4Å
279	K	84.5	Confident	81.9	Confident	60 Å²	60	48.6 Å²	48.6	26%	0.261	26%	0.258	S	S	.	.	H	α-helix	trans	-73	-48.9	175.9	-75.9	165.5	-176.8	172.7	0	111.3	Q275 R276 M318 H327 R329 V330	Q275-K279 WeakPolarHBondContact O-CB 3.28Å; Q275-K279 WeakPolarHBondContact O-CD 3.28Å; Q275-K279 VanDerWaalsContact O-CG 3.25Å; Q275-K279 WeakPolarHBondContact O-CG 3.34Å; Q275-K279 PolarHBondContact O-N 2.8Å; R276-K279 PolarHBondContact O-N 3.35Å; R276-K279 VanDerWaalsContact O-N 3.14Å; K279-M318 HydrophobicContact CD-CE 4.2Å; K279-M318 HydrophobicContact CG-CE 3.77Å; K279-H327 HydrophobicContact CG-CB 4.09Å; K279-H327 PolarHBondContact O-CE1 3.41Å; K279-H327 PolarHBondContact O-ND1 3.32Å; K279-R329 WeakPolarHBondContact O-CB 3.29Å; K279-V330 HydrophobicContact CG-CG2 3.96Å
280	H	82.1	Confident	81.9	Confident	91 Å²	91	48.2 Å²	48.2	42%	0.421	26%	0.255	S	S	.	.	S	Bend	trans	-72.6	165.5	-172	-76.1	-106.7	0	0	0	114.3	R276 M282 N333	R276-H280 PolarHBondContact O-CD2 3.24Å; R276-H280 PolarHBondContact O-N 3.08Å; H280-M282 PolarHBondContact O-N 3.08Å; H280-N333 PolarHBondContact O-ND2 2.68Å; H280-N333 VanDerWaalsContact O-ND2 3.11Å
281	N	74.3	Confident	82	Confident	125 Å²	125	51.8 Å²	51.8	67%	0.668	27%	0.269	S	S	*	.			trans	-72.5	90.5	176.2	-177.2	38.3	0	0	0	110.3	R329	N281-R329 PolarHBondContact OD1-NH1 3.32Å
282	M	75.7	Confident	82	Confident	25 Å²	25	53.6 Å²	53.6	12%	0.123	28%	0.277	C	S	.	.			trans	-106.5	127.3	-176	-65.8	-58.3	-73.5	0	0	111.9	H244 I277 H280 F284 L290	H244-M282 PolarHBondContact CE1-SD 3.46Å; I277-M282 HydrophobicContact CG2-CG 4.33Å; I277-M282 WeakPolarHBondContact O-CG 3.45Å; H280-M282 PolarHBondContact O-N 3.08Å; M282-F284 HydrophobicContact CB-CZ 4.49Å; M282-F284 PolarHBondContact O-N 3.28Å; M282-L290 HydrophobicContact CE-CD1 4.32Å; M282-L290 HydrophobicContact CE-CD2 4Å
283	D	73.7	Confident	82.1	Confident	73 Å²	73	51.3 Å²	51.3	39%	0.39	26%	0.262	S	S	.	.			trans	-93.8	90.1	170.7	-174.2	-22.4	0	0	0	109.2	G285 K286 C287	D283-G285 PolarHBondContact O-N 2.96Å; D283-G285 WeakPolarHBondContact OD1-CA 3.49Å; D283-G285 PolarHBondContact OD1-N 2.9Å; D283-K286 HydrophobicContact CB-CB 4.28Å; D283-K286 HydrophobicContact CB-CD 4.35Å; D283-K286 HydrophobicContact CB-CG 4.39Å; D283-K286 PolarHBondContact O-N 3.32Å; D283-K286 VanDerWaalsContact O-N 3.14Å; D283-K286 PolarHBondContact OD1-N 3.22Å; D283-K286 VanDerWaalsContact OD2-CD 3.31Å; D283-K286 WeakPolarHBondContact OD2-CD 3.44Å; D283-K286 VanDerWaalsContact OD2-CE 3.31Å; D283-K286 WeakPolarHBondContact OD2-CE 3.42Å; D283-K286 WeakPolarHBondContact OD2-CG 3.3Å; D283-K286 IonicContact OD2-NZ 3.46Å; D283-K286 PolarHBondContact OD2-NZ 3.49Å; D283-C287 PolarHBondContact O-N 2.86Å
284	F	78	Confident	82.3	Confident	12 Å²	12	51 Å²	51	5%	0.053	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-11.5	177	-70	-55.2	0	0	0	114.1	I277 M282 L290 R291 N333 A336 V337	I277-F284 HydrophobicContact CG2-CE1 3.88Å; I277-F284 HydrophobicContact CG2-CZ 3.89Å; M282-F284 HydrophobicContact CB-CZ 4.49Å; M282-F284 PolarHBondContact O-N 3.28Å; F284-L290 HydrophobicContact CE1-CB 4.48Å; F284-R291 HydrophobicContact CB-CB 4.13Å; F284-R291 HydrophobicContact CB-CG 4.37Å; F284-R291 HydrophobicContact CD1-CB 3.54Å; F284-R291 HydrophobicContact CD1-CG 4.17Å; F284-R291 HydrophobicContact CE1-CB 4.1Å; F284-R291 HydrophobicContact CG-CB 3.97Å; F284-R291 HydrophobicContact CG-CG 4.19Å; F284-N333 HydrophobicContact CE2-CB 3.87Å; F284-A336 HydrophobicContact CD2-CB 4.18Å; F284-V337 HydrophobicContact CE2-CG2 3.97Å; F284-V337 HydrophobicContact CZ-CG2 4.02Å
285	G	69.9	Low	82.4	Confident	63 Å²	63	51.8 Å²	51.8	65%	0.649	26%	0.264	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-42.8	169.7	0	0	0	0	0	111.4	D283	D283-G285 PolarHBondContact O-N 2.96Å; D283-G285 WeakPolarHBondContact OD1-CA 3.49Å; D283-G285 PolarHBondContact OD1-N 2.9Å
286	K	74.8	Confident	82.6	Confident	165 Å²	165	51.4 Å²	51.4	72%	0.717	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.3	-26	173.6	-66.9	-179.5	-175.1	115.7	0	113.5	D283 P288	D283-K286 HydrophobicContact CB-CB 4.28Å; D283-K286 HydrophobicContact CB-CD 4.35Å; D283-K286 HydrophobicContact CB-CG 4.39Å; D283-K286 PolarHBondContact O-N 3.32Å; D283-K286 VanDerWaalsContact O-N 3.14Å; D283-K286 PolarHBondContact OD1-N 3.22Å; D283-K286 VanDerWaalsContact OD2-CD 3.31Å; D283-K286 WeakPolarHBondContact OD2-CD 3.44Å; D283-K286 VanDerWaalsContact OD2-CE 3.31Å; D283-K286 WeakPolarHBondContact OD2-CE 3.42Å; D283-K286 WeakPolarHBondContact OD2-CG 3.3Å; D283-K286 IonicContact OD2-NZ 3.46Å; D283-K286 PolarHBondContact OD2-NZ 3.49Å; K286-P288 VanDerWaalsContact C-CD 3.45Å; K286-P288 WeakPolarHBondContact O-CD 3.46Å
287	C	77.9	Confident	82.9	Confident	48 Å²	48	48.4 Å²	48.4	32%	0.324	25%	0.251	S	S	.	.			trans	-124.3	63.4	-173.3	-65.8	0	0	0	0	113.3	D283 R289 L290 R291	D283-C287 PolarHBondContact O-N 2.86Å; C287-R289 VanDerWaalsContact C-N 3.3Å; C287-R289 PolarHBondContact O-N 3.19Å; C287-L290 HydrophobicContact CB-CB 4.41Å; C287-L290 HydrophobicContact CB-CD1 3.67Å; C287-L290 PolarHBondContact O-N 3.47Å; C287-R291 PolarHBondContact O-N 2.95Å
288	P	82.1	Confident	83.1	Confident	66 Å²	66	48.6 Å²	48.6	43%	0.429	25%	0.252	S	S	.	.	H	α-helix	trans	-63.8	-29.8	-173.8	25.3	-35.1	0	0	0	113.8	K286 R291 L292	K286-P288 VanDerWaalsContact C-CD 3.45Å; K286-P288 WeakPolarHBondContact O-CD 3.46Å; P288-R291 WeakPolarHBondContact O-CB 3.47Å; P288-R291 PolarHBondContact O-N 3.47Å; P288-L292 PolarHBondContact O-N 3.1Å
289	R	83.8	Confident	83.3	Confident	94 Å²	94	49.7 Å²	49.7	36%	0.355	26%	0.258	S	S	.	.	H	α-helix	trans	-70	-30.7	178.6	-62.6	-167.7	-170.7	162.1	-0.7	113.4	P247 D248 C250 E251 C287 L292 F293	P247-R289 WeakPolarHBondContact O-CD 3.13Å; P247-R289 PolarHBondContact O-NH1 2.69Å; D248-R289 IonicContact OD1-CZ 3.98Å; D248-R289 IonicContact OD1-NH1 3.9Å; D248-R289 PolarHBondContact OD1-NH1 2.94Å; D248-R289 IonicContact OD1-NH2 3.15Å; C250-R289 HydrophobicContact CB-CB 4.13Å; E251-R289 IonicContact OE2-CZ 3.09Å; E251-R289 IonicContact OE2-NE 3.57Å; E251-R289 IonicContact OE2-NH1 2.72Å; C287-R289 VanDerWaalsContact C-N 3.3Å; C287-R289 PolarHBondContact O-N 3.19Å; R289-L292 PolarHBondContact O-N 2.9Å; R289-F293 PolarHBondContact O-N 3.11Å
290	L	84.2	Confident	83.5	Confident	11 Å²	11	47 Å²	47	6%	0.058	25%	0.246	C	C	.	.	H	α-helix	trans	-69.8	-35.7	171.9	-79.6	122.2	0	0	0	111.7	P245 I277 M282 F284 C287 T294	P245-L290 HydrophobicContact CG-CD2 3.94Å; I277-L290 HydrophobicContact CD1-CD2 3.78Å; I277-L290 HydrophobicContact CG1-CD2 4Å; M282-L290 HydrophobicContact CE-CD1 4.32Å; M282-L290 HydrophobicContact CE-CD2 4Å; F284-L290 HydrophobicContact CE1-CB 4.48Å; C287-L290 HydrophobicContact CB-CB 4.41Å; C287-L290 HydrophobicContact CB-CD1 3.67Å; C287-L290 PolarHBondContact O-N 3.47Å; L290-T294 PolarHBondContact O-N 3.45Å; L290-T294 VanDerWaalsContact O-N 3.08Å; L290-T294 PolarHBondContact O-OG1 3.16Å
291	R	88.2	Confident	83.7	Confident	75 Å²	75	42.9 Å²	42.9	28%	0.283	23%	0.228	S	C	.	.	H	α-helix	trans	-62.6	-48.1	171.7	-169.5	177.9	60.5	-158	-2.5	110.8	F284 C287 P288 T294 Q295 V337	F284-R291 HydrophobicContact CB-CB 4.13Å; F284-R291 HydrophobicContact CB-CG 4.37Å; F284-R291 HydrophobicContact CD1-CB 3.54Å; F284-R291 HydrophobicContact CD1-CG 4.17Å; F284-R291 HydrophobicContact CE1-CB 4.1Å; F284-R291 HydrophobicContact CG-CB 3.97Å; F284-R291 HydrophobicContact CG-CG 4.19Å; C287-R291 PolarHBondContact O-N 2.95Å; P288-R291 WeakPolarHBondContact O-CB 3.47Å; P288-R291 PolarHBondContact O-N 3.47Å; R291-T294 WeakPolarHBondContact O-CB 3.37Å; R291-T294 PolarHBondContact O-N 3.45Å; R291-Q295 WeakPolarHBondContact O-CG 3.22Å; R291-Q295 PolarHBondContact O-N 3.42Å; R291-V337 HydrophobicContact CG-CG2 4.05Å
292	L	87.6	Confident	84.3	Confident	63 Å²	63	39 Å²	39	33%	0.33	21%	0.207	S	C	.	.	H	α-helix	trans	-60.4	-46.2	178.2	-174.2	65.4	0	0	0	111.5	P288 R289 T294 Q295 E296	P288-L292 PolarHBondContact O-N 3.1Å; R289-L292 PolarHBondContact O-N 2.9Å; L292-T294 VanDerWaalsContact C-N 3.27Å; L292-T294 PolarHBondContact O-N 3.02Å; L292-Q295 WeakPolarHBondContact O-CA 3.43Å; L292-Q295 WeakPolarHBondContact O-CB 3.46Å; L292-Q295 PolarHBondContact O-N 3.43Å; L292-E296 HydrophobicContact CD1-CG 4.36Å; L292-E296 HydrophobicContact CG-CG 4.32Å; L292-E296 WeakPolarHBondContact O-CG 3.34Å; L292-E296 PolarHBondContact O-N 3.29Å
293	F	89.7	Confident	84.8	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-56.5	-41.7	174.8	169.1	-122.5	0	0	0	112.4	C250 F253 C254 F270 V273 V274 I277 R289 Q295 E296 Y297	C250-F293 HydrophobicContact CB-CB 4.15Å; F253-F293 HydrophobicContact CB-CD2 3.48Å; F253-F293 VanDerWaalsContact CB-CD2 3.48Å; F253-F293 HydrophobicContact CB-CE2 3.45Å; F253-F293 VanDerWaalsContact CB-CE2 3.45Å; F253-F293 HydrophobicContact CB-CG 4.34Å; F253-F293 HydrophobicContact CB-CZ 4.27Å; F253-F293 HydrophobicContact CD2-CD2 4.27Å; F253-F293 HydrophobicContact CD2-CE1 4.2Å; F253-F293 AromaticContact CD2-CE2 3.93Å; F253-F293 HydrophobicContact CD2-CE2 3.93Å; F253-F293 AromaticContact CD2-CZ 3.88Å; F253-F293 HydrophobicContact CD2-CZ 3.88Å; F253-F293 HydrophobicContact CG-CD2 4.4Å; F253-F293 HydrophobicContact CG-CE2 4.11Å; F253-F293 HydrophobicContact CG-CZ 4.47Å; C254-F293 WeakPolarHBondContact SG-CA 3.26Å; C254-F293 PolarHBondContact SG-N 3.33Å; F270-F293 HydrophobicContact CB-CE2 4.5Å; F270-F293 HydrophobicContact CB-CZ 4.02Å; F270-F293 HydrophobicContact CD1-CE2 4.28Å; F270-F293 AromaticContact CD1-CZ 3.93Å; F270-F293 HydrophobicContact CD1-CZ 3.93Å; F270-F293 AromaticContact CD2-CE2 3.91Å; F270-F293 HydrophobicContact CD2-CE2 3.91Å; F270-F293 HydrophobicContact CD2-CZ 4.2Å; F270-F293 HydrophobicContact CE1-CE2 4.46Å; F270-F293 HydrophobicContact CE1-CZ 4.41Å; F270-F293 HydrophobicContact CE2-CE2 4.11Å; F270-F293 HydrophobicContact CG-CE2 4.01Å; F270-F293 AromaticContact CG-CZ 3.81Å; F270-F293 HydrophobicContact CG-CZ 3.81Å; F270-F293 HydrophobicContact CZ-CE2 4.38Å; V273-F293 HydrophobicContact CG1-CE1 4.15Å; V274-F293 HydrophobicContact CG2-CD1 4.33Å; V274-F293 HydrophobicContact CG2-CE1 3.61Å; V274-F293 HydrophobicContact CG2-CZ 3.85Å; I277-F293 HydrophobicContact CD1-CD1 3.99Å; I277-F293 HydrophobicContact CD1-CE1 4.05Å; R289-F293 PolarHBondContact O-N 3.11Å; F293-Q295 VanDerWaalsContact C-N 3.34Å; F293-Q295 PolarHBondContact O-N 3.36Å; F293-E296 PolarHBondContact O-N 2.93Å; F293-Y297 VanDerWaalsContact O-CB 3.3Å; F293-Y297 WeakPolarHBondContact O-CB 3.43Å; F293-Y297 PolarHBondContact O-N 3.26Å
294	T	90	Very high	85.4	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-63.6	-38.4	175.7	-53.3	0	0	0	0	112	V274 L278 L290 R291 L292 I298 V337	V274-T294 HydrophobicContact CG1-CG2 3.81Å; L278-T294 HydrophobicContact CD2-CG2 4.14Å; L290-T294 PolarHBondContact O-N 3.45Å; L290-T294 VanDerWaalsContact O-N 3.08Å; L290-T294 PolarHBondContact O-OG1 3.16Å; R291-T294 WeakPolarHBondContact O-CB 3.37Å; R291-T294 PolarHBondContact O-N 3.45Å; L292-T294 VanDerWaalsContact C-N 3.27Å; L292-T294 PolarHBondContact O-N 3.02Å; T294-I298 HydrophobicContact CG2-CD1 4.17Å; T294-I298 VanDerWaalsContact O-CG1 3.3Å; T294-I298 WeakPolarHBondContact O-CG1 3.14Å; T294-I298 PolarHBondContact O-N 3.12Å; T294-I298 VanDerWaalsContact O-N 3.14Å; T294-V337 HydrophobicContact CG2-CG1 4.11Å; T294-V337 HydrophobicContact CG2-CG2 3.81Å
295	Q	90.8	Very high	85.4	Confident	16 Å²	16	45.9 Å²	45.9	8%	0.075	24%	0.242	C	C	.	.	H	α-helix	trans	-65.7	-50.2	175.8	-68.1	169.1	-26.9	0	0	111.8	R291 L292 F293 Y297 I298 L299 V337 A341 F494	R291-Q295 WeakPolarHBondContact O-CG 3.22Å; R291-Q295 PolarHBondContact O-N 3.42Å; L292-Q295 WeakPolarHBondContact O-CA 3.43Å; L292-Q295 WeakPolarHBondContact O-CB 3.46Å; L292-Q295 PolarHBondContact O-N 3.43Å; F293-Q295 VanDerWaalsContact C-N 3.34Å; F293-Q295 PolarHBondContact O-N 3.36Å; Q295-Y297 VanDerWaalsContact C-N 3.32Å; Q295-Y297 PolarHBondContact O-N 3.04Å; Q295-I298 PolarHBondContact O-N 3.33Å; Q295-L299 WeakPolarHBondContact O-CG 3.49Å; Q295-L299 PolarHBondContact O-N 2.93Å; Q295-V337 HydrophobicContact CG-CG1 3.74Å; Q295-V337 PolarHBondContact NE2-O 3.22Å; Q295-A341 HydrophobicContact CG-CB 4.3Å; Q295-F494 HydrophobicContact CB-CZ 4Å; Q295-F494 HydrophobicContact CG-CZ 4.14Å
296	E	90.1	Very high	85.7	Confident	29 Å²	29	44.9 Å²	44.9	14%	0.136	23%	0.232	C	C	.	.	H	α-helix	trans	-64.7	-35.5	-179.6	-61	-64.9	161.7	0	0	112.1	C254 C257 R258 L292 F293 L299 A300	C254-E296 HydrophobicContact CB-CB 4.49Å; C254-E296 HydrophobicContact CB-CG 4.01Å; C257-E296 HydrophobicContact CB-CB 4.01Å; R258-E296 WeakPolarHBondContact CG-OE2 3.44Å; R258-E296 IonicContact CZ-OE1 3.76Å; R258-E296 VanDerWaalsContact CZ-OE1 3.31Å; R258-E296 IonicContact CZ-OE2 2.71Å; R258-E296 IonicContact NE-OE1 3.97Å; R258-E296 PolarHBondContact NE-OE1 3.19Å; R258-E296 VanDerWaalsContact NE-OE1 3.14Å; R258-E296 IonicContact NE-OE2 3.97Å; R258-E296 PolarHBondContact NE-OE2 3.09Å; R258-E296 VanDerWaalsContact NH2-CD 3.26Å; R258-E296 IonicContact NH2-OE1 3.98Å; R258-E296 PolarHBondContact NH2-OE1 2.83Å; R258-E296 IonicContact NH2-OE2 3.86Å; L292-E296 HydrophobicContact CD1-CG 4.36Å; L292-E296 HydrophobicContact CG-CG 4.32Å; L292-E296 WeakPolarHBondContact O-CG 3.34Å; L292-E296 PolarHBondContact O-N 3.29Å; F293-E296 PolarHBondContact O-N 2.93Å; E296-L299 PolarHBondContact O-N 3.06Å; E296-A300 WeakPolarHBondContact O-CB 3.45Å; E296-A300 PolarHBondContact O-N 2.73Å
297	Y	91.6	Very high	86.2	Confident	1 Å²	1	37.8 Å²	37.8	0%	0.004	21%	0.206	C	C	.	.	H	α-helix	trans	-62.8	-45.9	171.7	168.4	-96.6	0	0	0	112.3	V266 F270 T271 V274 F293 Q295 L299 A300 L301 F314	V266-Y297 HydrophobicContact CG1-CD2 3.94Å; V266-Y297 HydrophobicContact CG1-CE2 4.04Å; V266-Y297 WeakPolarHBondContact O-CE2 3.42Å; F270-Y297 HydrophobicContact CB-CD2 3.69Å; F270-Y297 HydrophobicContact CB-CE2 3.84Å; T271-Y297 VanDerWaalsContact CA-OH 3.31Å; T271-Y297 WeakPolarHBondContact CA-OH 3.27Å; T271-Y297 WeakPolarHBondContact CB-OH 3.15Å; T271-Y297 PolarHBondContact OG1-OH 3.47Å; V274-Y297 HydrophobicContact CB-CD1 3.96Å; V274-Y297 HydrophobicContact CB-CE1 4.01Å; V274-Y297 HydrophobicContact CB-CG 4.42Å; V274-Y297 HydrophobicContact CG1-CD1 3.77Å; V274-Y297 HydrophobicContact CG1-CE1 3.97Å; V274-Y297 HydrophobicContact CG2-CD1 3.78Å; V274-Y297 HydrophobicContact CG2-CD2 4.22Å; V274-Y297 HydrophobicContact CG2-CE1 4.24Å; V274-Y297 HydrophobicContact CG2-CG 3.76Å; F293-Y297 VanDerWaalsContact O-CB 3.3Å; F293-Y297 WeakPolarHBondContact O-CB 3.43Å; F293-Y297 PolarHBondContact O-N 3.26Å; Q295-Y297 VanDerWaalsContact C-N 3.32Å; Q295-Y297 PolarHBondContact O-N 3.04Å; Y297-L299 VanDerWaalsContact C-N 3.32Å; Y297-L299 PolarHBondContact O-N 3.09Å; Y297-A300 PolarHBondContact O-N 2.72Å; Y297-L301 HydrophobicContact CD1-CD1 4.3Å; Y297-L301 HydrophobicContact CD1-CG 4.5Å; Y297-L301 HydrophobicContact CE1-CD1 3.53Å; Y297-L301 HydrophobicContact CE1-CG 4.02Å; Y297-L301 HydrophobicContact CE2-CD1 4.5Å; Y297-L301 HydrophobicContact CE2-CD2 4.22Å; Y297-L301 HydrophobicContact CE2-CG 4.24Å; Y297-L301 WeakPolarHBondContact O-CG 3.48Å; Y297-L301 PolarHBondContact O-N 3.23Å; Y297-F314 HydrophobicContact CE1-CD2 4.27Å; Y297-F314 HydrophobicContact CE1-CE1 4.41Å; Y297-F314 AromaticContact CE1-CE2 3.83Å; Y297-F314 HydrophobicContact CE1-CE2 3.83Å; Y297-F314 AromaticContact CE1-CZ 3.93Å; Y297-F314 HydrophobicContact CE1-CZ 3.93Å
298	I	90.9	Very high	86.6	Confident	3 Å²	3	37.5 Å²	37.5	2%	0.015	20%	0.2	C	C	.	.	H	α-helix	trans	-62.8	-40.2	177.4	-73.6	168.6	0	0	0	111.1	T294 Q295 L301 N302 V311 L334 V337 F494 I497	T294-I298 HydrophobicContact CG2-CD1 4.17Å; T294-I298 VanDerWaalsContact O-CG1 3.3Å; T294-I298 WeakPolarHBondContact O-CG1 3.14Å; T294-I298 PolarHBondContact O-N 3.12Å; T294-I298 VanDerWaalsContact O-N 3.14Å; Q295-I298 PolarHBondContact O-N 3.33Å; I298-L301 PolarHBondContact O-N 3.42Å; I298-N302 PolarHBondContact O-N 3.47Å; I298-N302 VanDerWaalsContact O-N 3.15Å; I298-V311 HydrophobicContact CG2-CG1 4.45Å; I298-L334 HydrophobicContact CD1-CD2 4.41Å; I298-V337 HydrophobicContact CD1-CG1 3.98Å; I298-F494 HydrophobicContact CB-CE1 4.24Å; I298-F494 HydrophobicContact CB-CZ 4.26Å; I298-F494 HydrophobicContact CD1-CE1 4.13Å; I298-F494 HydrophobicContact CG2-CE1 3.78Å; I298-F494 HydrophobicContact CG2-CZ 3.98Å; I298-I497 HydrophobicContact CG2-CD1 3.43Å; I298-I497 VanDerWaalsContact CG2-CD1 3.43Å
299	L	89.7	Confident	86.8	Confident	23 Å²	23	38.7 Å²	38.7	12%	0.12	20%	0.2	C	C	.	.	H	α-helix	trans	-64.9	-43	174.7	-67.9	170.9	0	0	0	111.6	Q295 E296 Y297 L301 N302 E303 V490 C493 F494	Q295-L299 WeakPolarHBondContact O-CG 3.49Å; Q295-L299 PolarHBondContact O-N 2.93Å; E296-L299 PolarHBondContact O-N 3.06Å; Y297-L299 VanDerWaalsContact C-N 3.32Å; Y297-L299 PolarHBondContact O-N 3.09Å; L299-L301 PolarHBondContact O-N 3.25Å; L299-N302 WeakPolarHBondContact O-CB 3.27Å; L299-N302 PolarHBondContact O-N 3.26Å; L299-E303 PolarHBondContact O-N 3.19Å; L299-V490 HydrophobicContact CD1-CG2 3.88Å; L299-V490 HydrophobicContact CD2-CB 4.43Å; L299-V490 HydrophobicContact CD2-CG2 3.98Å; L299-C493 HydrophobicContact CD2-CB 4.15Å; L299-F494 HydrophobicContact CD1-CE2 4.3Å; L299-F494 HydrophobicContact CD2-CE2 3.86Å; L299-F494 HydrophobicContact CD2-CZ 4.49Å; L299-F494 HydrophobicContact CG-CE2 3.98Å; L299-F494 HydrophobicContact CG-CZ 4.28Å
300	A	88	Confident	87.1	Confident	3 Å²	3	35.9 Å²	35.9	3%	0.025	19%	0.193	C	C	.	.	H	α-helix	trans	-60.7	-41.1	174.9	0	0	0	0	0	112.5	C257 P261 V266 E296 Y297 N302 E303	C257-A300 HydrophobicContact CB-CB 4.09Å; P261-A300 HydrophobicContact CB-CB 3.78Å; V266-A300 HydrophobicContact CG1-CB 4.1Å; E296-A300 WeakPolarHBondContact O-CB 3.45Å; E296-A300 PolarHBondContact O-N 2.73Å; Y297-A300 PolarHBondContact O-N 2.72Å; A300-N302 VanDerWaalsContact C-N 3.26Å; A300-N302 PolarHBondContact O-N 3.12Å; A300-E303 PolarHBondContact O-N 3.03Å; A300-E303 VanDerWaalsContact O-N 3.11Å
301	L	87.1	Confident	87.3	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	19%	0.191	C	C	.	.	H	α-helix	trans	-58.9	-37.6	172.2	-72.2	-173.7	0	0	0	112.4	Y297 I298 L299 E303 L304 V310 V311 F314	Y297-L301 HydrophobicContact CD1-CD1 4.3Å; Y297-L301 HydrophobicContact CD1-CG 4.5Å; Y297-L301 HydrophobicContact CE1-CD1 3.53Å; Y297-L301 HydrophobicContact CE1-CG 4.02Å; Y297-L301 HydrophobicContact CE2-CD1 4.5Å; Y297-L301 HydrophobicContact CE2-CD2 4.22Å; Y297-L301 HydrophobicContact CE2-CG 4.24Å; Y297-L301 WeakPolarHBondContact O-CG 3.48Å; Y297-L301 PolarHBondContact O-N 3.23Å; I298-L301 PolarHBondContact O-N 3.42Å; L299-L301 PolarHBondContact O-N 3.25Å; L301-E303 VanDerWaalsContact C-N 3.27Å; L301-E303 PolarHBondContact O-N 3.27Å; L301-L304 HydrophobicContact CD2-CD1 3.85Å; L301-L304 WeakPolarHBondContact O-CB 3.49Å; L301-L304 WeakPolarHBondContact O-CG 3.12Å; L301-L304 PolarHBondContact O-N 3.23Å; L301-V310 HydrophobicContact CD2-CG1 4.3Å; L301-V311 HydrophobicContact CB-CG2 4.01Å; L301-F314 HydrophobicContact CD1-CB 4.05Å; L301-F314 HydrophobicContact CD1-CD1 4.45Å; L301-F314 HydrophobicContact CD1-CD2 4.29Å; L301-F314 HydrophobicContact CD1-CG 4Å
302	N	87.4	Confident	87.3	Confident	42 Å²	42	36.3 Å²	36.3	23%	0.225	20%	0.197	C	C	.	.	H	α-helix	trans	-73.6	-13.4	178.1	-170.5	39.6	0	0	0	113.7	I298 L299 A300 G307 M308 V311	I298-N302 PolarHBondContact O-N 3.47Å; I298-N302 VanDerWaalsContact O-N 3.15Å; L299-N302 WeakPolarHBondContact O-CB 3.27Å; L299-N302 PolarHBondContact O-N 3.26Å; A300-N302 VanDerWaalsContact C-N 3.26Å; A300-N302 PolarHBondContact O-N 3.12Å; N302-G307 WeakPolarHBondContact O-CA 3.22Å; N302-M308 HydrophobicContact CB-SD 4.5Å; N302-M308 WeakPolarHBondContact OD1-CG 3.48Å; N302-M308 PolarHBondContact OD1-N 3.04Å; N302-M308 VanDerWaalsContact OD1-N 3.13Å; N302-M308 PolarHBondContact OD1-SD 2.99Å; N302-V311 HydrophobicContact CB-CG2 4.12Å
303	E	85.5	Confident	87.4	Confident	76 Å²	76	37.8 Å²	37.8	36%	0.355	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	-0.2	174.7	-66.8	-169.3	166.5	0	0	113.7	P261 R262 L299 A300 L301	P261-E303 HydrophobicContact CB-CB 4.02Å; P261-E303 HydrophobicContact CG-CB 4.22Å; P261-E303 WeakPolarHBondContact CG-OE2 3.32Å; R262-E303 PolarHBondContact NE-O 2.8Å; R262-E303 PolarHBondContact NH2-O 3.46Å; L299-E303 PolarHBondContact O-N 3.19Å; A300-E303 PolarHBondContact O-N 3.03Å; A300-E303 VanDerWaalsContact O-N 3.11Å; L301-E303 VanDerWaalsContact C-N 3.27Å; L301-E303 PolarHBondContact O-N 3.27Å
304	L	85.1	Confident	87.3	Confident	24 Å²	24	38 Å²	38	13%	0.126	20%	0.201	C	C	.	.	S	Bend	trans	-70.1	160.7	167.1	-58.7	178.2	0	0	0	111.1	P261 R262 I267 L301 G306 G307 V310	P261-L304 WeakPolarHBondContact O-CD2 3.41Å; R262-L304 HydrophobicContact CB-CD2 4.33Å; R262-L304 HydrophobicContact CG-CD2 4.01Å; I267-L304 HydrophobicContact CD1-CD1 4Å; I267-L304 HydrophobicContact CD1-CD2 4.17Å; I267-L304 HydrophobicContact CG1-CD1 4.04Å; L301-L304 HydrophobicContact CD2-CD1 3.85Å; L301-L304 WeakPolarHBondContact O-CB 3.49Å; L301-L304 WeakPolarHBondContact O-CG 3.12Å; L301-L304 PolarHBondContact O-N 3.23Å; L304-G306 PolarHBondContact O-N 2.85Å; L304-G307 PolarHBondContact O-N 3.37Å; L304-V310 HydrophobicContact CB-CG2 4.4Å; L304-V310 HydrophobicContact CD1-CG1 4.02Å
305	N	79.4	Confident	87.3	Confident	155 Å²	155	38.1 Å²	38.1	83%	0.829	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-21.2	-173.3	-64.3	-11.2	0	0	0	114.9
306	G	75.5	Confident	87.1	Confident	42 Å²	42	42.2 Å²	42.2	43%	0.433	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-2.2	174.9	0	0	0	0	0	115.1	L304 M308 E309	L304-G306 PolarHBondContact O-N 2.85Å; G306-M308 PolarHBondContact O-N 2.96Å; G306-E309 WeakPolarHBondContact O-CB 3.43Å; G306-E309 PolarHBondContact O-N 3.13Å; G306-E309 VanDerWaalsContact O-N 3.09Å
307	G	85.8	Confident	86.9	Confident	16 Å²	16	43.3 Å²	43.3	17%	0.165	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	46.4	-129.1	179.8	0	0	0	0	0	114.4	N302 L304 E309 V310	N302-G307 WeakPolarHBondContact O-CA 3.22Å; L304-G307 PolarHBondContact O-N 3.37Å; G307-E309 PolarHBondContact O-N 3.06Å; G307-E309 VanDerWaalsContact O-N 3.11Å; G307-V310 WeakPolarHBondContact O-CB 3.14Å; G307-V310 PolarHBondContact O-N 3.17Å
308	M	86.3	Confident	86.5	Confident	42 Å²	42	43.4 Å²	43.4	21%	0.207	23%	0.232	C	C	.	.	H	α-helix	trans	-57.7	-23.6	-179.6	-69.7	-59.7	-49	0	0	114.6	N302 G306 V310 V311 K312 C493 L496 I497 M500	N302-M308 HydrophobicContact CB-SD 4.5Å; N302-M308 WeakPolarHBondContact OD1-CG 3.48Å; N302-M308 PolarHBondContact OD1-N 3.04Å; N302-M308 VanDerWaalsContact OD1-N 3.13Å; N302-M308 PolarHBondContact OD1-SD 2.99Å; G306-M308 PolarHBondContact O-N 2.96Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.42Å; M308-V311 HydrophobicContact CE-CB 4.23Å; M308-V311 HydrophobicContact CE-CG1 4.26Å; M308-V311 PolarHBondContact O-N 3.39Å; M308-K312 WeakPolarHBondContact O-CB 3.46Å; M308-K312 PolarHBondContact O-N 3.43Å; M308-C493 HydrophobicContact SD-CB 4.32Å; M308-L496 HydrophobicContact CE-CB 3.65Å; M308-L496 HydrophobicContact CE-CD1 4.28Å; M308-L496 HydrophobicContact CG-CD1 3.9Å; M308-L496 HydrophobicContact SD-CB 4.5Å; M308-L496 HydrophobicContact SD-CD1 4.22Å; M308-I497 HydrophobicContact CE-CG1 4.29Å; M308-M500 HydrophobicContact CE-CE 3.4Å
309	E	87.1	Confident	85.7	Confident	91 Å²	91	43.8 Å²	43.8	43%	0.425	23%	0.234	S	C	.	.	H	α-helix	trans	-70.1	-28.5	176.5	-172.6	56.5	-146.9	0	0	111.5	G306 G307 K312 K313	G306-E309 WeakPolarHBondContact O-CB 3.43Å; G306-E309 PolarHBondContact O-N 3.13Å; G306-E309 VanDerWaalsContact O-N 3.09Å; G307-E309 PolarHBondContact O-N 3.06Å; G307-E309 VanDerWaalsContact O-N 3.11Å; E309-K312 PolarHBondContact O-N 2.87Å; E309-K312 WeakPolarHBondContact OE2-CD 3.34Å; E309-K313 WeakPolarHBondContact O-CG 3.48Å; E309-K313 PolarHBondContact O-N 3.23Å
310	V	88.5	Confident	84.5	Confident	35 Å²	35	43.3 Å²	43.3	21%	0.212	24%	0.235	C	C	.	.	H	α-helix	trans	-69.7	-41.5	171.7	-171.7	0	0	0	0	110.4	L301 L304 G307 M308 K312 K313 F314	L301-V310 HydrophobicContact CD2-CG1 4.3Å; L304-V310 HydrophobicContact CB-CG2 4.4Å; L304-V310 HydrophobicContact CD1-CG1 4.02Å; G307-V310 WeakPolarHBondContact O-CB 3.14Å; G307-V310 PolarHBondContact O-N 3.17Å; M308-V310 VanDerWaalsContact C-N 3.29Å; M308-V310 PolarHBondContact O-N 3.42Å; V310-K312 VanDerWaalsContact C-N 3.33Å; V310-K312 PolarHBondContact O-N 2.88Å; V310-K313 PolarHBondContact O-N 2.97Å; V310-F314 WeakPolarHBondContact O-CB 3.36Å; V310-F314 PolarHBondContact O-N 3.48Å
311	V	89.1	Confident	83.1	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	27%	0.273	C	S	.	.	H	α-helix	trans	-62.5	-41	174.8	-177	0	0	0	0	110.9	I298 L301 N302 M308 F314 I315 I497 M500	I298-V311 HydrophobicContact CG2-CG1 4.45Å; L301-V311 HydrophobicContact CB-CG2 4.01Å; N302-V311 HydrophobicContact CB-CG2 4.12Å; M308-V311 HydrophobicContact CE-CB 4.23Å; M308-V311 HydrophobicContact CE-CG1 4.26Å; M308-V311 PolarHBondContact O-N 3.39Å; V311-F314 WeakPolarHBondContact O-CB 3.39Å; V311-F314 PolarHBondContact O-N 3.42Å; V311-I315 HydrophobicContact CG1-CD1 4.05Å; V311-I315 WeakPolarHBondContact O-CG1 3.47Å; V311-I315 PolarHBondContact O-N 3.15Å; V311-I497 HydrophobicContact CG1-CD1 3.9Å; V311-I497 HydrophobicContact CG1-CG1 3.9Å; V311-M500 HydrophobicContact CG1-CE 4.14Å
312	K	89	Confident	81.7	Confident	94 Å²	94	54.5 Å²	54.5	41%	0.409	31%	0.305	S	S	.	.	H	α-helix	trans	-60.4	-48.6	174.9	-170.7	-178.1	179.2	-175	0	112	M308 E309 V310 F314 I315 H316 M500	M308-K312 WeakPolarHBondContact O-CB 3.46Å; M308-K312 PolarHBondContact O-N 3.43Å; E309-K312 PolarHBondContact O-N 2.87Å; E309-K312 WeakPolarHBondContact OE2-CD 3.34Å; V310-K312 VanDerWaalsContact C-N 3.33Å; V310-K312 PolarHBondContact O-N 2.88Å; K312-F314 VanDerWaalsContact C-N 3.31Å; K312-F314 PolarHBondContact O-N 3.48Å; K312-I315 PolarHBondContact O-N 3.23Å; K312-H316 WeakPolarHBondContact O-CB 3.3Å; K312-H316 PolarHBondContact O-N 3.31Å; K312-M500 HydrophobicContact CB-SD 3.58Å; K312-M500 VanDerWaalsContact CB-SD 3.58Å; K312-M500 HydrophobicContact CD-SD 4.38Å; K312-M500 HydrophobicContact CG-SD 3.76Å
313	K	87.9	Confident	80.2	Confident	95 Å²	95	54.9 Å²	54.9	41%	0.413	32%	0.32	S	S	.	.	H	α-helix	trans	-61	-38.8	175.2	-72.6	175.4	-178.5	-176.7	0	112.3	L27 E309 V310 H316 S317	L27-K313 HydrophobicContact CD2-CB 3.9Å; L27-K313 HydrophobicContact CD2-CD 4.21Å; L27-K313 HydrophobicContact CD2-CG 4.47Å; E309-K313 WeakPolarHBondContact O-CG 3.48Å; E309-K313 PolarHBondContact O-N 3.23Å; V310-K313 PolarHBondContact O-N 2.97Å; K313-H316 PolarHBondContact O-N 3.31Å; K313-S317 PolarHBondContact O-N 2.95Å
314	F	89.5	Confident	78.8	Confident	4 Å²	4	58.5 Å²	58.5	2%	0.018	34%	0.337	C	S	.	.	H	α-helix	trans	-61.7	-48.8	173.6	172.7	-96.5	0	0	0	111.8	T271 V274 Q275 L278 Y297 L301 V310 V311 K312 H316 S317 M318	T271-F314 HydrophobicContact CG2-CD2 4.26Å; T271-F314 HydrophobicContact CG2-CE2 4.21Å; V274-F314 HydrophobicContact CG1-CZ 4.05Å; Q275-F314 HydrophobicContact CG-CE2 3.78Å; Q275-F314 HydrophobicContact CG-CZ 4.31Å; L278-F314 HydrophobicContact CD1-CE1 3.95Å; L278-F314 HydrophobicContact CD1-CZ 3.94Å; Y297-F314 HydrophobicContact CE1-CD2 4.27Å; Y297-F314 HydrophobicContact CE1-CE1 4.41Å; Y297-F314 AromaticContact CE1-CE2 3.83Å; Y297-F314 HydrophobicContact CE1-CE2 3.83Å; Y297-F314 AromaticContact CE1-CZ 3.93Å; Y297-F314 HydrophobicContact CE1-CZ 3.93Å; L301-F314 HydrophobicContact CD1-CB 4.05Å; L301-F314 HydrophobicContact CD1-CD1 4.45Å; L301-F314 HydrophobicContact CD1-CD2 4.29Å; L301-F314 HydrophobicContact CD1-CG 4Å; V310-F314 WeakPolarHBondContact O-CB 3.36Å; V310-F314 PolarHBondContact O-N 3.48Å; V311-F314 WeakPolarHBondContact O-CB 3.39Å; V311-F314 PolarHBondContact O-N 3.42Å; K312-F314 VanDerWaalsContact C-N 3.31Å; K312-F314 PolarHBondContact O-N 3.48Å; F314-H316 VanDerWaalsContact C-N 3.34Å; F314-H316 PolarHBondContact O-N 2.67Å; F314-S317 WeakPolarHBondContact O-CB 3.44Å; F314-S317 PolarHBondContact O-N 2.81Å; F314-S317 PolarHBondContact O-OG 3.2Å; F314-M318 WeakPolarHBondContact O-CG 3.47Å; F314-M318 PolarHBondContact O-N 2.95Å
315	I	88.2	Confident	77.6	Confident	2 Å²	2	58.6 Å²	58.6	1%	0.01	34%	0.339	C	S	.	.	H	α-helix	trans	-60.9	-43.4	176.8	-67.5	164.6	0	0	0	110.8	V311 K312 S317 M318 H319 I497 M500 L501 Y504 W507	V311-I315 HydrophobicContact CG1-CD1 4.05Å; V311-I315 WeakPolarHBondContact O-CG1 3.47Å; V311-I315 PolarHBondContact O-N 3.15Å; K312-I315 PolarHBondContact O-N 3.23Å; I315-S317 VanDerWaalsContact C-N 3.33Å; I315-S317 PolarHBondContact O-N 3.2Å; I315-M318 WeakPolarHBondContact O-CB 3.43Å; I315-M318 PolarHBondContact O-N 2.91Å; I315-H319 PolarHBondContact O-N 3.48Å; I315-I497 HydrophobicContact CD1-CG1 4.19Å; I315-I497 HydrophobicContact CD1-CG2 3.93Å; I315-M500 HydrophobicContact CD1-CB 4.5Å; I315-M500 HydrophobicContact CD1-CE 3.7Å; I315-M500 HydrophobicContact CD1-SD 4.49Å; I315-L501 HydrophobicContact CG2-CD2 4.21Å; I315-Y504 HydrophobicContact CG2-CE2 4.12Å; I315-W507 HydrophobicContact CG2-CH2 3.94Å; I315-W507 HydrophobicContact CG2-CZ3 3.67Å
316	H	86.7	Confident	76.7	Confident	102 Å²	102	55.2 Å²	55.2	47%	0.472	33%	0.325	S	S	.	.	H	α-helix	trans	-60.9	-39.8	177.2	-170.9	66.7	0	0	0	112.4	K312 K313 F314 M318 H319 G320 Y504	K312-H316 WeakPolarHBondContact O-CB 3.3Å; K312-H316 PolarHBondContact O-N 3.31Å; K313-H316 PolarHBondContact O-N 3.31Å; F314-H316 VanDerWaalsContact C-N 3.34Å; F314-H316 PolarHBondContact O-N 2.67Å; H316-M318 PolarHBondContact O-N 2.92Å; H316-H319 PolarHBondContact O-N 3.03Å; H316-G320 PolarHBondContact O-N 3.18Å; H316-Y504 WeakPolarHBondContact CA-OH 3.48Å; H316-Y504 PolarHBondContact ND1-OH 2.75Å
317	S	86.4	Confident	76.6	Confident	53 Å²	53	56.2 Å²	56.2	37%	0.371	32%	0.318	S	S	.	.	H	α-helix	trans	-60.9	-17.9	174.9	79.9	0	0	0	0	114.2	Q275 K313 F314 I315	Q275-S317 PolarHBondContact NE2-OG 2.74Å; Q275-S317 VanDerWaalsContact NE2-OG 3.15Å; K313-S317 PolarHBondContact O-N 2.95Å; F314-S317 WeakPolarHBondContact O-CB 3.44Å; F314-S317 PolarHBondContact O-N 2.81Å; F314-S317 PolarHBondContact O-OG 3.2Å; I315-S317 VanDerWaalsContact C-N 3.33Å; I315-S317 PolarHBondContact O-N 3.2Å
318	M	82.5	Confident	76.2	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-96.9	-18.7	178.1	-62.1	-69.2	-70.7	0	0	113.2	Q275 L278 K279 F314 I315 H316 V330	Q275-M318 HydrophobicContact CB-CE 4.25Å; Q275-M318 HydrophobicContact CB-SD 3.67Å; Q275-M318 HydrophobicContact CG-SD 3.43Å; Q275-M318 WeakPolarHBondContact CG-SD 3.5Å; Q275-M318 WeakPolarHBondContact O-CE 3.27Å; L278-M318 HydrophobicContact CB-CE 3.71Å; L278-M318 HydrophobicContact CD1-CE 4.33Å; K279-M318 HydrophobicContact CD-CE 4.2Å; K279-M318 HydrophobicContact CG-CE 3.77Å; F314-M318 WeakPolarHBondContact O-CG 3.47Å; F314-M318 PolarHBondContact O-N 2.95Å; I315-M318 WeakPolarHBondContact O-CB 3.43Å; I315-M318 PolarHBondContact O-N 2.91Å; H316-M318 PolarHBondContact O-N 2.92Å; M318-V330 HydrophobicContact CB-CG1 3.91Å; M318-V330 HydrophobicContact CE-CB 4.46Å; M318-V330 HydrophobicContact CE-CG1 4.05Å; M318-V330 HydrophobicContact CE-CG2 3.55Å
319	H	75.1	Confident	76.1	Confident	12 Å²	12	63.3 Å²	63.3	6%	0.056	35%	0.351	C	S	.	.	H	α-helix	trans	-83.5	-26.7	178.8	-173.9	-100.8	0	0	0	113.3	I315 H316 P326 Y504 D506 W507	I315-H319 PolarHBondContact O-N 3.48Å; H316-H319 PolarHBondContact O-N 3.03Å; H319-P326 WeakPolarHBondContact O-CD 3.46Å; H319-Y504 HydrophobicContact CB-CD1 4.32Å; H319-Y504 HydrophobicContact CB-CE1 3.84Å; H319-Y504 AromaticContact CD2-CD1 3.56Å; H319-Y504 AromaticContact CD2-CE1 3.99Å; H319-Y504 AromaticContact CE1-CD1 3.45Å; H319-Y504 VanDerWaalsContact CE1-CD1 3.45Å; H319-Y504 WeakPolarHBondContact CE1-CD1 3.46Å; H319-Y504 AromaticContact CE1-CE1 3.95Å; H319-Y504 AromaticContact CG-CD1 3.48Å; H319-Y504 VanDerWaalsContact CG-CD1 3.48Å; H319-Y504 AromaticContact CG-CE1 3.44Å; H319-Y504 VanDerWaalsContact CG-CE1 3.44Å; H319-Y504 AromaticContact ND1-CD1 3.42Å; H319-Y504 WeakPolarHBondContact ND1-CD1 3.48Å; H319-Y504 AromaticContact ND1-CE1 3.41Å; H319-Y504 WeakPolarHBondContact ND1-CE1 3.44Å; H319-Y504 AromaticContact NE2-CD1 3.54Å; H319-D506 IonicContact CD2-OD1 3.76Å; H319-D506 IonicContact CD2-OD2 3.55Å; H319-D506 IonicContact CE1-OD1 3.84Å; H319-D506 IonicContact NE2-OD1 2.66Å; H319-D506 PolarHBondContact NE2-OD1 2.91Å; H319-D506 IonicContact NE2-OD2 3.7Å; H319-D506 PolarHBondContact NE2-OD2 2.79Å; H319-D506 VanDerWaalsContact NE2-OD2 3.09Å; H319-W507 HydrophobicContact CB-CH2 3.95Å; H319-W507 HydrophobicContact CB-CZ2 4.12Å; H319-W507 AromaticContact CD2-CD2 3.93Å; H319-W507 AromaticContact CD2-CE2 3.58Å; H319-W507 AromaticContact CD2-CZ2 3.68Å; H319-W507 AromaticContact CD2-NE1 3.89Å
320	G	64.5	Low	76.2	Confident	13 Å²	13	59 Å²	59	13%	0.134	33%	0.331	C	S	.	.			trans	78.4	157.3	177.6	0	0	0	0	0	113.8	H316 T322	H316-G320 PolarHBondContact O-N 3.18Å; G320-T322 VanDerWaalsContact C-N 3.34Å; G320-T322 PolarHBondContact O-N 3.25Å
321	P	58.9	Low	76.2	Confident	129 Å²	129	57.5 Å²	57.5	84%	0.838	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-11.4	-171.6	30.8	-35.1	0	0	0	114.6
322	T	56.9	Low	76.1	Confident	114 Å²	114	59.5 Å²	59.5	70%	0.699	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	9.9	-167.6	48.4	0	0	0	0	115.2	G320 Q324	G320-T322 VanDerWaalsContact C-N 3.34Å; G320-T322 PolarHBondContact O-N 3.25Å; T322-Q324 PolarHBondContact O-N 3.08Å
323	G	55.7	Low	76.2	Confident	51 Å²	51	55.7 Å²	55.7	53%	0.526	32%	0.319	S	S	.	.	S	Bend	trans	68.1	5.4	176.4	0	0	0	0	0	115.6
324	Q	57.5	Low	76.3	Confident	152 Å²	152	51.2 Å²	51.2	71%	0.71	30%	0.299	S	S	*	.	S	Bend	trans	-124.6	122.3	167.7	-68.4	-178	-2.8	0	0	106.9	T322 P326	T322-Q324 PolarHBondContact O-N 3.08Å; Q324-P326 WeakPolarHBondContact O-CD 3.25Å; Q324-P326 VanDerWaalsContact O-N 3.12Å
325	C	59	Low	76.3	Confident	26 Å²	26	51.1 Å²	51.1	18%	0.176	30%	0.299	C	S	.	.			trans	-55.1	118.3	179.4	-177.8	0	0	0	0	110.9	H327 D506 W507	C325-H327 PolarHBondContact O-N 2.89Å; C325-H327 PolarHBondContact SG-O 3.37Å; C325-H327 VanDerWaalsContact SG-O 3.36Å; C325-D506 VanDerWaalsContact CB-OD2 3.28Å; C325-D506 WeakPolarHBondContact CB-OD2 3.38Å; C325-D506 PolarHBondContact N-OD2 2.77Å; C325-W507 VanDerWaalsContact CB-NE1 3.31Å; C325-W507 PolarHBondContact SG-NE1 3.37Å
326	P	60.8	Low	76.4	Confident	84 Å²	84	52.8 Å²	52.8	55%	0.545	31%	0.313	S	S	.	.	S	Bend	trans	-70	-6.3	-176.8	30.3	-37.3	0	0	0	112.3	H319 Q324	H319-P326 WeakPolarHBondContact O-CD 3.46Å; Q324-P326 WeakPolarHBondContact O-CD 3.25Å; Q324-P326 VanDerWaalsContact O-N 3.12Å
327	H	73.3	Confident	76.5	Confident	62 Å²	62	47.9 Å²	47.9	29%	0.287	29%	0.291	S	S	.	.			trans	-148	96.1	-176.6	-144.7	-61.5	0	0	0	113	K279 C325 R329 V330	K279-H327 HydrophobicContact CG-CB 4.09Å; K279-H327 PolarHBondContact O-CE1 3.41Å; K279-H327 PolarHBondContact O-ND1 3.32Å; C325-H327 PolarHBondContact O-N 2.89Å; C325-H327 PolarHBondContact SG-O 3.37Å; C325-H327 VanDerWaalsContact SG-O 3.36Å; H327-R329 PolarHBondContact O-N 2.96Å; H327-V330 HydrophobicContact CB-CG2 3.94Å; H327-V330 PolarHBondContact O-N 3.07Å; H327-V330 VanDerWaalsContact O-N 3.12Å
328	P	77.2	Confident	76.7	Confident	100 Å²	100	45.4 Å²	45.4	65%	0.649	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-1.9	-167.9	27.2	-36.8	0	0	0	115.5	P332	P328-P332 WeakPolarHBondContact O-CD 3.41Å
329	R	85.4	Confident	77.1	Confident	108 Å²	108	46.7 Å²	46.7	41%	0.408	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	-16.4	178.3	-52.8	-47.5	-165.2	86.4	1.1	114	L278 K279 N281 H327 L331 P332 N333	L278-R329 CarbonylContact O-C 3.54Å; K279-R329 WeakPolarHBondContact O-CB 3.29Å; N281-R329 PolarHBondContact OD1-NH1 3.32Å; H327-R329 PolarHBondContact O-N 2.96Å; R329-L331 PolarHBondContact O-N 3.05Å; R329-P332 WeakPolarHBondContact O-CD 3.39Å; R329-N333 VanDerWaalsContact O-CB 3.3Å; R329-N333 WeakPolarHBondContact O-CB 3.29Å; R329-N333 VanDerWaalsContact O-CG 3.24Å; R329-N333 PolarHBondContact O-N 3.06Å; R329-N333 PolarHBondContact O-ND2 3.29Å
330	V	87.7	Confident	77.7	Confident	0 Å²	0	47 Å²	47	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-59.8	-47.8	-177.6	168.8	0	0	0	0	111.4	L278 K279 M318 H327 N333 L334 W507	L278-V330 WeakPolarHBondContact O-CA 3.36Å; L278-V330 PolarHBondContact O-N 3.3Å; K279-V330 HydrophobicContact CG-CG2 3.96Å; M318-V330 HydrophobicContact CB-CG1 3.91Å; M318-V330 HydrophobicContact CE-CB 4.46Å; M318-V330 HydrophobicContact CE-CG1 4.05Å; M318-V330 HydrophobicContact CE-CG2 3.55Å; H327-V330 HydrophobicContact CB-CG2 3.94Å; H327-V330 PolarHBondContact O-N 3.07Å; H327-V330 VanDerWaalsContact O-N 3.12Å; V330-N333 PolarHBondContact O-N 2.95Å; V330-L334 HydrophobicContact CG1-CD1 3.78Å; V330-L334 HydrophobicContact CG1-CG 4.35Å; V330-L334 WeakPolarHBondContact O-CB 3.4Å; V330-L334 WeakPolarHBondContact O-CG 3.5Å; V330-L334 PolarHBondContact O-N 3.08Å; V330-W507 HydrophobicContact CG1-CH2 4.37Å; V330-W507 HydrophobicContact CG1-CZ2 4.06Å
331	L	88.6	Confident	78.8	Confident	3 Å²	3	46.5 Å²	46.5	2%	0.016	28%	0.279	C	S	.	.	H	α-helix	trans	-63.5	-53.5	-179.5	175.8	74.3	0	0	0	112.5	R329 N333 L334 V335 L501 W507 A510 L511 L514	R329-L331 PolarHBondContact O-N 3.05Å; L331-N333 VanDerWaalsContact C-N 3.28Å; L331-N333 PolarHBondContact O-N 3.18Å; L331-L334 PolarHBondContact O-N 3.15Å; L331-V335 HydrophobicContact CD1-CG2 4.09Å; L331-V335 HydrophobicContact CG-CG2 4.44Å; L331-V335 VanDerWaalsContact O-CG2 3.32Å; L331-V335 WeakPolarHBondContact O-CG2 3.4Å; L331-V335 PolarHBondContact O-N 2.81Å; L331-L501 HydrophobicContact CD1-CB 4.19Å; L331-L501 HydrophobicContact CD1-CD1 3.95Å; L331-L501 HydrophobicContact CD1-CD2 3.94Å; L331-L501 HydrophobicContact CD1-CG 4.24Å; L331-W507 HydrophobicContact CB-CD2 4.26Å; L331-W507 HydrophobicContact CB-CG 4.23Å; L331-W507 HydrophobicContact CD1-CB 4.11Å; L331-W507 HydrophobicContact CD1-CD2 4.01Å; L331-W507 HydrophobicContact CD1-CE3 4.2Å; L331-W507 HydrophobicContact CD1-CG 4.02Å; L331-W507 HydrophobicContact CD2-CB 3.74Å; L331-W507 HydrophobicContact CD2-CG 3.8Å; L331-W507 WeakPolarHBondContact CD2-O 3.23Å; L331-W507 HydrophobicContact CG-CB 4.47Å; L331-W507 HydrophobicContact CG-CG 4.24Å; L331-A510 HydrophobicContact CD2-CB 3.55Å; L331-L511 HydrophobicContact CD1-CB 4.42Å; L331-L511 HydrophobicContact CD1-CD1 4.27Å; L331-L511 HydrophobicContact CD2-CB 4.31Å; L331-L514 HydrophobicContact CG-CD1 4.35Å
332	P	88.3	Confident	80.1	Confident	44 Å²	44	40.4 Å²	40.4	29%	0.286	24%	0.24	S	C	.	.	H	α-helix	trans	-52.3	-42.9	172.7	-28.1	32.3	0	0	0	114	P328 R329 A336 L514	P328-P332 WeakPolarHBondContact O-CD 3.41Å; R329-P332 WeakPolarHBondContact O-CD 3.39Å; P332-A336 WeakPolarHBondContact O-CB 3.4Å; P332-A336 PolarHBondContact O-N 2.78Å; P332-L514 HydrophobicContact CB-CD1 4.3Å; P332-L514 HydrophobicContact CG-CD1 4.19Å
333	N	90	Very high	81.6	Confident	13 Å²	13	39.6 Å²	39.6	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-67.3	-43.9	-179.8	-74.8	-20.7	0	0	0	112	L278 H280 F284 R329 V330 L331 A336 V337	L278-N333 HydrophobicContact CD2-CB 3.82Å; L278-N333 PolarHBondContact O-ND2 3.5Å; H280-N333 PolarHBondContact O-ND2 2.68Å; H280-N333 VanDerWaalsContact O-ND2 3.11Å; F284-N333 HydrophobicContact CE2-CB 3.87Å; R329-N333 VanDerWaalsContact O-CB 3.3Å; R329-N333 WeakPolarHBondContact O-CB 3.29Å; R329-N333 VanDerWaalsContact O-CG 3.24Å; R329-N333 PolarHBondContact O-N 3.06Å; R329-N333 PolarHBondContact O-ND2 3.29Å; V330-N333 PolarHBondContact O-N 2.95Å; L331-N333 VanDerWaalsContact C-N 3.28Å; L331-N333 PolarHBondContact O-N 3.18Å; N333-A336 PolarHBondContact O-N 3.16Å; N333-V337 VanDerWaalsContact O-CG2 3.3Å; N333-V337 WeakPolarHBondContact O-CG2 3.4Å; N333-V337 PolarHBondContact O-N 2.84Å
334	L	90.4	Very high	83	Confident	1 Å²	1	40 Å²	40	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-63.7	-44.5	175.1	-78.2	175.1	0	0	0	111.9	L278 I298 V330 L331 A336 V337 C338 L501	L278-L334 HydrophobicContact CD1-CD2 3.6Å; L278-L334 HydrophobicContact CD1-CG 4.11Å; L278-L334 HydrophobicContact CD2-CD2 3.88Å; L278-L334 HydrophobicContact CD2-CG 4.06Å; L278-L334 HydrophobicContact CG-CD2 4.4Å; I298-L334 HydrophobicContact CD1-CD2 4.41Å; V330-L334 HydrophobicContact CG1-CD1 3.78Å; V330-L334 HydrophobicContact CG1-CG 4.35Å; V330-L334 WeakPolarHBondContact O-CB 3.4Å; V330-L334 WeakPolarHBondContact O-CG 3.5Å; V330-L334 PolarHBondContact O-N 3.08Å; L331-L334 PolarHBondContact O-N 3.15Å; L334-A336 PolarHBondContact O-N 3.26Å; L334-V337 WeakPolarHBondContact O-CB 3.4Å; L334-V337 PolarHBondContact O-N 2.9Å; L334-C338 PolarHBondContact O-N 3.34Å; L334-C338 PolarHBondContact O-SG 2.99Å; L334-C338 VanDerWaalsContact O-SG 3.35Å; L334-L501 HydrophobicContact CB-CD1 4.35Å; L334-L501 HydrophobicContact CD1-CD2 4.04Å
335	V	90.3	Very high	84.3	Confident	2 Å²	2	33.4 Å²	33.4	1%	0.012	19%	0.19	C	C	.	.	H	α-helix	trans	-61.6	-44.3	176.7	175	0	0	0	0	110.5	L331 V337 C338 L339 L498 L501 L511 L514	L331-V335 HydrophobicContact CD1-CG2 4.09Å; L331-V335 HydrophobicContact CG-CG2 4.44Å; L331-V335 VanDerWaalsContact O-CG2 3.32Å; L331-V335 WeakPolarHBondContact O-CG2 3.4Å; L331-V335 PolarHBondContact O-N 2.81Å; V335-V337 VanDerWaalsContact C-N 3.29Å; V335-V337 PolarHBondContact O-N 2.8Å; V335-C338 PolarHBondContact O-N 3.03Å; V335-L339 HydrophobicContact CG1-CD1 3.84Å; V335-L339 HydrophobicContact CG1-CG 4.03Å; V335-L339 WeakPolarHBondContact O-CB 3.42Å; V335-L339 VanDerWaalsContact O-CG 3.26Å; V335-L339 WeakPolarHBondContact O-CG 3.28Å; V335-L339 PolarHBondContact O-N 3.05Å; V335-L498 HydrophobicContact CG2-CD2 4.49Å; V335-L501 HydrophobicContact CG2-CD1 3.94Å; V335-L511 HydrophobicContact CG2-CD1 3.45Å; V335-L511 VanDerWaalsContact CG2-CD1 3.45Å; V335-L514 HydrophobicContact CB-CD1 4.23Å; V335-L514 HydrophobicContact CG1-CB 4.12Å; V335-L514 HydrophobicContact CG1-CD1 4.5Å; V335-L514 HydrophobicContact CG2-CD1 4.09Å
336	A	88.9	Confident	85.4	Confident	37 Å²	37	32.2 Å²	32.2	31%	0.306	18%	0.181	S	C	.	.	H	α-helix	trans	-61.4	-35.7	176.7	0	0	0	0	0	113.3	F284 P332 N333 L334 A340	F284-A336 HydrophobicContact CD2-CB 4.18Å; P332-A336 WeakPolarHBondContact O-CB 3.4Å; P332-A336 PolarHBondContact O-N 2.78Å; N333-A336 PolarHBondContact O-N 3.16Å; L334-A336 PolarHBondContact O-N 3.26Å; A336-A340 WeakPolarHBondContact O-CB 3.38Å; A336-A340 PolarHBondContact O-N 2.83Å
337	V	89.4	Confident	86.2	Confident	0 Å²	0	30.8 Å²	30.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-66.1	-48.1	173.4	163	0	0	0	0	111.2	F284 R291 T294 Q295 I298 N333 L334 V335 A341 F494	F284-V337 HydrophobicContact CE2-CG2 3.97Å; F284-V337 HydrophobicContact CZ-CG2 4.02Å; R291-V337 HydrophobicContact CG-CG2 4.05Å; T294-V337 HydrophobicContact CG2-CG1 4.11Å; T294-V337 HydrophobicContact CG2-CG2 3.81Å; Q295-V337 HydrophobicContact CG-CG1 3.74Å; Q295-V337 PolarHBondContact NE2-O 3.22Å; I298-V337 HydrophobicContact CD1-CG1 3.98Å; N333-V337 VanDerWaalsContact O-CG2 3.3Å; N333-V337 WeakPolarHBondContact O-CG2 3.4Å; N333-V337 PolarHBondContact O-N 2.84Å; L334-V337 WeakPolarHBondContact O-CB 3.4Å; L334-V337 PolarHBondContact O-N 2.9Å; V335-V337 VanDerWaalsContact C-N 3.29Å; V335-V337 PolarHBondContact O-N 2.8Å; V337-A341 WeakPolarHBondContact O-CB 3.26Å; V337-A341 PolarHBondContact O-N 2.72Å; V337-A341 VanDerWaalsContact O-N 3.1Å; V337-F494 HydrophobicContact CG1-CE1 3.97Å
338	C	90.9	Very high	85.9	Confident	1 Å²	1	34.9 Å²	34.9	1%	0.007	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-51	176.6	-71.3	0	0	0	0	112.2	L334 V335 A340 A341 I342 F494 I497 L498	L334-C338 PolarHBondContact O-N 3.34Å; L334-C338 PolarHBondContact O-SG 2.99Å; L334-C338 VanDerWaalsContact O-SG 3.35Å; V335-C338 PolarHBondContact O-N 3.03Å; C338-A340 PolarHBondContact O-N 3.29Å; C338-A341 PolarHBondContact O-N 3.18Å; C338-A341 VanDerWaalsContact O-N 3.17Å; C338-I342 WeakPolarHBondContact O-CD1 3.28Å; C338-I342 VanDerWaalsContact O-CG1 3.31Å; C338-I342 WeakPolarHBondContact O-CG1 2.88Å; C338-I342 PolarHBondContact O-N 3.45Å; C338-F494 HydrophobicContact CB-CB 4.41Å; C338-F494 HydrophobicContact CB-CD1 4.32Å; C338-I497 WeakPolarHBondContact SG-CG2 3.31Å; C338-L498 HydrophobicContact CB-CD2 3.96Å; C338-L498 HydrophobicContact CB-CG 4.12Å
339	L	89.6	Confident	85.4	Confident	28 Å²	28	33.2 Å²	33.2	15%	0.147	17%	0.17	C	C	.	.	H	α-helix	trans	-57.8	-49.8	-179.5	-68.5	178.2	0	0	0	110.8	V335 A341 I342 Y343 L515 P519 F520	V335-L339 HydrophobicContact CG1-CD1 3.84Å; V335-L339 HydrophobicContact CG1-CG 4.03Å; V335-L339 WeakPolarHBondContact O-CB 3.42Å; V335-L339 VanDerWaalsContact O-CG 3.26Å; V335-L339 WeakPolarHBondContact O-CG 3.28Å; V335-L339 PolarHBondContact O-N 3.05Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 3.29Å; L339-I342 PolarHBondContact O-N 3.42Å; L339-Y343 VanDerWaalsContact O-CD2 3.28Å; L339-Y343 WeakPolarHBondContact O-CD2 3.39Å; L339-Y343 PolarHBondContact O-N 3.36Å; L339-L515 HydrophobicContact CD2-CD2 4.44Å; L339-P519 HydrophobicContact CD1-CB 3.99Å; L339-P519 HydrophobicContact CD1-CG 4.06Å; L339-P519 HydrophobicContact CD2-CB 4.07Å; L339-P519 HydrophobicContact CD2-CG 3.62Å; L339-F520 HydrophobicContact CD2-CD1 4.02Å; L339-F520 HydrophobicContact CD2-CE1 3.35Å; L339-F520 HydrophobicContact CD2-CZ 3.66Å
340	A	88.1	Confident	84.6	Confident	20 Å²	20	29.3 Å²	29.3	17%	0.165	16%	0.156	C	C	.	.	H	α-helix	trans	-62.8	-33.3	179.1	0	0	0	0	0	113.2	A336 C338 S344	A336-A340 WeakPolarHBondContact O-CB 3.38Å; A336-A340 PolarHBondContact O-N 2.83Å; C338-A340 PolarHBondContact O-N 3.29Å; A340-S344 PolarHBondContact O-N 3.18Å; A340-S344 VanDerWaalsContact O-N 3.1Å
341	A	87.1	Confident	83.5	Confident	2 Å²	2	32.2 Å²	32.2	2%	0.017	17%	0.172	C	C	.	.	H	α-helix	trans	-69.3	-46.3	175.9	0	0	0	0	0	110.9	Q295 V337 C338 L339 Y343 S344 C345 V490 F494	Q295-A341 HydrophobicContact CG-CB 4.3Å; V337-A341 WeakPolarHBondContact O-CB 3.26Å; V337-A341 PolarHBondContact O-N 2.72Å; V337-A341 VanDerWaalsContact O-N 3.1Å; C338-A341 PolarHBondContact O-N 3.18Å; C338-A341 VanDerWaalsContact O-N 3.17Å; L339-A341 VanDerWaalsContact C-N 3.28Å; L339-A341 PolarHBondContact O-N 3.29Å; A341-Y343 PolarHBondContact O-N 3.36Å; A341-S344 PolarHBondContact O-N 3.27Å; A341-S344 VanDerWaalsContact O-N 3.12Å; A341-S344 PolarHBondContact O-OG 2.85Å; A341-C345 PolarHBondContact O-N 3.26Å; A341-C345 PolarHBondContact O-SG 2.84Å; A341-C345 VanDerWaalsContact O-SG 3.37Å; A341-V490 HydrophobicContact CB-CG1 4.41Å; A341-F494 HydrophobicContact CB-CB 4.4Å; A341-F494 HydrophobicContact CB-CD1 4.13Å; A341-F494 HydrophobicContact CB-CD2 3.29Å; A341-F494 HydrophobicContact CB-CE1 4.26Å; A341-F494 HydrophobicContact CB-CE2 3.46Å; A341-F494 VanDerWaalsContact CB-CE2 3.46Å; A341-F494 HydrophobicContact CB-CG 3.67Å; A341-F494 HydrophobicContact CB-CZ 3.96Å
342	I	87.6	Confident	82.2	Confident	0 Å²	0	36 Å²	36	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.2	-44.7	176.6	-65.5	160.6	0	0	0	110.6	C338 L339 S344 C345 Y346 L491 F494 L498 F520 A524 F530	C338-I342 WeakPolarHBondContact O-CD1 3.28Å; C338-I342 VanDerWaalsContact O-CG1 3.31Å; C338-I342 WeakPolarHBondContact O-CG1 2.88Å; C338-I342 PolarHBondContact O-N 3.45Å; L339-I342 PolarHBondContact O-N 3.42Å; I342-S344 VanDerWaalsContact C-N 3.32Å; I342-S344 PolarHBondContact O-N 3.28Å; I342-C345 WeakPolarHBondContact O-CB 3.36Å; I342-C345 PolarHBondContact O-N 3.15Å; I342-Y346 HydrophobicContact CG2-CE2 4.43Å; I342-Y346 WeakPolarHBondContact O-CD2 3.39Å; I342-L491 HydrophobicContact CG1-CD1 4.16Å; I342-L491 HydrophobicContact CG2-CD1 4Å; I342-F494 HydrophobicContact CD1-CB 4.46Å; I342-F494 HydrophobicContact CG1-CB 4.21Å; I342-L498 HydrophobicContact CD1-CD1 3.74Å; I342-F520 HydrophobicContact CD1-CE1 3.87Å; I342-F520 HydrophobicContact CG2-CD1 4.11Å; I342-A524 HydrophobicContact CG2-CB 4.39Å; I342-F530 HydrophobicContact CD1-CE2 3.87Å; I342-F530 HydrophobicContact CD1-CZ 4.44Å; I342-F530 HydrophobicContact CG1-CE2 4.46Å; I342-F530 HydrophobicContact CG2-CE2 4.24Å; I342-F530 HydrophobicContact CG2-CZ 4.4Å
343	Y	87.3	Confident	80.7	Confident	98 Å²	98	41.6 Å²	41.6	38%	0.384	21%	0.214	S	C	.	.	H	α-helix	trans	-58.1	-42.1	173.7	-89.2	-72.5	0	0	0	112.6	L339 A341 C345 Y346 E347 I350 P519 P521	L339-Y343 VanDerWaalsContact O-CD2 3.28Å; L339-Y343 WeakPolarHBondContact O-CD2 3.39Å; L339-Y343 PolarHBondContact O-N 3.36Å; A341-Y343 PolarHBondContact O-N 3.36Å; Y343-C345 VanDerWaalsContact C-N 3.26Å; Y343-C345 PolarHBondContact O-N 3.01Å; Y343-Y346 PolarHBondContact O-N 3.12Å; Y343-Y346 VanDerWaalsContact O-N 3.1Å; Y343-E347 PolarHBondContact O-N 3.42Å; Y343-I350 HydrophobicContact CD1-CD1 4.29Å; Y343-P519 WeakPolarHBondContact CE2-O 3.28Å; Y343-P519 PolarHBondContact OH-O 3.25Å; Y343-P521 HydrophobicContact CD1-CB 4.35Å; Y343-P521 HydrophobicContact CD1-CG 4.08Å; Y343-P521 HydrophobicContact CE1-CB 4.06Å; Y343-P521 HydrophobicContact CE1-CG 4.09Å
344	S	85.1	Confident	78.8	Confident	60 Å²	60	45.5 Å²	45.5	42%	0.42	24%	0.235	S	C	.	.	H	α-helix	trans	-63.2	-29.3	179.2	75.4	0	0	0	0	113.4	A340 A341 I342 Y346 E347	A340-S344 PolarHBondContact O-N 3.18Å; A340-S344 VanDerWaalsContact O-N 3.1Å; A341-S344 PolarHBondContact O-N 3.27Å; A341-S344 VanDerWaalsContact O-N 3.12Å; A341-S344 PolarHBondContact O-OG 2.85Å; I342-S344 VanDerWaalsContact C-N 3.32Å; I342-S344 PolarHBondContact O-N 3.28Å; S344-Y346 PolarHBondContact O-N 3.48Å; S344-E347 PolarHBondContact O-N 3.05Å
345	C	84.8	Confident	76.6	Confident	13 Å²	13	53.7 Å²	53.7	9%	0.088	28%	0.279	C	S	.	.	H	α-helix	trans	-65	-25.3	174.9	-61.6	0	0	0	0	113.5	A341 I342 Y343 L483 A487 V490	A341-C345 PolarHBondContact O-N 3.26Å; A341-C345 PolarHBondContact O-SG 2.84Å; A341-C345 VanDerWaalsContact O-SG 3.37Å; I342-C345 WeakPolarHBondContact O-CB 3.36Å; I342-C345 PolarHBondContact O-N 3.15Å; Y343-C345 VanDerWaalsContact C-N 3.26Å; Y343-C345 PolarHBondContact O-N 3.01Å; C345-L483 VanDerWaalsContact O-CD2 3.27Å; C345-L483 WeakPolarHBondContact O-CD2 3.25Å; C345-A487 HydrophobicContact CB-CB 4.23Å; C345-A487 PolarHBondContact SG-O 3.2Å; C345-V490 VanDerWaalsContact SG-CG1 3.58Å
346	Y	82.1	Confident	74.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111.1	5.5	-177.7	-62.8	-82.6	0	0	0	113.3	I342 Y343 S344 E348 F349 I350 I481 L483 L491 P521 E523 A524 H527	I342-Y346 HydrophobicContact CG2-CE2 4.43Å; I342-Y346 WeakPolarHBondContact O-CD2 3.39Å; Y343-Y346 PolarHBondContact O-N 3.12Å; Y343-Y346 VanDerWaalsContact O-N 3.1Å; S344-Y346 PolarHBondContact O-N 3.48Å; Y346-E348 VanDerWaalsContact C-N 3.26Å; Y346-E348 PolarHBondContact O-N 3.42Å; Y346-F349 HydrophobicContact CD1-CD2 4.46Å; Y346-F349 PolarHBondContact O-N 2.7Å; Y346-I350 WeakPolarHBondContact O-CG1 3.41Å; Y346-I350 PolarHBondContact O-N 3.23Å; Y346-I481 HydrophobicContact CE1-CG2 4.4Å; Y346-L483 HydrophobicContact CD1-CD2 4.08Å; Y346-L483 HydrophobicContact CE1-CD1 3.98Å; Y346-L483 HydrophobicContact CE1-CD2 3.92Å; Y346-L483 HydrophobicContact CE1-CG 4.2Å; Y346-L491 HydrophobicContact CE2-CD1 4.1Å; Y346-L491 HydrophobicContact CE2-CD2 4.31Å; Y346-L491 VanDerWaalsContact OH-CD2 3.22Å; Y346-L491 WeakPolarHBondContact OH-CD2 3.32Å; Y346-P521 HydrophobicContact CD2-CG 4.08Å; Y346-P521 HydrophobicContact CG-CG 4.32Å; Y346-E523 HydrophobicContact CD1-CB 3.61Å; Y346-E523 HydrophobicContact CE1-CB 4.13Å; Y346-E523 HydrophobicContact CG-CB 4.16Å; Y346-A524 HydrophobicContact CD2-CB 3.96Å; Y346-A524 HydrophobicContact CE2-CB 3.48Å; Y346-A524 VanDerWaalsContact CE2-CB 3.48Å; Y346-H527 WeakPolarHBondContact OH-CB 3.38Å
347	E	79	Confident	71.7	Confident	55 Å²	55	60.2 Å²	60.2	26%	0.257	32%	0.32	S	S	.	.	H	α-helix	trans	-55.7	-38.9	-174.5	-159.3	-174	149.7	0	0	112.1	Y343 S344 N351 R363	Y343-E347 PolarHBondContact O-N 3.42Å; S344-E347 PolarHBondContact O-N 3.05Å; E347-N351 VanDerWaalsContact O-CB 3.25Å; E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 PolarHBondContact O-N 3.11Å; E347-N351 PolarHBondContact O-ND2 3.21Å; E347-N351 VanDerWaalsContact O-ND2 3.08Å; E347-R363 IonicContact OE2-NH1 3.74Å
348	E	66.4	Low	69.5	Low	147 Å²	147	63.2 Å²	63.2	69%	0.687	34%	0.341	S	S	*	.	H	α-helix	trans	-68.3	-34.7	176.9	-62.3	-177.4	167	0	0	113.3	Y346 S352	Y346-E348 VanDerWaalsContact C-N 3.26Å; Y346-E348 PolarHBondContact O-N 3.42Å; E348-S352 WeakPolarHBondContact O-CB 3.39Å; E348-S352 PolarHBondContact O-N 3.15Å; E348-S352 PolarHBondContact O-OG 3.22Å
349	F	66.3	Low	67.1	Low	66 Å²	66	66 Å²	66	29%	0.289	36%	0.355	S	S	.	.	H	α-helix	trans	-76.5	-33.2	177.8	-67.1	-86.7	0	0	0	112.1	Y346 S352 R353 I481 L483 E523	Y346-F349 HydrophobicContact CD1-CD2 4.46Å; Y346-F349 PolarHBondContact O-N 2.7Å; F349-S352 WeakPolarHBondContact CA-OG 3.38Å; F349-S352 PolarHBondContact O-OG 3.46Å; F349-R353 PolarHBondContact O-N 3.03Å; F349-I481 HydrophobicContact CD1-CG2 4.29Å; F349-I481 HydrophobicContact CE1-CG2 3.94Å; F349-I481 HydrophobicContact CE2-CG2 4.31Å; F349-I481 HydrophobicContact CZ-CG2 3.95Å; F349-L483 HydrophobicContact CD2-CD2 4.47Å; F349-L483 HydrophobicContact CE2-CD2 3.94Å; F349-E523 HydrophobicContact CB-CG 4.13Å
350	I	68.3	Low	64.6	Low	25 Å²	25	71.8 Å²	71.8	13%	0.128	38%	0.379	C	S	.	.	H	α-helix	trans	-68.5	-52.6	173.3	-63.6	162.9	0	0	0	109.5	Y343 Y346 S352 R353 D354 L359 P521	Y343-I350 HydrophobicContact CD1-CD1 4.29Å; Y346-I350 WeakPolarHBondContact O-CG1 3.41Å; Y346-I350 PolarHBondContact O-N 3.23Å; I350-S352 PolarHBondContact O-N 2.79Å; I350-S352 VanDerWaalsContact O-N 3.15Å; I350-R353 PolarHBondContact O-N 3.5Å; I350-R353 VanDerWaalsContact O-N 3.12Å; I350-D354 PolarHBondContact O-N 3.4Å; I350-L359 HydrophobicContact CG2-CD1 3.77Å; I350-P521 HydrophobicContact CD1-CB 3.92Å; I350-P521 HydrophobicContact CD1-CG 4.44Å; I350-P521 HydrophobicContact CG1-CB 4.42Å
351	N	65.6	Low	62.3	Low	61 Å²	61	77.6 Å²	77.6	33%	0.326	40%	0.403	S	S	.	.	H	α-helix	trans	-65.5	-15.8	-178.8	-71.6	-28.8	0	0	0	114.6	E347 L359	E347-N351 VanDerWaalsContact O-CB 3.25Å; E347-N351 WeakPolarHBondContact O-CB 3.45Å; E347-N351 PolarHBondContact O-N 3.11Å; E347-N351 PolarHBondContact O-ND2 3.21Å; E347-N351 VanDerWaalsContact O-ND2 3.08Å; N351-L359 WeakPolarHBondContact OD1-CD1 3.42Å
352	S	61.1	Low	60.2	Low	84 Å²	84	84.1 Å²	84.1	59%	0.587	44%	0.436	S	S	*	.	H	α-helix	trans	-93.6	-16.4	175.6	49	0	0	0	0	113.8	E348 F349 I350	E348-S352 WeakPolarHBondContact O-CB 3.39Å; E348-S352 PolarHBondContact O-N 3.15Å; E348-S352 PolarHBondContact O-OG 3.22Å; F349-S352 WeakPolarHBondContact CA-OG 3.38Å; F349-S352 PolarHBondContact O-OG 3.46Å; I350-S352 PolarHBondContact O-N 2.79Å; I350-S352 VanDerWaalsContact O-N 3.15Å
353	R	57.2	Low	57.7	Low	161 Å²	161	93.1 Å²	93.1	61%	0.608	47%	0.47	S	S	*	.	H	α-helix	trans	-85.8	-43	168.1	-76.5	177.4	61.1	165.3	6.6	111.9	F349 I350 N355 E523	F349-R353 PolarHBondContact O-N 3.03Å; I350-R353 PolarHBondContact O-N 3.5Å; I350-R353 VanDerWaalsContact O-N 3.12Å; R353-N355 PolarHBondContact O-N 3.23Å; R353-E523 WeakPolarHBondContact CD-OE1 3.03Å; R353-E523 IonicContact CZ-OE1 3.09Å; R353-E523 IonicContact NE-OE1 3.9Å; R353-E523 IonicContact NH1-OE1 2.75Å; R353-E523 PolarHBondContact NH1-OE1 2.65Å
354	D	50.2	Low	55.2	Low	95 Å²	95	93.2 Å²	93.2	51%	0.508	48%	0.478	S	S	.	.			trans	-88.2	95.8	179.1	-68.1	-27.3	0	0	0	109.7	I350 S356	I350-D354 PolarHBondContact O-N 3.4Å; D354-S356 PolarHBondContact O-N 2.82Å
355	N	43.7	Very low	52.7	Low	172 Å²	172	93.6 Å²	93.6	92%	0.92	49%	0.491	S	S	*	.			trans	-69.5	55.3	168.3	-95.2	-26.2	0	0	0	111.2	R353	R353-N355 PolarHBondContact O-N 3.23Å
356	S	38.3	Very low	50.2	Low	69 Å²	69	99.2 Å²	99.2	48%	0.483	53%	0.529	S	S	.	.	S	Bend	trans	-146.1	132.3	-178.7	-161.5	0	0	0	0	109.7	D354 S358	D354-S356 PolarHBondContact O-N 2.82Å; S356-S358 PolarHBondContact O-N 3.46Å
357	P	38	Very low	47.7	Very low	107 Å²	107	107.2 Å²	107.2	70%	0.695	57%	0.566	S	S	*	*			trans	-79.6	33.2	-167.2	33.6	-37.6	0	0	0	114.6
358	S	41.9	Very low	45.3	Very low	64 Å²	64	113.9 Å²	113.9	45%	0.448	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-96.9	4.2	-159.9	43.2	0	0	0	0	117.2	S356	S356-S358 PolarHBondContact O-N 3.46Å
359	L	41	Very low	43.3	Very low	58 Å²	58	116 Å²	116	30%	0.304	61%	0.607	S	S	.	*	T	Hydrogen-bonded Turn	trans	-104.1	-23.4	169.3	-88.8	161.6	0	0	0	113.8	I350 N351 E361 I362	I350-L359 HydrophobicContact CG2-CD1 3.77Å; N351-L359 WeakPolarHBondContact OD1-CD1 3.42Å; L359-E361 PolarHBondContact O-N 2.9Å; L359-I362 HydrophobicContact CD2-CD1 4.15Å; L359-I362 PolarHBondContact O-N 3.31Å
360	K	37.4	Very low	41.4	Very low	150 Å²	150	120.1 Å²	120.1	65%	0.652	63%	0.632	S	S	*	*	H	α-helix	trans	-63.9	-29.7	172	-77.9	-176.1	177.9	175.4	0	112.4	R363 N364	K360-R363 CarbonylContact O-C 3.41Å; K360-R363 PolarHBondContact O-N 3.48Å; K360-N364 WeakPolarHBondContact O-CB 3.25Å; K360-N364 PolarHBondContact O-N 2.99Å
361	E	40.7	Very low	39.4	Very low	142 Å²	142	126.1 Å²	126.1	66%	0.664	67%	0.665	S	S	*	*	H	α-helix	trans	-70.3	-31.5	178.3	-64	-171.3	151.7	0	0	113.1	L359 R363 N364 G365	L359-E361 PolarHBondContact O-N 2.9Å; E361-R363 PolarHBondContact O-N 3.06Å; E361-N364 PolarHBondContact O-N 3.19Å; E361-G365 WeakPolarHBondContact O-CA 3.49Å; E361-G365 PolarHBondContact O-N 3.27Å
362	I	41.8	Very low	37.5	Very low	139 Å²	139	135.4 Å²	135.4	71%	0.713	70%	0.695	S	S	*	*	H	α-helix	trans	-70.2	-22.3	173.7	-65.4	168.8	0	0	0	111.1	L359	L359-I362 HydrophobicContact CD2-CD1 4.15Å; L359-I362 PolarHBondContact O-N 3.31Å
363	R	36.2	Very low	35.8	Very low	189 Å²	189	141 Å²	141	71%	0.713	71%	0.709	S	S	*	*	H	α-helix	trans	-91.5	-30.3	174.4	-165	168.5	-178.4	159.2	-1.7	113.7	E347 K360 E361	E347-R363 IonicContact OE2-NH1 3.74Å; K360-R363 CarbonylContact O-C 3.41Å; K360-R363 PolarHBondContact O-N 3.48Å; E361-R363 PolarHBondContact O-N 3.06Å
364	N	33.8	Very low	34.3	Very low	101 Å²	101	139.1 Å²	139.1	54%	0.54	72%	0.718	S	S	.	*	H	α-helix	trans	-113	4	-172.2	-69	2.8	0	0	0	115	K360 E361 C366 Q367	K360-N364 WeakPolarHBondContact O-CB 3.25Å; K360-N364 PolarHBondContact O-N 2.99Å; E361-N364 PolarHBondContact O-N 3.19Å; N364-C366 PolarHBondContact O-N 2.93Å; N364-Q367 PolarHBondContact O-N 3.32Å
365	G	32.2	Very low	33.3	Very low	68 Å²	68	140.3 Å²	140.3	70%	0.701	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.2	23.7	179.8	0	0	0	0	0	117	E361	E361-G365 WeakPolarHBondContact O-CA 3.49Å; E361-G365 PolarHBondContact O-N 3.27Å
366	C	33.1	Very low	32.4	Very low	131 Å²	131	140.9 Å²	140.9	89%	0.885	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.5	31.9	174.8	-91.1	0	0	0	0	113	N364	N364-C366 PolarHBondContact O-N 2.93Å
367	Q	30.5	Very low	31.9	Very low	167 Å²	167	143 Å²	143	78%	0.78	74%	0.742	S	S	*	*			trans	-134.3	57.1	175.4	-115.3	170.3	-1.6	0	0	113.9	N364	N364-Q367 PolarHBondContact O-N 3.32Å
368	Q	27.3	Very low	31.7	Very low	195 Å²	195	146.4 Å²	146.4	91%	0.911	75%	0.753	S	S	*	*			trans	-160.4	107.3	150.4	-113.4	166.3	56.5	0	0	111.2
369	Q	25.8	Very low	30.8	Very low	191 Å²	191	155.1 Å²	155.1	89%	0.893	78%	0.777	S	S	*	*			trans	-140.9	98.8	161.7	-118.5	-177	13.3	0	0	109.6
370	N	25	Very low	30.2	Very low	153 Å²	153	159.8 Å²	159.8	82%	0.818	80%	0.801	S	S	*	*			trans	178.1	122.1	155.6	-86.7	-16.8	0	0	0	103.4
371	D	25.9	Very low	29.5	Very low	152 Å²	152	159.3 Å²	159.3	81%	0.813	81%	0.805	S	S	*	*			cis	-126.7	139.1	19.6	-66.8	-64.7	0	0	0	113.5
372	R	27.1	Very low	28.8	Very low	255 Å²	255	163.3 Å²	163.3	96%	0.962	81%	0.814	S	S	*	*			trans	-141.4	129.8	151.1	-76.2	-163.6	172.4	168.6	-1.1	111.6
373	K	23.8	Very low	28.4	Very low	201 Å²	201	162.5 Å²	162.5	87%	0.874	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-64.2	159.1	173.6	-86.6	179	177.3	176.6	0	112
374	P	25.6	Very low	27.8	Very low	123 Å²	123	162.5 Å²	162.5	80%	0.799	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-76.1	157.5	-162.7	30.4	-37.4	0	0	0	114.7
375	P	30.7	Very low	27.6	Very low	120 Å²	120	162.4 Å²	162.4	78%	0.779	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-101.2	152.9	-179.1	38.6	-33.8	0	0	0	114.1
376	M	23.7	Very low	27.4	Very low	184 Å²	184	165.5 Å²	165.5	91%	0.906	84%	0.838	S	S	*	*			trans	-172.7	154.5	158.4	-94.7	-121.8	-151.2	0	0	109.2
377	P	28.5	Very low	27.2	Very low	113 Å²	113	165.6 Å²	165.6	73%	0.734	84%	0.835	S	S	*	*			cis	-127.4	166.5	-49.7	34.4	-18.2	0	0	0	111.9
378	L	33.5	Very low	27.2	Very low	178 Å²	178	163.2 Å²	163.2	93%	0.932	83%	0.834	S	S	*	*			trans	-72	140.9	176.9	-79.6	156.8	0	0	0	112.5
379	R	24.2	Very low	27.5	Very low	248 Å²	248	159.5 Å²	159.5	94%	0.936	83%	0.827	S	S	*	*			trans	-139.7	144.8	158	-139.2	173.3	-170.8	145.6	3.1	111.8
380	L	26.9	Very low	27.8	Very low	156 Å²	156	156.7 Å²	156.7	82%	0.817	83%	0.825	S	S	*	*			trans	-86	163.3	-164.2	-89.7	133	0	0	0	115.1
381	L	23.7	Very low	27.9	Very low	140 Å²	140	155 Å²	155	73%	0.733	83%	0.826	S	S	*	*			trans	94.7	129.1	141	-84.9	154.9	0	0	0	121.8
382	R	25.2	Very low	28	Very low	226 Å²	226	153.6 Å²	153.6	85%	0.853	82%	0.822	S	S	*	*			trans	89.3	134.1	151.8	-70.3	175.8	-178.9	165.8	0.3	119.9
383	P	33.8	Very low	28.2	Very low	121 Å²	121	149.6 Å²	149.6	79%	0.786	82%	0.818	S	S	*	*			trans	-93.6	138.4	167.3	36.4	-30	0	0	0	111.3
384	E	23.8	Very low	28.5	Very low	190 Å²	190	146.8 Å²	146.8	89%	0.888	81%	0.812	S	S	*	*			trans	-160.6	176.1	164.6	-122.2	-174.9	-142.7	0	0	110.5
385	P	30.3	Very low	29.3	Very low	98 Å²	98	145.9 Å²	145.9	64%	0.636	81%	0.806	S	S	*	*				-102.7	173.9	-126.1	31.9	-15.5	0	0	0	115
386	P	28.3	Very low	29.1	Very low	133 Å²	133	148 Å²	148	86%	0.864	81%	0.81	S	S	*	*			trans	-75.9	131.4	-178.2	30.2	-35.2	0	0	0	113.3
387	T	27.7	Very low	29.4	Very low	133 Å²	133	144.3 Å²	144.3	82%	0.816	80%	0.803	S	S	*	*			trans	-107.4	156.2	170.8	45.6	0	0	0	0	112.1
388	P	30.8	Very low	29.4	Very low	118 Å²	118	144.1 Å²	144.1	77%	0.766	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-87	169.3	-158.4	34.9	-37.9	0	0	0	115.6
389	P	33.5	Very low	29.1	Very low	117 Å²	117	140.1 Å²	140.1	76%	0.76	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-71.6	163.2	173.6	30.8	-36.2	0	0	0	113.4
390	P	31.8	Very low	30.1	Very low	131 Å²	131	134.4 Å²	134.4	85%	0.851	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-81.9	170.6	-164.7	32.9	-37.2	0	0	0	115.9
391	S	27.5	Very low	30.1	Very low	119 Å²	119	135.6 Å²	135.6	83%	0.832	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-73.4	151.7	-161.5	45.8	0	0	0	0	117.9
392	T	28.1	Very low	31.1	Very low	122 Å²	122	133.7 Å²	133.7	75%	0.748	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-67.6	150.4	-178.1	-23.7	0	0	0	0	115.5	L394	T392-L394 HydrophobicContact CG2-CD2 4.47Å
393	I	31.5	Very low	31.3	Very low	170 Å²	170	128.2 Å²	128.2	87%	0.872	79%	0.785	S	S	*	*			trans	-117.9	138	151.6	-62.8	178.6	0	0	0	107.7
394	L	29.7	Very low	32	Very low	142 Å²	142	127.9 Å²	127.9	74%	0.743	78%	0.783	S	S	*	*			trans	-97.1	-174.9	-168.4	-64.9	167	0	0	0	111.9	T392	T392-L394 HydrophobicContact CG2-CD2 4.47Å
395	P	41.9	Very low	33.1	Very low	104 Å²	104	124.7 Å²	124.7	68%	0.675	78%	0.779	S	S	*	*				-133.2	-179.8	-62.8	39.8	-25	0	0	0	112
396	L	27	Very low	33.1	Very low	164 Å²	164	124.2 Å²	124.2	86%	0.859	78%	0.783	S	S	*	*			trans	162.7	121.3	137	-90.5	154.4	0	0	0	113.8
397	S	28.9	Very low	34.1	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	78%	0.78	S	S	*	*			trans	64.4	140.1	140.3	-140.4	0	0	0	0	120.2
398	S	29.1	Very low	34.1	Very low	109 Å²	109	122.2 Å²	122.2	76%	0.762	78%	0.781	S	S	*	*			cis	-160.9	160.9	-5.3	20.8	0	0	0	0	109.8
399	A	27.8	Very low	34.1	Very low	94 Å²	94	124.1 Å²	124.1	78%	0.777	79%	0.785	S	S	*	*			trans	-72.6	-179.9	179.3	0	0	0	0	0	113.3
400	P	43.9	Very low	34.7	Very low	127 Å²	127	124 Å²	124	83%	0.825	78%	0.784	S	S	*	*			cis	-141.3	-166.9	12.5	41.6	-19.3	0	0	0	118
401	Q	27.2	Very low	34.5	Very low	181 Å²	181	122.7 Å²	122.7	85%	0.846	78%	0.784	S	S	*	*			trans	-76.5	-162.7	-178.9	-52.2	-169.1	-38.1	0	0	113.8
402	P	44.4	Very low	34.5	Very low	100 Å²	100	121.4 Å²	121.4	65%	0.649	78%	0.78	S	S	*	*			cis	-150.2	147.3	2.1	39.5	-16	0	0	0	122
403	S	29.2	Very low	35.3	Very low	112 Å²	112	121.2 Å²	121.2	78%	0.783	78%	0.781	S	S	*	*			trans	72.8	-175.4	130.3	86.3	0	0	0	0	121
404	P	50.3	Low	35.1	Very low	113 Å²	113	119 Å²	119	73%	0.734	78%	0.781	S	S	*	*				-123.6	-149.8	-129.8	39.8	-14.9	0	0	0	112.2
405	P	47.1	Very low	35	Very low	124 Å²	124	120 Å²	120	81%	0.805	79%	0.785	S	S	*	*			cis	-134.8	-164.2	-7.4	41.6	-20.3	0	0	0	115.8
406	A	30.1	Very low	35	Very low	87 Å²	87	120 Å²	120	72%	0.719	79%	0.786	S	S	*	*			trans	-71.4	-175.6	175.3	0	0	0	0	0	113.2
407	P	47.9	Very low	34.9	Very low	124 Å²	124	119.6 Å²	119.6	81%	0.805	78%	0.783	S	S	*	*			cis	-150.4	-167.5	22.3	44	-21.1	0	0	0	118.9
408	A	28.6	Very low	34.7	Very low	100 Å²	100	120.3 Å²	120.3	83%	0.826	79%	0.786	S	S	*	*			trans	104.4	138.2	146.8	0	0	0	0	0	122.1
409	N	29.9	Very low	34.6	Very low	159 Å²	159	120.2 Å²	120.2	85%	0.85	79%	0.785	S	S	*	*			trans	-81	-175	173.8	-110	-11.7	0	0	0	111.4
410	P	45.8	Very low	35.2	Very low	115 Å²	115	121.1 Å²	121.1	75%	0.747	78%	0.784	S	S	*	*			cis	-138.9	-169.4	5.3	34.3	-11	0	0	0	116.5
411	A	28.8	Very low	34.3	Very low	102 Å²	102	121.3 Å²	121.3	84%	0.843	78%	0.782	S	S	*	*			trans	102.2	133.9	143.5	0	0	0	0	0	121.1
412	A	26.6	Very low	35.2	Very low	92 Å²	92	118 Å²	118	76%	0.76	78%	0.777	S	S	*	*			trans	-102.4	-165.9	168.3	0	0	0	0	0	108.9
413	P	45.2	Very low	34.2	Very low	118 Å²	118	119.1 Å²	119.1	77%	0.766	79%	0.785	S	S	*	*			cis	-135.6	175.7	-5.9	42.6	-26.5	0	0	0	114.7
414	S	27.2	Very low	34	Very low	125 Å²	125	121.6 Å²	121.6	87%	0.874	79%	0.789	S	S	*	*			trans	177.4	155.8	139.6	35	0	0	0	0	114.7
415	I	27.3	Very low	33.5	Very low	162 Å²	162	121.3 Å²	121.3	83%	0.831	79%	0.787	S	S	*	*			trans	-143.7	129	-174.4	-68.5	166.9	0	0	0	104.4
416	P	42.8	Very low	32.5	Very low	105 Å²	105	123.2 Å²	123.2	68%	0.682	79%	0.789	S	S	*	*				-162.3	157.3	88.9	43.8	-23.2	0	0	0	120.8
417	I	25.5	Very low	32.3	Very low	155 Å²	155	124 Å²	124	80%	0.795	79%	0.79	S	S	*	*			trans	80.9	140.3	131.7	-74	166.7	0	0	0	123.5
418	C	22.9	Very low	32	Very low	122 Å²	122	123.6 Å²	123.6	82%	0.824	79%	0.787	S	S	*	*			trans	101.9	119.3	150.9	-96.1	0	0	0	0	123
419	S	27	Very low	32.8	Very low	107 Å²	107	124.2 Å²	124.2	75%	0.748	78%	0.783	S	S	*	*			trans	-83.9	-175.9	163.8	62.6	0	0	0	0	110.2
420	P	42.1	Very low	33.2	Very low	114 Å²	114	122.1 Å²	122.1	74%	0.74	78%	0.778	S	S	*	*			cis	-150.1	-177.2	40	41	-16.4	0	0	0	120.3
421	T	24.2	Very low	32.1	Very low	130 Å²	130	121.4 Å²	121.4	80%	0.798	78%	0.776	S	S	*	*			trans	-46	178.3	166.1	41	0	0	0	0	117.4
422	P	45.2	Very low	31.9	Very low	112 Å²	112	124.1 Å²	124.1	73%	0.727	77%	0.774	S	S	*	*			cis	-140.3	-179.2	28.2	36.8	-11.2	0	0	0	116.4
423	C	24.2	Very low	31.7	Very low	123 Å²	123	125.2 Å²	125.2	83%	0.831	77%	0.771	S	S	*	*				-168.3	168.5	63.2	-110.1	0	0	0	0	116
424	L	24.7	Very low	30.6	Very low	165 Å²	165	126.8 Å²	126.8	86%	0.864	77%	0.773	S	S	*	*			trans	-95.1	-165.3	-170.4	-70.6	158.7	0	0	0	113.2
425	P	39.5	Very low	30.3	Very low	106 Å²	106	125.2 Å²	125.2	69%	0.688	76%	0.762	S	S	*	*			cis	-129.4	177	-4.5	29.3	-3.7	0	0	0	114.2
426	L	26.6	Very low	30.1	Very low	164 Å²	164	122.3 Å²	122.3	86%	0.859	76%	0.757	S	S	*	*				-168.5	166.2	66.5	-95.6	166.5	0	0	0	112.5
427	S	27.2	Very low	29.1	Very low	103 Å²	103	126 Å²	126	72%	0.72	76%	0.764	S	S	*	*			trans	-147.9	-167.1	-163.1	-32.1	0	0	0	0	111.1
428	P	41.1	Very low	29	Very low	116 Å²	116	125.6 Å²	125.6	75%	0.753	76%	0.762	S	S	*	*				-133.7	-132.7	-62.2	33.5	-9.5	0	0	0	112.8
429	P	46.1	Very low	28.8	Very low	113 Å²	113	127.1 Å²	127.1	73%	0.734	76%	0.761	S	S	*	*				-112.6	-116.4	-93.3	38.2	-16.3	0	0	0	110.6
430	P	37.5	Very low	28.5	Very low	116 Å²	116	127.2 Å²	127.2	75%	0.753	76%	0.757	S	S	*	*			cis	-97.8	-177.9	-10.6	15.6	8.5	0	0	0	112.8
431	S	22.5	Very low	27.5	Very low	100 Å²	100	129.5 Å²	129.5	70%	0.699	76%	0.758	S	S	*	*			cis	-155.8	126.4	-8.7	31.5	0	0	0	0	111.7
432	I	25.1	Very low	27.3	Very low	159 Å²	159	130.4 Å²	130.4	82%	0.815	76%	0.758	S	S	*	*				41	139.2	128	-51.9	174.2	0	0	0	119.2
433	V	22	Very low	26.2	Very low	114 Å²	114	131.8 Å²	131.8	69%	0.691	75%	0.754	S	S	*	*			cis	164.4	140	-31.7	146	0	0	0	0	107.1
434	N	21.1	Very low	26.2	Very low	151 Å²	151	135 Å²	135	81%	0.807	75%	0.749	S	S	*	*			trans	-175.8	108.9	137.7	-97.9	-7.2	0	0	0	113.5
435	S	22.6	Very low	26.1	Very low	93 Å²	93	133.4 Å²	133.4	65%	0.65	74%	0.741	S	S	*	*			trans	30.6	118.1	135.9	-44.9	0	0	0	0	122.9
436	S	23.1	Very low	25.4	Very low	101 Å²	101	135 Å²	135	71%	0.706	74%	0.744	S	S	*	*				29.9	155.1	108.9	52.2	0	0	0	0	121
437	E	21.5	Very low	25.3	Very low	181 Å²	181	134 Å²	134	85%	0.846	74%	0.739	S	S	*	*			cis	-154.4	-152.3	14.3	-139.3	158.1	-142.7	0	0	113.5
438	I	22.5	Very low	25.3	Very low	147 Å²	147	135.3 Å²	135.3	75%	0.754	74%	0.743	S	S	*	*			trans	-117.4	148.8	-154.2	-62.7	157.8	0	0	0	114
439	L	19.4	Very low	24.5	Very low	154 Å²	154	134.8 Å²	134.8	81%	0.806	75%	0.749	S	S	*	*			trans	94.2	147.2	148.2	-131.8	72.6	0	0	0	122.9
440	V	20.1	Very low	23.6	Very low	109 Å²	109	137.5 Å²	137.5	66%	0.661	76%	0.757	S	S	*	*			trans	83.6	140.7	157.6	-166.8	0	0	0	0	120.4
441	E	20.7	Very low	23.2	Very low	162 Å²	162	135.7 Å²	135.7	76%	0.757	75%	0.752	S	S	*	*			trans	-35.9	152.1	169.1	-48.4	162.3	130	0	0	116.4
442	L	21.4	Very low	23.4	Very low	150 Å²	150	141.2 Å²	141.2	79%	0.785	76%	0.763	S	S	*	*				-177.3	169.9	96.4	-108.2	135.9	0	0	0	114.1
443	E	22.1	Very low	23.6	Very low	140 Å²	140	145.1 Å²	145.1	65%	0.654	77%	0.767	S	S	*	*			trans	-68.7	177.6	-177.3	-50.8	173.8	125.9	0	0	115.3
444	R	23.5	Very low	23.9	Very low	192 Å²	192	150 Å²	150	73%	0.725	78%	0.78	S	S	*	*			trans	93.9	119.2	147.7	-79.3	-176.8	171.3	90.4	1.5	120.3
445	N	22.1	Very low	24	Very low	130 Å²	130	146.5 Å²	146.5	70%	0.695	78%	0.779	S	S	*	*			trans	72.8	117.4	130.1	-64.6	3.3	0	0	0	120.7
446	N	25.6	Very low	24	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	79%	0.786	S	S	*	*				30.2	111.2	128.6	-60.3	1.6	0	0	0	117.7
447	N	24.3	Very low	24.8	Very low	142 Å²	142	146.9 Å²	146.9	76%	0.759	79%	0.791	S	S	*	*				-176.4	157.8	95.2	-98.5	-25	0	0	0	114.5
448	T	28.2	Very low	25.1	Very low	132 Å²	132	143.4 Å²	143.4	81%	0.81	79%	0.793	S	S	*	*			trans	49.5	98.4	151.4	54.8	0	0	0	0	119.5
449	A	23.4	Very low	25.3	Very low	105 Å²	105	140.5 Å²	140.5	87%	0.868	80%	0.799	S	S	*	*			trans	-161.3	109.2	135.2	0	0	0	0	0	110.6
450	N	27.4	Very low	25.6	Very low	170 Å²	170	136.9 Å²	136.9	91%	0.909	80%	0.799	S	S	*	*			trans	-128.2	152.3	161.8	-147.5	-5.8	0	0	0	110.7
451	A	29.4	Very low	26.2	Very low	77 Å²	77	139.8 Å²	139.8	64%	0.636	81%	0.811	S	S	*	*			trans	-47.6	144.3	-155.3	0	0	0	0	0	119.7	R453	A451-R453 PolarHBondContact O-N 2.94Å
452	K	26.9	Very low	26.7	Very low	216 Å²	216	137.6 Å²	137.6	94%	0.939	81%	0.813	S	S	*	*			trans	-68.4	108.1	150.5	-102.8	-179.8	175.5	173	0	110
453	R	28.5	Very low	27.3	Very low	241 Å²	241	139.2 Å²	139.2	91%	0.909	82%	0.817	S	S	*	*			trans	-139.2	155.2	153.4	-77.9	-164	173.8	-176.9	-0.6	110.9	A451	A451-R453 PolarHBondContact O-N 2.94Å
454	K	27.7	Very low	27.9	Very low	218 Å²	218	137 Å²	137	95%	0.948	82%	0.815	S	S	*	*			trans	-80.2	132.8	-162.2	-68.4	172.7	169.3	179.3	0	114.5
455	G	24.5	Very low	28.6	Very low	77 Å²	77	133.1 Å²	133.1	79%	0.794	81%	0.808	S	S	*	*				85.4	71.1	111.6	0	0	0	0	0	122.6
456	G	22.6	Very low	29.8	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	80%	0.804	S	S	*	*			trans	56.1	176.3	138.8	0	0	0	0	0	122.7
457	P	38.4	Very low	31	Very low	125 Å²	125	127.9 Å²	127.9	81%	0.812	78%	0.779	S	S	*	*			cis	-128.8	160.4	-6.5	40.2	-25.1	0	0	0	116.7
458	A	28.3	Very low	31.8	Very low	108 Å²	108	125 Å²	125	89%	0.893	76%	0.764	S	S	*	*			trans	65	120.3	150.8	0	0	0	0	0	122.1
459	G	25.9	Very low	32.7	Very low	85 Å²	85	122.2 Å²	122.2	88%	0.876	75%	0.749	S	S	*	*			trans	145.2	96.8	147.1	0	0	0	0	0	117.4
460	G	27.5	Very low	33.6	Very low	79 Å²	79	119.8 Å²	119.8	81%	0.814	72%	0.721	S	S	*	*			trans	95.3	107	157.5	0	0	0	0	0	116.8
461	D	32.2	Very low	34.3	Very low	170 Å²	170	115.7 Å²	115.7	91%	0.909	70%	0.699	S	S	*	*			trans	-74.5	124	169.2	-71.2	-53.9	0	0	0	111.3
462	S	31.1	Very low	34.8	Very low	115 Å²	115	117.1 Å²	117.1	80%	0.804	70%	0.699	S	S	*	*			trans	-156.3	115	158.3	-69.5	0	0	0	0	106.6
463	E	33.7	Very low	35	Very low	184 Å²	184	109.8 Å²	109.8	86%	0.86	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-58.9	136.3	171.8	-69.6	-175.8	126.2	0	0	109	N465	E463-N465 PolarHBondContact O-N 3.19Å
464	P	34.7	Very low	35.2	Very low	95 Å²	95	103 Å²	103	62%	0.617	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-63.5	127.6	176.7	26.8	-33	0	0	0	108.8
465	N	38.8	Very low	35.3	Very low	109 Å²	109	97.3 Å²	97.3	58%	0.583	66%	0.656	S	S	*	*	P	Polyproline II helix	trans	-62.7	145.4	-180	-79.8	-61	0	0	0	109.3	E463 I467 D468 C469	E463-N465 PolarHBondContact O-N 3.19Å; N465-I467 HydrophobicContact CB-CB 4.45Å; N465-I467 PolarHBondContact O-N 2.92Å; N465-D468 PolarHBondContact N-OD2 3.28Å; N465-D468 WeakPolarHBondContact O-CB 3.49Å; N465-D468 PolarHBondContact O-N 2.91Å; N465-C469 PolarHBondContact O-N 3.44Å
466	L	46.8	Very low	35.8	Very low	113 Å²	113	98.2 Å²	98.2	59%	0.592	64%	0.642	S	S	*	*	H	α-helix	trans	-57.9	-23.2	177.5	-168.6	65.4	0	0	0	112.4	C469 L470	L466-C469 HydrophobicContact CD1-CB 4.47Å; L466-C469 PolarHBondContact O-N 2.78Å; L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 2.65Å
467	I	49.8	Very low	36.2	Very low	47 Å²	47	102.4 Å²	102.4	24%	0.241	65%	0.646	C	S	.	*	H	α-helix	trans	-62.6	-45.2	171.2	-62.3	174	0	0	0	111.2	N465 C469 L470 L471 L615	N465-I467 HydrophobicContact CB-CB 4.45Å; N465-I467 PolarHBondContact O-N 2.92Å; I467-C469 VanDerWaalsContact C-N 3.31Å; I467-C469 PolarHBondContact O-N 3.27Å; I467-L470 PolarHBondContact O-N 3.44Å; I467-L471 HydrophobicContact CG2-CD1 4.07Å; I467-L471 WeakPolarHBondContact O-CG 3.44Å; I467-L471 PolarHBondContact O-N 2.88Å; I467-L615 HydrophobicContact CG2-CD1 4.09Å; I467-L615 HydrophobicContact CG2-CD2 4.17Å
468	D	42.7	Very low	36.3	Very low	82 Å²	82	101.3 Å²	101.3	44%	0.439	64%	0.638	S	S	.	*	H	α-helix	trans	-64.3	-38.7	176.7	-58.7	-47.9	0	0	0	110.9	N465 L470 L471 V472	N465-D468 PolarHBondContact N-OD2 3.28Å; N465-D468 WeakPolarHBondContact O-CB 3.49Å; N465-D468 PolarHBondContact O-N 2.91Å; D468-L470 VanDerWaalsContact C-N 3.31Å; D468-L470 PolarHBondContact O-N 3.44Å; D468-L471 PolarHBondContact O-N 3.27Å; D468-V472 PolarHBondContact O-N 3.11Å
469	C	47.5	Very low	36.9	Very low	74 Å²	74	103.4 Å²	103.4	50%	0.5	63%	0.633	S	S	.	*	H	α-helix	trans	-66	-29.2	174.9	-67.6	0	0	0	0	113.6	N465 L466 I467	N465-C469 PolarHBondContact O-N 3.44Å; L466-C469 HydrophobicContact CD1-CB 4.47Å; L466-C469 PolarHBondContact O-N 2.78Å; I467-C469 VanDerWaalsContact C-N 3.31Å; I467-C469 PolarHBondContact O-N 3.27Å
470	L	40.5	Very low	38.2	Very low	54 Å²	54	103.9 Å²	103.9	28%	0.283	62%	0.623	S	S	.	*	H	α-helix	trans	-76.5	-37	173.4	-74.3	167.4	0	0	0	111.7	L466 I467 D468 V472 L612 L615	L466-L470 WeakPolarHBondContact O-CG 3.29Å; L466-L470 PolarHBondContact O-N 2.65Å; I467-L470 PolarHBondContact O-N 3.44Å; D468-L470 VanDerWaalsContact C-N 3.31Å; D468-L470 PolarHBondContact O-N 3.44Å; L470-V472 VanDerWaalsContact C-N 3.26Å; L470-V472 PolarHBondContact O-N 2.9Å; L470-L612 HydrophobicContact CB-CD1 4.14Å; L470-L612 WeakPolarHBondContact O-CD1 3.33Å; L470-L615 HydrophobicContact CB-CD1 4.5Å; L470-L615 HydrophobicContact CD1-CD1 4.18Å
471	L	43.3	Very low	39.9	Very low	84 Å²	84	101.9 Å²	101.9	44%	0.44	59%	0.593	S	S	.	*	H	α-helix	trans	-71	-16.6	-178	-70.4	170	0	0	0	114	I467 D468 S473	I467-L471 HydrophobicContact CG2-CD1 4.07Å; I467-L471 WeakPolarHBondContact O-CG 3.44Å; I467-L471 PolarHBondContact O-N 2.88Å; D468-L471 PolarHBondContact O-N 3.27Å; L471-S473 PolarHBondContact O-N 3.39Å
472	V	39.9	Very low	41.6	Very low	106 Å²	106	101.6 Å²	101.6	64%	0.642	59%	0.587	S	S	*	*	S	Bend	trans	-77.1	98	170.5	178.9	0	0	0	0	109.8	D468 L470	D468-V472 PolarHBondContact O-N 3.11Å; L470-V472 VanDerWaalsContact C-N 3.26Å; L470-V472 PolarHBondContact O-N 2.9Å
473	S	30.8	Very low	43.7	Very low	63 Å²	63	97.2 Å²	97.2	44%	0.441	55%	0.554	S	S	.	*			trans	-52.7	123.8	171	-65.1	0	0	0	0	110.4	L471 A475 R616	L471-S473 PolarHBondContact O-N 3.39Å; S473-A475 PolarHBondContact O-N 3.26Å; S473-R616 PolarHBondContact OG-NH2 2.99Å
474	P	32.3	Very low	46	Very low	98 Å²	98	91.8 Å²	91.8	64%	0.636	53%	0.534	S	S	*	.			trans	-66.8	113.7	176.6	26.6	-32.5	0	0	0	108.7	L476	P474-L476 VanDerWaalsContact C-N 3.31Å; P474-L476 PolarHBondContact O-N 2.95Å
475	A	29.5	Very low	48.2	Very low	98 Å²	98	90.9 Å²	90.9	81%	0.81	54%	0.535	S	S	*	.			trans	-63.6	93.5	173.7	0	0	0	0	0	109.3	S473 N477	S473-A475 PolarHBondContact O-N 3.26Å; A475-N477 PolarHBondContact O-N 3.23Å; A475-N477 VanDerWaalsContact O-N 3.09Å
476	L	36.4	Very low	50.2	Low	97 Å²	97	90.3 Å²	90.3	51%	0.508	53%	0.529	S	S	.	.			trans	-62.1	111.3	176.2	-93.9	155	0	0	0	108.9	P474 T478	P474-L476 VanDerWaalsContact C-N 3.31Å; P474-L476 PolarHBondContact O-N 2.95Å; L476-T478 PolarHBondContact O-N 3.06Å
477	N	31.3	Very low	51.8	Low	164 Å²	164	85.8 Å²	85.8	88%	0.877	51%	0.508	S	S	*	.			trans	-63	82.5	161.8	-85.4	-23.7	0	0	0	108.4	A475 L479	A475-N477 PolarHBondContact O-N 3.23Å; A475-N477 VanDerWaalsContact O-N 3.09Å; N477-L479 PolarHBondContact O-N 3.22Å; N477-L479 VanDerWaalsContact O-N 3.15Å
478	T	39.6	Very low	53.5	Low	102 Å²	102	85.7 Å²	85.7	63%	0.626	51%	0.508	S	S	*	.			trans	-66.2	111.7	170.8	39.4	0	0	0	0	108	L476 S480	L476-T478 PolarHBondContact O-N 3.06Å; T478-S480 VanDerWaalsContact C-N 3.29Å; T478-S480 PolarHBondContact O-N 3.4Å
479	L	41.3	Very low	55.5	Low	153 Å²	153	88.7 Å²	88.7	80%	0.801	51%	0.513	S	S	*	.			trans	-59.8	98.1	161.4	-83	159.2	0	0	0	106.8	N477 I481	N477-L479 PolarHBondContact O-N 3.22Å; N477-L479 VanDerWaalsContact O-N 3.15Å; L479-I481 VanDerWaalsContact C-N 3.33Å; L479-I481 PolarHBondContact O-N 3.22Å
480	S	52.1	Low	57.4	Low	94 Å²	94	86 Å²	86	66%	0.657	49%	0.494	S	S	*	.			trans	-72.3	89.3	-177.9	45.9	0	0	0	0	109.6	T478 Q482	T478-S480 VanDerWaalsContact C-N 3.29Å; T478-S480 PolarHBondContact O-N 3.4Å; S480-Q482 PolarHBondContact O-N 3.18Å
481	I	63.5	Low	59.6	Low	37 Å²	37	83.5 Å²	83.5	19%	0.19	48%	0.481	C	S	.	.			trans	-63	99.6	173.4	-60	172.7	0	0	0	107.7	Y346 F349 L479 L483 E523 A526 H527	Y346-I481 HydrophobicContact CE1-CG2 4.4Å; F349-I481 HydrophobicContact CD1-CG2 4.29Å; F349-I481 HydrophobicContact CE1-CG2 3.94Å; F349-I481 HydrophobicContact CE2-CG2 4.31Å; F349-I481 HydrophobicContact CZ-CG2 3.95Å; L479-I481 VanDerWaalsContact C-N 3.33Å; L479-I481 PolarHBondContact O-N 3.22Å; I481-L483 PolarHBondContact O-N 3.29Å; I481-E523 HydrophobicContact CD1-CB 4.03Å; I481-E523 HydrophobicContact CD1-CG 4.43Å; I481-A526 HydrophobicContact CD1-CB 4.18Å; I481-H527 PolarHBondContact O-CD2 3.21Å
482	Q	67.9	Low	61.7	Low	165 Å²	165	80.2 Å²	80.2	77%	0.771	47%	0.468	S	S	*	.			trans	-81.8	107.1	175.7	-68.8	-175.1	-3.8	0	0	109.3	S480	S480-Q482 PolarHBondContact O-N 3.18Å
483	L	75.9	Confident	64.1	Low	22 Å²	22	75.3 Å²	75.3	12%	0.115	44%	0.438	C	S	.	.			trans	-76.1	149.4	172.5	-75.7	169	0	0	0	111.4	C345 Y346 F349 I481 A487 D488 L491	C345-L483 VanDerWaalsContact O-CD2 3.27Å; C345-L483 WeakPolarHBondContact O-CD2 3.25Å; Y346-L483 HydrophobicContact CD1-CD2 4.08Å; Y346-L483 HydrophobicContact CE1-CD1 3.98Å; Y346-L483 HydrophobicContact CE1-CD2 3.92Å; Y346-L483 HydrophobicContact CE1-CG 4.2Å; F349-L483 HydrophobicContact CD2-CD2 4.47Å; F349-L483 HydrophobicContact CE2-CD2 3.94Å; I481-L483 PolarHBondContact O-N 3.29Å; L483-A487 HydrophobicContact CB-CB 4.31Å; L483-A487 HydrophobicContact CD2-CB 4.24Å; L483-D488 HydrophobicContact CB-CB 4.37Å; L483-L491 HydrophobicContact CD1-CD2 3.47Å; L483-L491 VanDerWaalsContact CD1-CD2 3.47Å
484	P	81.3	Confident	67	Low	70 Å²	70	72.3 Å²	72.3	46%	0.455	42%	0.417	S	S	.	.			trans	-54.2	143	165.5	-24.4	33.8	0	0	0	111.3	Q486 A487 D488	P484-Q486 PolarHBondContact O-N 3.45Å; P484-A487 HydrophobicContact CB-CB 4.42Å; P484-A487 WeakPolarHBondContact O-CA 3.44Å; P484-A487 WeakPolarHBondContact O-CB 3.46Å; P484-A487 PolarHBondContact O-N 2.88Å; P484-D488 PolarHBondContact O-N 3.02Å
485	A	80.1	Confident	69.7	Low	77 Å²	77	67.9 Å²	67.9	64%	0.636	39%	0.389	S	S	*	.	H	α-helix	trans	-55.6	-29.4	-175.9	0	0	0	0	0	114	R489	A485-R489 WeakPolarHBondContact O-CG 3.21Å; A485-R489 PolarHBondContact O-N 3.26Å
486	Q	81.1	Confident	72.7	Confident	97 Å²	97	65.8 Å²	65.8	45%	0.453	36%	0.363	S	S	.	.	H	α-helix	trans	-69.5	-44.9	172.4	-172.6	62.4	10.3	0	0	112.1	P484 D488 R489 V490	P484-Q486 PolarHBondContact O-N 3.45Å; Q486-D488 PolarHBondContact O-N 3.43Å; Q486-R489 PolarHBondContact O-N 3.49Å; Q486-V490 WeakPolarHBondContact O-CG2 3.34Å; Q486-V490 PolarHBondContact O-N 2.85Å
487	A	81.8	Confident	75.3	Confident	17 Å²	17	61.2 Å²	61.2	14%	0.14	34%	0.34	C	S	.	.	H	α-helix	trans	-65.3	-37.7	178.3	0	0	0	0	0	111.7	C345 L483 P484 R489 V490 L491	C345-A487 HydrophobicContact CB-CB 4.23Å; C345-A487 PolarHBondContact SG-O 3.2Å; L483-A487 HydrophobicContact CB-CB 4.31Å; L483-A487 HydrophobicContact CD2-CB 4.24Å; P484-A487 HydrophobicContact CB-CB 4.42Å; P484-A487 WeakPolarHBondContact O-CA 3.44Å; P484-A487 WeakPolarHBondContact O-CB 3.46Å; P484-A487 PolarHBondContact O-N 2.88Å; A487-R489 PolarHBondContact O-N 3.35Å; A487-V490 PolarHBondContact O-N 2.94Å; A487-L491 VanDerWaalsContact O-CB 3.23Å; A487-L491 WeakPolarHBondContact O-CB 3.39Å; A487-L491 PolarHBondContact O-N 3.06Å
488	D	84.1	Confident	78.2	Confident	45 Å²	45	53.5 Å²	53.5	24%	0.241	30%	0.298	C	S	.	.	H	α-helix	trans	-66.4	-34.1	174.9	-179.4	53.5	0	0	0	113.3	L483 P484 Q486 G492 H527 K529	L483-D488 HydrophobicContact CB-CB 4.37Å; P484-D488 PolarHBondContact O-N 3.02Å; Q486-D488 PolarHBondContact O-N 3.43Å; D488-G492 PolarHBondContact O-N 3.46Å; D488-H527 IonicContact OD1-CE1 3.72Å; D488-K529 PolarHBondContact O-NZ 3.05Å; D488-K529 WeakPolarHBondContact OD1-CD 3.47Å; D488-K529 IonicContact OD1-NZ 2.78Å; D488-K529 PolarHBondContact OD1-NZ 3.37Å; D488-K529 IonicContact OD2-NZ 2.69Å; D488-K529 PolarHBondContact OD2-NZ 3.34Å
489	R	84.9	Confident	80.7	Confident	145 Å²	145	51.2 Å²	51.2	55%	0.547	28%	0.28	S	S	.	.	H	α-helix	trans	-66.8	-44.6	171.8	-75.2	-168.7	-66.3	-168.8	2.6	112.1	A485 Q486 A487 G492 C493	A485-R489 WeakPolarHBondContact O-CG 3.21Å; A485-R489 PolarHBondContact O-N 3.26Å; Q486-R489 PolarHBondContact O-N 3.49Å; A487-R489 PolarHBondContact O-N 3.35Å; R489-G492 PolarHBondContact O-N 3.49Å; R489-C493 WeakPolarHBondContact O-CB 3.44Å; R489-C493 PolarHBondContact O-N 3.03Å
490	V	87.1	Confident	83	Confident	17 Å²	17	45 Å²	45	10%	0.103	25%	0.246	C	C	.	.	H	α-helix	trans	-61.1	-51	176	172.9	0	0	0	0	110.4	L299 A341 C345 Q486 A487 G492 C493 F494	L299-V490 HydrophobicContact CD1-CG2 3.88Å; L299-V490 HydrophobicContact CD2-CB 4.43Å; L299-V490 HydrophobicContact CD2-CG2 3.98Å; A341-V490 HydrophobicContact CB-CG1 4.41Å; C345-V490 VanDerWaalsContact SG-CG1 3.58Å; Q486-V490 WeakPolarHBondContact O-CG2 3.34Å; Q486-V490 PolarHBondContact O-N 2.85Å; A487-V490 PolarHBondContact O-N 2.94Å; V490-G492 PolarHBondContact O-N 3.45Å; V490-C493 PolarHBondContact O-N 3.31Å; V490-F494 HydrophobicContact CG1-CD2 3.78Å; V490-F494 HydrophobicContact CG1-CE2 3.9Å; V490-F494 VanDerWaalsContact O-CD2 3.29Å; V490-F494 WeakPolarHBondContact O-CD2 3.37Å; V490-F494 PolarHBondContact O-N 2.76Å
491	L	88	Confident	84.8	Confident	3 Å²	3	40.5 Å²	40.5	2%	0.016	22%	0.215	C	C	.	.	H	α-helix	trans	-55.6	-47.9	177.5	179.9	64.1	0	0	0	112	I342 Y346 L483 A487 C493 A495 H527 F530	I342-L491 HydrophobicContact CG1-CD1 4.16Å; I342-L491 HydrophobicContact CG2-CD1 4Å; Y346-L491 HydrophobicContact CE2-CD1 4.1Å; Y346-L491 HydrophobicContact CE2-CD2 4.31Å; Y346-L491 VanDerWaalsContact OH-CD2 3.22Å; Y346-L491 WeakPolarHBondContact OH-CD2 3.32Å; L483-L491 HydrophobicContact CD1-CD2 3.47Å; L483-L491 VanDerWaalsContact CD1-CD2 3.47Å; A487-L491 VanDerWaalsContact O-CB 3.23Å; A487-L491 WeakPolarHBondContact O-CB 3.39Å; A487-L491 PolarHBondContact O-N 3.06Å; L491-C493 PolarHBondContact O-N 3.35Å; L491-A495 WeakPolarHBondContact O-CB 3.19Å; L491-A495 PolarHBondContact O-N 3.24Å; L491-H527 WeakPolarHBondContact CD2-ND1 3.43Å; L491-F530 HydrophobicContact CD1-CB 4.34Å; L491-F530 HydrophobicContact CD1-CD2 3.63Å; L491-F530 HydrophobicContact CD1-CE2 4.3Å; L491-F530 HydrophobicContact CD1-CG 4.19Å; L491-F530 HydrophobicContact CD2-CB 4.26Å; L491-F530 HydrophobicContact CG-CD2 4.41Å
492	G	86.5	Confident	86	Confident	15 Å²	15	38.7 Å²	38.7	16%	0.155	21%	0.206	C	C	.	.	H	α-helix	trans	-60	-43.9	177.4	0	0	0	0	0	112.9	D488 R489 V490 L496	D488-G492 PolarHBondContact O-N 3.46Å; R489-G492 PolarHBondContact O-N 3.49Å; V490-G492 PolarHBondContact O-N 3.45Å; G492-L496 WeakPolarHBondContact O-CB 3.5Å; G492-L496 VanDerWaalsContact O-CG 3.25Å; G492-L496 WeakPolarHBondContact O-CG 3.49Å; G492-L496 PolarHBondContact O-N 2.97Å
493	C	90.1	Very high	87.1	Confident	2 Å²	2	34 Å²	34	1%	0.014	19%	0.186	C	C	.	.	H	α-helix	trans	-61.3	-52.6	178.3	-172.7	0	0	0	0	111.8	L299 M308 R489 V490 L491 L496 I497	L299-C493 HydrophobicContact CD2-CB 4.15Å; M308-C493 HydrophobicContact SD-CB 4.32Å; R489-C493 WeakPolarHBondContact O-CB 3.44Å; R489-C493 PolarHBondContact O-N 3.03Å; V490-C493 PolarHBondContact O-N 3.31Å; L491-C493 PolarHBondContact O-N 3.35Å; C493-L496 PolarHBondContact O-N 3.39Å; C493-I497 WeakPolarHBondContact O-CG1 3.25Å; C493-I497 PolarHBondContact O-N 2.82Å
494	F	91.7	Very high	87.6	Confident	1 Å²	1	34.7 Å²	34.7	0%	0.004	19%	0.188	C	C	.	.	H	α-helix	trans	-73.8	-27.9	-176.7	-70.2	-72.7	0	0	0	113.8	Q295 I298 L299 V337 C338 A341 I342 V490 I497 L498	Q295-F494 HydrophobicContact CB-CZ 4Å; Q295-F494 HydrophobicContact CG-CZ 4.14Å; I298-F494 HydrophobicContact CB-CE1 4.24Å; I298-F494 HydrophobicContact CB-CZ 4.26Å; I298-F494 HydrophobicContact CD1-CE1 4.13Å; I298-F494 HydrophobicContact CG2-CE1 3.78Å; I298-F494 HydrophobicContact CG2-CZ 3.98Å; L299-F494 HydrophobicContact CD1-CE2 4.3Å; L299-F494 HydrophobicContact CD2-CE2 3.86Å; L299-F494 HydrophobicContact CD2-CZ 4.49Å; L299-F494 HydrophobicContact CG-CE2 3.98Å; L299-F494 HydrophobicContact CG-CZ 4.28Å; V337-F494 HydrophobicContact CG1-CE1 3.97Å; C338-F494 HydrophobicContact CB-CB 4.41Å; C338-F494 HydrophobicContact CB-CD1 4.32Å; A341-F494 HydrophobicContact CB-CB 4.4Å; A341-F494 HydrophobicContact CB-CD1 4.13Å; A341-F494 HydrophobicContact CB-CD2 3.29Å; A341-F494 HydrophobicContact CB-CE1 4.26Å; A341-F494 HydrophobicContact CB-CE2 3.46Å; A341-F494 VanDerWaalsContact CB-CE2 3.46Å; A341-F494 HydrophobicContact CB-CG 3.67Å; A341-F494 HydrophobicContact CB-CZ 3.96Å; I342-F494 HydrophobicContact CD1-CB 4.46Å; I342-F494 HydrophobicContact CG1-CB 4.21Å; V490-F494 HydrophobicContact CG1-CD2 3.78Å; V490-F494 HydrophobicContact CG1-CE2 3.9Å; V490-F494 VanDerWaalsContact O-CD2 3.29Å; V490-F494 WeakPolarHBondContact O-CD2 3.37Å; V490-F494 PolarHBondContact O-N 2.76Å; F494-I497 HydrophobicContact CD1-CD1 3.87Å; F494-I497 HydrophobicContact CE1-CD1 4.17Å; F494-I497 PolarHBondContact O-N 2.77Å; F494-L498 PolarHBondContact O-N 3Å; F494-L498 VanDerWaalsContact O-N 3.14Å
495	A	90	Very high	87.8	Confident	5 Å²	5	35.6 Å²	35.6	4%	0.041	19%	0.188	C	C	.	.	H	α-helix	trans	-66.7	-43.2	170.3	0	0	0	0	0	111.9	L491 I497 L498 K499 F530 E533	L491-A495 WeakPolarHBondContact O-CB 3.19Å; L491-A495 PolarHBondContact O-N 3.24Å; A495-I497 VanDerWaalsContact C-N 3.25Å; A495-I497 PolarHBondContact O-N 3.24Å; A495-L498 PolarHBondContact O-N 3.46Å; A495-K499 PolarHBondContact O-N 3.11Å; A495-F530 HydrophobicContact CB-CD2 4Å; A495-F530 HydrophobicContact CB-CE2 4.29Å; A495-E533 HydrophobicContact CB-CB 4.1Å
496	L	91	Very high	88	Confident	54 Å²	54	34 Å²	34	28%	0.283	17%	0.169	S	C	.	.	H	α-helix	trans	-64.3	-29.8	173.5	-71.7	172	0	0	0	112.4	M308 G492 C493 K499 M500 E533	M308-L496 HydrophobicContact CE-CB 3.65Å; M308-L496 HydrophobicContact CE-CD1 4.28Å; M308-L496 HydrophobicContact CG-CD1 3.9Å; M308-L496 HydrophobicContact SD-CB 4.5Å; M308-L496 HydrophobicContact SD-CD1 4.22Å; G492-L496 WeakPolarHBondContact O-CB 3.5Å; G492-L496 VanDerWaalsContact O-CG 3.25Å; G492-L496 WeakPolarHBondContact O-CG 3.49Å; G492-L496 PolarHBondContact O-N 2.97Å; C493-L496 PolarHBondContact O-N 3.39Å; L496-K499 HydrophobicContact CD2-CD 4.25Å; L496-K499 WeakPolarHBondContact O-CB 3.34Å; L496-K499 PolarHBondContact O-N 2.74Å; L496-M500 WeakPolarHBondContact O-CG 3.36Å; L496-M500 PolarHBondContact O-N 3.09Å; L496-E533 HydrophobicContact CD2-CG 4.36Å; L496-E533 WeakPolarHBondContact CD2-OE2 3.26Å
497	I	91.7	Very high	88.4	Confident	1 Å²	1	29.8 Å²	29.8	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-65.6	-48.1	171.4	-67.2	167.2	0	0	0	111	I298 M308 V311 I315 C338 C493 F494 A495 K499 M500 L501	I298-I497 HydrophobicContact CG2-CD1 3.43Å; I298-I497 VanDerWaalsContact CG2-CD1 3.43Å; M308-I497 HydrophobicContact CE-CG1 4.29Å; V311-I497 HydrophobicContact CG1-CD1 3.9Å; V311-I497 HydrophobicContact CG1-CG1 3.9Å; I315-I497 HydrophobicContact CD1-CG1 4.19Å; I315-I497 HydrophobicContact CD1-CG2 3.93Å; C338-I497 WeakPolarHBondContact SG-CG2 3.31Å; C493-I497 WeakPolarHBondContact O-CG1 3.25Å; C493-I497 PolarHBondContact O-N 2.82Å; F494-I497 HydrophobicContact CD1-CD1 3.87Å; F494-I497 HydrophobicContact CE1-CD1 4.17Å; F494-I497 PolarHBondContact O-N 2.77Å; A495-I497 VanDerWaalsContact C-N 3.25Å; A495-I497 PolarHBondContact O-N 3.24Å; I497-K499 PolarHBondContact O-N 3.41Å; I497-M500 HydrophobicContact CB-CE 4.35Å; I497-M500 HydrophobicContact CG1-CE 3.79Å; I497-M500 PolarHBondContact O-N 3.44Å; I497-M500 VanDerWaalsContact O-N 3.11Å; I497-L501 HydrophobicContact CG2-CD1 4.23Å; I497-L501 HydrophobicContact CG2-CG 4.29Å; I497-L501 VanDerWaalsContact O-CG 3.31Å; I497-L501 WeakPolarHBondContact O-CG 3.34Å; I497-L501 PolarHBondContact O-N 3.27Å
498	L	91.7	Very high	88.7	Confident	2 Å²	2	29.7 Å²	29.7	1%	0.01	15%	0.145	C	C	.	.	H	α-helix	trans	-57.1	-38.2	176	-68.1	173.1	0	0	0	112.1	V335 C338 I342 F494 A495 L501 S502 F520 V537	V335-L498 HydrophobicContact CG2-CD2 4.49Å; C338-L498 HydrophobicContact CB-CD2 3.96Å; C338-L498 HydrophobicContact CB-CG 4.12Å; I342-L498 HydrophobicContact CD1-CD1 3.74Å; F494-L498 PolarHBondContact O-N 3Å; F494-L498 VanDerWaalsContact O-N 3.14Å; A495-L498 PolarHBondContact O-N 3.46Å; L498-L501 HydrophobicContact CD2-CD1 4.41Å; L498-L501 PolarHBondContact O-N 3.2Å; L498-S502 PolarHBondContact O-N 3.43Å; L498-F520 HydrophobicContact CD1-CE1 4.13Å; L498-F520 HydrophobicContact CD1-CZ 3.92Å; L498-V537 HydrophobicContact CB-CG2 4.44Å
499	K	91.9	Very high	88.8	Confident	54 Å²	54	28.5 Å²	28.5	24%	0.235	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-53	171.3	173.9	164.4	176.7	174.7	0	112.7	A495 L496 I497 L501 S502 D503 E533 Y536 V537	A495-K499 PolarHBondContact O-N 3.11Å; L496-K499 HydrophobicContact CD2-CD 4.25Å; L496-K499 WeakPolarHBondContact O-CB 3.34Å; L496-K499 PolarHBondContact O-N 2.74Å; I497-K499 PolarHBondContact O-N 3.41Å; K499-L501 PolarHBondContact O-N 3.01Å; K499-S502 WeakPolarHBondContact O-CA 3.39Å; K499-S502 WeakPolarHBondContact O-CB 3.47Å; K499-S502 PolarHBondContact O-N 3.07Å; K499-S502 PolarHBondContact O-OG 2.83Å; K499-D503 PolarHBondContact O-N 2.77Å; K499-E533 WeakPolarHBondContact CD-OE2 3.12Å; K499-E533 WeakPolarHBondContact CE-OE2 3.33Å; K499-E533 IonicContact NZ-OE2 2.86Å; K499-E533 PolarHBondContact NZ-OE2 2.88Å; K499-Y536 HydrophobicContact CD-CD1 4.02Å; K499-Y536 HydrophobicContact CD-CG 4.13Å; K499-Y536 HydrophobicContact CG-CD1 3.61Å; K499-Y536 HydrophobicContact CG-CE1 4.05Å; K499-Y536 HydrophobicContact CG-CG 4.22Å; K499-V537 HydrophobicContact CB-CG2 4.4Å
500	M	90.4	Very high	88.9	Confident	21 Å²	21	23.8 Å²	23.8	10%	0.103	13%	0.132	C	C	.	.	H	α-helix	trans	-60.4	-31.8	176.4	-70.2	-177.7	-66.4	0	0	113.1	M308 V311 K312 I315 L496 I497 S502 D503 Y504	M308-M500 HydrophobicContact CE-CE 3.4Å; V311-M500 HydrophobicContact CG1-CE 4.14Å; K312-M500 HydrophobicContact CB-SD 3.58Å; K312-M500 VanDerWaalsContact CB-SD 3.58Å; K312-M500 HydrophobicContact CD-SD 4.38Å; K312-M500 HydrophobicContact CG-SD 3.76Å; I315-M500 HydrophobicContact CD1-CB 4.5Å; I315-M500 HydrophobicContact CD1-CE 3.7Å; I315-M500 HydrophobicContact CD1-SD 4.49Å; L496-M500 WeakPolarHBondContact O-CG 3.36Å; L496-M500 PolarHBondContact O-N 3.09Å; I497-M500 HydrophobicContact CB-CE 4.35Å; I497-M500 HydrophobicContact CG1-CE 3.79Å; I497-M500 PolarHBondContact O-N 3.44Å; I497-M500 VanDerWaalsContact O-N 3.11Å; M500-S502 VanDerWaalsContact C-N 3.28Å; M500-S502 PolarHBondContact O-N 3.4Å; M500-D503 PolarHBondContact O-N 3.13Å; M500-Y504 WeakPolarHBondContact O-CD2 3.41Å; M500-Y504 WeakPolarHBondContact O-CE2 3.43Å
501	L	89.5	Confident	89	Confident	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-67.6	-28.3	173.9	-65.9	176.6	0	0	0	112.4	I315 L331 L334 V335 I497 L498 K499 D503 W507 L511	I315-L501 HydrophobicContact CG2-CD2 4.21Å; L331-L501 HydrophobicContact CD1-CB 4.19Å; L331-L501 HydrophobicContact CD1-CD1 3.95Å; L331-L501 HydrophobicContact CD1-CD2 3.94Å; L331-L501 HydrophobicContact CD1-CG 4.24Å; L334-L501 HydrophobicContact CB-CD1 4.35Å; L334-L501 HydrophobicContact CD1-CD2 4.04Å; V335-L501 HydrophobicContact CG2-CD1 3.94Å; I497-L501 HydrophobicContact CG2-CD1 4.23Å; I497-L501 HydrophobicContact CG2-CG 4.29Å; I497-L501 VanDerWaalsContact O-CG 3.31Å; I497-L501 WeakPolarHBondContact O-CG 3.34Å; I497-L501 PolarHBondContact O-N 3.27Å; L498-L501 HydrophobicContact CD2-CD1 4.41Å; L498-L501 PolarHBondContact O-N 3.2Å; K499-L501 PolarHBondContact O-N 3.01Å; L501-D503 VanDerWaalsContact C-N 3.32Å; L501-W507 HydrophobicContact CD2-CE3 3.54Å; L501-W507 HydrophobicContact CD2-CH2 4.19Å; L501-W507 HydrophobicContact CD2-CZ3 3.33Å; L501-L511 HydrophobicContact CB-CD1 4.44Å; L501-L511 HydrophobicContact CB-CD2 3.95Å; L501-L511 HydrophobicContact CD1-CD1 4.45Å
502	S	89.6	Confident	88.9	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-79.4	-10.7	178.3	76.8	0	0	0	0	114.5	L498 K499 M500 Y504 R508	L498-S502 PolarHBondContact O-N 3.43Å; K499-S502 WeakPolarHBondContact O-CA 3.39Å; K499-S502 WeakPolarHBondContact O-CB 3.47Å; K499-S502 PolarHBondContact O-N 3.07Å; K499-S502 PolarHBondContact O-OG 2.83Å; M500-S502 VanDerWaalsContact C-N 3.28Å; M500-S502 PolarHBondContact O-N 3.4Å; S502-Y504 VanDerWaalsContact C-N 3.3Å; S502-R508 VanDerWaalsContact O-CD 3.25Å; S502-R508 WeakPolarHBondContact O-CD 3.48Å; S502-R508 VanDerWaalsContact O-CG 3.29Å; S502-R508 WeakPolarHBondContact O-CG 3.43Å
503	D	90	Very high	89	Confident	66 Å²	66	26.1 Å²	26.1	35%	0.353	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-19.9	175.5	-64.7	-27.5	0	0	0	112.6	K499 M500 L501 Y536	K499-D503 PolarHBondContact O-N 2.77Å; M500-D503 PolarHBondContact O-N 3.13Å; L501-D503 VanDerWaalsContact C-N 3.32Å; D503-Y536 WeakPolarHBondContact OD1-CE1 3.31Å; D503-Y536 PolarHBondContact OD1-OH 3.33Å
504	Y	87.6	Confident	88.8	Confident	37 Å²	37	29.1 Å²	29.1	15%	0.145	16%	0.162	C	C	.	.			trans	-92.5	115.2	-174.9	-67.9	-83.8	0	0	0	112.7	I315 H316 H319 M500 S502 D506 W507 R508	I315-Y504 HydrophobicContact CG2-CE2 4.12Å; H316-Y504 WeakPolarHBondContact CA-OH 3.48Å; H316-Y504 PolarHBondContact ND1-OH 2.75Å; H319-Y504 HydrophobicContact CB-CD1 4.32Å; H319-Y504 HydrophobicContact CB-CE1 3.84Å; H319-Y504 AromaticContact CD2-CD1 3.56Å; H319-Y504 AromaticContact CD2-CE1 3.99Å; H319-Y504 AromaticContact CE1-CD1 3.45Å; H319-Y504 VanDerWaalsContact CE1-CD1 3.45Å; H319-Y504 WeakPolarHBondContact CE1-CD1 3.46Å; H319-Y504 AromaticContact CE1-CE1 3.95Å; H319-Y504 AromaticContact CG-CD1 3.48Å; H319-Y504 VanDerWaalsContact CG-CD1 3.48Å; H319-Y504 AromaticContact CG-CE1 3.44Å; H319-Y504 VanDerWaalsContact CG-CE1 3.44Å; H319-Y504 AromaticContact ND1-CD1 3.42Å; H319-Y504 WeakPolarHBondContact ND1-CD1 3.48Å; H319-Y504 AromaticContact ND1-CE1 3.41Å; H319-Y504 WeakPolarHBondContact ND1-CE1 3.44Å; H319-Y504 AromaticContact NE2-CD1 3.54Å; M500-Y504 WeakPolarHBondContact O-CD2 3.41Å; M500-Y504 WeakPolarHBondContact O-CE2 3.43Å; S502-Y504 VanDerWaalsContact C-N 3.3Å; Y504-D506 VanDerWaalsContact C-N 3.3Å; Y504-D506 PolarHBondContact O-N 2.77Å; Y504-W507 AromaticContact CD2-CE3 3.53Å; Y504-W507 HydrophobicContact CD2-CE3 3.53Å; Y504-W507 AromaticContact CD2-CZ3 3.66Å; Y504-W507 HydrophobicContact CD2-CZ3 3.66Å; Y504-W507 HydrophobicContact CE2-CE3 4.22Å; Y504-W507 AromaticContact CE2-CZ3 3.86Å; Y504-W507 HydrophobicContact CE2-CZ3 3.86Å; Y504-W507 HydrophobicContact CG-CD2 4.46Å; Y504-W507 AromaticContact CG-CE3 3.83Å; Y504-W507 HydrophobicContact CG-CE3 3.83Å; Y504-W507 HydrophobicContact CG-CZ3 4.2Å; Y504-W507 PolarHBondContact O-N 3.14Å; Y504-W507 VanDerWaalsContact O-N 3.09Å; Y504-R508 WeakPolarHBondContact O-CG 3.42Å; Y504-R508 PolarHBondContact O-N 2.97Å
505	D	84.8	Confident	88.5	Confident	88 Å²	88	29 Å²	29	47%	0.471	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-26.1	-173.2	-72.3	-20.4	0	0	0	116.2	R508 R546	D505-R508 IonicContact OD1-CZ 2.68Å; D505-R508 VanDerWaalsContact OD1-CZ 3.29Å; D505-R508 IonicContact OD1-NE 2.71Å; D505-R508 PolarHBondContact OD1-NE 2.93Å; D505-R508 IonicContact OD1-NH2 2.77Å; D505-R508 PolarHBondContact OD1-NH2 3.48Å; D505-R546 PolarHBondContact O-NH1 2.75Å; D505-R546 PolarHBondContact O-NH2 3.44Å
506	D	85.3	Confident	88.1	Confident	44 Å²	44	31.3 Å²	31.3	24%	0.235	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.5	-27.1	176	67.2	-37.6	0	0	0	112.3	H319 C325 Y504	H319-D506 IonicContact CD2-OD1 3.76Å; H319-D506 IonicContact CD2-OD2 3.55Å; H319-D506 IonicContact CE1-OD1 3.84Å; H319-D506 IonicContact NE2-OD1 2.66Å; H319-D506 PolarHBondContact NE2-OD1 2.91Å; H319-D506 IonicContact NE2-OD2 3.7Å; H319-D506 PolarHBondContact NE2-OD2 2.79Å; H319-D506 VanDerWaalsContact NE2-OD2 3.09Å; C325-D506 VanDerWaalsContact CB-OD2 3.28Å; C325-D506 WeakPolarHBondContact CB-OD2 3.38Å; C325-D506 PolarHBondContact N-OD2 2.77Å; Y504-D506 VanDerWaalsContact C-N 3.3Å; Y504-D506 PolarHBondContact O-N 2.77Å
507	W	87.9	Confident	87.6	Confident	8 Å²	8	33.2 Å²	33.2	3%	0.03	19%	0.188	C	C	.	.	H	α-helix	trans	-80.9	-28.7	174.4	-76.1	-4.2	0	0	0	113.4	I315 H319 C325 V330 L331 L501 Y504 A510 L511	I315-W507 HydrophobicContact CG2-CH2 3.94Å; I315-W507 HydrophobicContact CG2-CZ3 3.67Å; H319-W507 HydrophobicContact CB-CH2 3.95Å; H319-W507 HydrophobicContact CB-CZ2 4.12Å; H319-W507 AromaticContact CD2-CD2 3.93Å; H319-W507 AromaticContact CD2-CE2 3.58Å; H319-W507 AromaticContact CD2-CZ2 3.68Å; H319-W507 AromaticContact CD2-NE1 3.89Å; C325-W507 VanDerWaalsContact CB-NE1 3.31Å; C325-W507 PolarHBondContact SG-NE1 3.37Å; V330-W507 HydrophobicContact CG1-CH2 4.37Å; V330-W507 HydrophobicContact CG1-CZ2 4.06Å; L331-W507 HydrophobicContact CB-CD2 4.26Å; L331-W507 HydrophobicContact CB-CG 4.23Å; L331-W507 HydrophobicContact CD1-CB 4.11Å; L331-W507 HydrophobicContact CD1-CD2 4.01Å; L331-W507 HydrophobicContact CD1-CE3 4.2Å; L331-W507 HydrophobicContact CD1-CG 4.02Å; L331-W507 HydrophobicContact CD2-CB 3.74Å; L331-W507 HydrophobicContact CD2-CG 3.8Å; L331-W507 WeakPolarHBondContact CD2-O 3.23Å; L331-W507 HydrophobicContact CG-CB 4.47Å; L331-W507 HydrophobicContact CG-CG 4.24Å; L501-W507 HydrophobicContact CD2-CE3 3.54Å; L501-W507 HydrophobicContact CD2-CH2 4.19Å; L501-W507 HydrophobicContact CD2-CZ3 3.33Å; Y504-W507 AromaticContact CD2-CE3 3.53Å; Y504-W507 HydrophobicContact CD2-CE3 3.53Å; Y504-W507 AromaticContact CD2-CZ3 3.66Å; Y504-W507 HydrophobicContact CD2-CZ3 3.66Å; Y504-W507 HydrophobicContact CE2-CE3 4.22Å; Y504-W507 AromaticContact CE2-CZ3 3.86Å; Y504-W507 HydrophobicContact CE2-CZ3 3.86Å; Y504-W507 HydrophobicContact CG-CD2 4.46Å; Y504-W507 AromaticContact CG-CE3 3.83Å; Y504-W507 HydrophobicContact CG-CE3 3.83Å; Y504-W507 HydrophobicContact CG-CZ3 4.2Å; Y504-W507 PolarHBondContact O-N 3.14Å; Y504-W507 VanDerWaalsContact O-N 3.09Å; W507-A510 PolarHBondContact O-N 3.45Å; W507-A510 VanDerWaalsContact O-N 3.15Å; W507-L511 VanDerWaalsContact O-CB 3.32Å; W507-L511 WeakPolarHBondContact O-CB 3.25Å; W507-L511 PolarHBondContact O-N 3.01Å
508	R	88.9	Confident	87.2	Confident	16 Å²	16	35.1 Å²	35.1	6%	0.06	20%	0.197	C	C	.	.	H	α-helix	trans	-48.5	-47.9	-178.3	-80.2	-166.8	-74.3	155.5	10.7	114.4	S502 Y504 D505 L511 A512 R540 D544	S502-R508 VanDerWaalsContact O-CD 3.25Å; S502-R508 WeakPolarHBondContact O-CD 3.48Å; S502-R508 VanDerWaalsContact O-CG 3.29Å; S502-R508 WeakPolarHBondContact O-CG 3.43Å; Y504-R508 WeakPolarHBondContact O-CG 3.42Å; Y504-R508 PolarHBondContact O-N 2.97Å; D505-R508 IonicContact OD1-CZ 2.68Å; D505-R508 VanDerWaalsContact OD1-CZ 3.29Å; D505-R508 IonicContact OD1-NE 2.71Å; D505-R508 PolarHBondContact OD1-NE 2.93Å; D505-R508 IonicContact OD1-NH2 2.77Å; D505-R508 PolarHBondContact OD1-NH2 3.48Å; R508-L511 PolarHBondContact O-N 3.31Å; R508-A512 VanDerWaalsContact O-CB 3.28Å; R508-A512 WeakPolarHBondContact O-CB 3.35Å; R508-A512 PolarHBondContact O-N 3.13Å; R508-R540 WeakPolarHBondContact CD-O 3.43Å; R508-R540 PolarHBondContact NH1-O 3.14Å; R508-D544 IonicContact CZ-OD2 3.86Å; R508-D544 IonicContact NE-OD2 2.68Å; R508-D544 PolarHBondContact NE-OD2 2.73Å; R508-D544 IonicContact NH1-OD2 3.31Å; R508-D544 PolarHBondContact NH1-OD2 3.09Å; R508-D544 IonicContact NH2-OD2 3.29Å; R508-D544 PolarHBondContact NH2-OD2 3.27Å
509	P	87.2	Confident	86.8	Confident	20 Å²	20	36.1 Å²	36.1	13%	0.13	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-46.7	176.8	-25.1	34.8	0	0	0	114.7	A512 S513 R546 E548 V549	P509-A512 PolarHBondContact O-N 3.04Å; P509-S513 PolarHBondContact O-N 3.32Å; P509-R546 VanDerWaalsContact CG-NH1 3.35Å; P509-E548 HydrophobicContact CB-CG 3.99Å; P509-E548 WeakPolarHBondContact CB-OE1 3.35Å; P509-E548 HydrophobicContact CG-CG 4.4Å; P509-E548 VanDerWaalsContact CG-OE1 3.26Å; P509-E548 WeakPolarHBondContact CG-OE1 3.47Å; P509-V549 HydrophobicContact CB-CG2 4.27Å; P509-V549 HydrophobicContact CG-CG2 4.07Å
510	A	86.8	Confident	86.5	Confident	45 Å²	45	34.1 Å²	34.1	37%	0.372	20%	0.195	S	C	.	.	H	α-helix	trans	-71.2	-35.2	-179.1	0	0	0	0	0	111.4	L331 W507 S513 L514	L331-A510 HydrophobicContact CD2-CB 3.55Å; W507-A510 PolarHBondContact O-N 3.45Å; W507-A510 VanDerWaalsContact O-N 3.15Å; A510-S513 PolarHBondContact O-N 2.88Å; A510-L514 WeakPolarHBondContact O-CB 3.48Å; A510-L514 WeakPolarHBondContact O-CD1 3.47Å; A510-L514 WeakPolarHBondContact O-CG 3.41Å; A510-L514 PolarHBondContact O-N 2.83Å
511	L	88.6	Confident	86.1	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-65	-44.3	173.4	-176.8	64.9	0	0	0	110.9	L331 V335 L501 W507 R508 S513 L514 L515 V537 F541	L331-L511 HydrophobicContact CD1-CB 4.42Å; L331-L511 HydrophobicContact CD1-CD1 4.27Å; L331-L511 HydrophobicContact CD2-CB 4.31Å; V335-L511 HydrophobicContact CG2-CD1 3.45Å; V335-L511 VanDerWaalsContact CG2-CD1 3.45Å; L501-L511 HydrophobicContact CB-CD1 4.44Å; L501-L511 HydrophobicContact CB-CD2 3.95Å; L501-L511 HydrophobicContact CD1-CD1 4.45Å; W507-L511 VanDerWaalsContact O-CB 3.32Å; W507-L511 WeakPolarHBondContact O-CB 3.25Å; W507-L511 PolarHBondContact O-N 3.01Å; R508-L511 PolarHBondContact O-N 3.31Å; L511-S513 PolarHBondContact O-N 3.36Å; L511-L514 PolarHBondContact O-N 2.83Å; L511-L514 VanDerWaalsContact O-N 3.13Å; L511-L515 HydrophobicContact CD1-CD1 4.2Å; L511-L515 HydrophobicContact CD1-CG 4.32Å; L511-L515 HydrophobicContact CG-CD1 4.16Å; L511-L515 WeakPolarHBondContact O-CG 3.46Å; L511-L515 PolarHBondContact O-N 3.23Å; L511-V537 HydrophobicContact CD2-CG1 4.33Å; L511-F541 HydrophobicContact CB-CZ 4.36Å; L511-F541 HydrophobicContact CD2-CE1 4.17Å; L511-F541 HydrophobicContact CD2-CZ 4.05Å; L511-F541 HydrophobicContact CG-CE1 4.37Å; L511-F541 HydrophobicContact CG-CZ 3.94Å
512	A	86.8	Confident	85.6	Confident	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-58.3	-46.9	174.5	0	0	0	0	0	111.1	R508 P509 L514 L515 Q516 F541 V549 C552	R508-A512 VanDerWaalsContact O-CB 3.28Å; R508-A512 WeakPolarHBondContact O-CB 3.35Å; R508-A512 PolarHBondContact O-N 3.13Å; P509-A512 PolarHBondContact O-N 3.04Å; A512-L514 VanDerWaalsContact C-N 3.28Å; A512-L514 PolarHBondContact O-N 3.24Å; A512-L515 PolarHBondContact O-N 2.88Å; A512-Q516 PolarHBondContact O-N 2.9Å; A512-F541 HydrophobicContact CB-CD1 4.34Å; A512-F541 HydrophobicContact CB-CD2 4.39Å; A512-F541 HydrophobicContact CB-CE1 4.08Å; A512-F541 HydrophobicContact CB-CE2 4.13Å; A512-F541 HydrophobicContact CB-CG 4.5Å; A512-F541 HydrophobicContact CB-CZ 3.97Å; A512-V549 HydrophobicContact CB-CG1 4.17Å; A512-C552 HydrophobicContact CB-CB 3.75Å; A512-C552 PolarHBondContact O-SG 3.34Å
513	S	86.6	Confident	85.3	Confident	85 Å²	85	41.8 Å²	41.8	59%	0.594	23%	0.229	S	C	*	.	H	α-helix	trans	-62.8	-29.9	174.8	-176.4	0	0	0	0	114	P509 A510 L511	P509-S513 PolarHBondContact O-N 3.32Å; A510-S513 PolarHBondContact O-N 2.88Å; L511-S513 PolarHBondContact O-N 3.36Å
514	L	85.9	Confident	85	Confident	64 Å²	64	38.6 Å²	38.6	34%	0.335	21%	0.212	S	C	.	.	H	α-helix	trans	-81.6	-23.7	178.4	-71.6	164.8	0	0	0	113	L331 P332 V335 A510 L511 A512 Q516	L331-L514 HydrophobicContact CG-CD1 4.35Å; P332-L514 HydrophobicContact CB-CD1 4.3Å; P332-L514 HydrophobicContact CG-CD1 4.19Å; V335-L514 HydrophobicContact CB-CD1 4.23Å; V335-L514 HydrophobicContact CG1-CB 4.12Å; V335-L514 HydrophobicContact CG1-CD1 4.5Å; V335-L514 HydrophobicContact CG2-CD1 4.09Å; A510-L514 WeakPolarHBondContact O-CB 3.48Å; A510-L514 WeakPolarHBondContact O-CD1 3.47Å; A510-L514 WeakPolarHBondContact O-CG 3.41Å; A510-L514 PolarHBondContact O-N 2.83Å; L511-L514 PolarHBondContact O-N 2.83Å; L511-L514 VanDerWaalsContact O-N 3.13Å; A512-L514 VanDerWaalsContact C-N 3.28Å; A512-L514 PolarHBondContact O-N 3.24Å; L514-Q516 VanDerWaalsContact C-N 3.28Å
515	L	85.9	Confident	84.7	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.8	13.4	174.8	-63.9	-178.2	0	0	0	113	L339 L511 A512 P517 P519 F520 V537 F541 W563	L339-L515 HydrophobicContact CD2-CD2 4.44Å; L511-L515 HydrophobicContact CD1-CD1 4.2Å; L511-L515 HydrophobicContact CD1-CG 4.32Å; L511-L515 HydrophobicContact CG-CD1 4.16Å; L511-L515 WeakPolarHBondContact O-CG 3.46Å; L511-L515 PolarHBondContact O-N 3.23Å; A512-L515 PolarHBondContact O-N 2.88Å; L515-P517 CarbonylContact O-C 3.4Å; L515-P519 HydrophobicContact CD2-CG 3.9Å; L515-F520 HydrophobicContact CD2-CE2 4Å; L515-F520 HydrophobicContact CD2-CZ 3.85Å; L515-V537 HydrophobicContact CD1-CG1 3.96Å; L515-F541 HydrophobicContact CD1-CE2 4.06Å; L515-F541 HydrophobicContact CD1-CZ 4.07Å; L515-W563 HydrophobicContact CB-CZ2 4.39Å; L515-W563 PolarHBondContact O-NE1 2.86Å; L515-W563 VanDerWaalsContact O-NE1 3.13Å
516	Q	82.1	Confident	84.5	Confident	52 Å²	52	35.4 Å²	35.4	24%	0.243	20%	0.202	C	C	.	.			trans	-127.1	124.5	177.6	-147	-162.3	22.6	0	0	111.3	A512 L514 S551 C552 L554 V556	A512-Q516 PolarHBondContact O-N 2.9Å; L514-Q516 VanDerWaalsContact C-N 3.28Å; Q516-S551 PolarHBondContact NE2-O 3.35Å; Q516-C552 PolarHBondContact NE2-O 3.25Å; Q516-L554 PolarHBondContact NE2-O 3.43Å; Q516-V556 HydrophobicContact CG-CG2 3.46Å; Q516-V556 VanDerWaalsContact CG-CG2 3.46Å
517	P	80.8	Confident	84.5	Confident	95 Å²	95	34.5 Å²	34.5	62%	0.617	20%	0.197	S	C	*	.	S	Bend	cis	-67.3	162.6	-7	33.2	-37.6	0	0	0	112.1	L515 P519 V556	L515-P517 CarbonylContact O-C 3.4Å; P517-P519 WeakPolarHBondContact O-CD 2.98Å; P517-V556 HydrophobicContact CB-CG2 4.39Å
518	I	83.3	Confident	84.1	Confident	40 Å²	40	37.5 Å²	37.5	21%	0.205	22%	0.224	C	C	.	.			trans	-45.4	108.5	-178.8	-57.2	-175.5	0	0	0	111.1	F520 L525 W563	I518-F520 VanDerWaalsContact C-N 3.32Å; I518-F520 HydrophobicContact CG2-CB 4.42Å; I518-F520 HydrophobicContact CG2-CD2 4.05Å; I518-F520 PolarHBondContact O-N 2.96Å; I518-L525 HydrophobicContact CG2-CD1 3.92Å; I518-L525 HydrophobicContact CG2-CD2 4.25Å; I518-W563 HydrophobicContact CB-CH2 4.39Å; I518-W563 HydrophobicContact CB-CZ2 4.22Å; I518-W563 HydrophobicContact CD1-CD2 4.14Å; I518-W563 HydrophobicContact CD1-CE3 4.08Å; I518-W563 HydrophobicContact CD1-CZ3 4.29Å; I518-W563 HydrophobicContact CG1-CD2 4.03Å; I518-W563 HydrophobicContact CG1-CE3 4.33Å; I518-W563 HydrophobicContact CG1-CH2 4.22Å; I518-W563 HydrophobicContact CG1-CZ2 3.91Å; I518-W563 HydrophobicContact CG1-CZ3 4.41Å; I518-W563 HydrophobicContact CG2-CH2 3.7Å; I518-W563 HydrophobicContact CG2-CZ2 3.99Å; I518-W563 HydrophobicContact CG2-CZ3 4.17Å
519	P	82.5	Confident	83.8	Confident	23 Å²	23	41.3 Å²	41.3	15%	0.149	24%	0.24	C	C	.	.			trans	-97.1	39.6	-169.7	39.6	-38.5	0	0	0	112	L339 Y343 L515 P517	L339-P519 HydrophobicContact CD1-CB 3.99Å; L339-P519 HydrophobicContact CD1-CG 4.06Å; L339-P519 HydrophobicContact CD2-CB 4.07Å; L339-P519 HydrophobicContact CD2-CG 3.62Å; Y343-P519 WeakPolarHBondContact CE2-O 3.28Å; Y343-P519 PolarHBondContact OH-O 3.25Å; L515-P519 HydrophobicContact CD2-CG 3.9Å; P517-P519 WeakPolarHBondContact O-CD 2.98Å
520	F	85.2	Confident	83.7	Confident	12 Å²	12	40.4 Å²	40.4	5%	0.053	24%	0.235	C	C	.	.	S	Bend	trans	-129.5	147.7	-174	-59.4	-72.4	0	0	0	111.5	L339 I342 L498 L515 I518 L525 F530 L534 W563	L339-F520 HydrophobicContact CD2-CD1 4.02Å; L339-F520 HydrophobicContact CD2-CE1 3.35Å; L339-F520 HydrophobicContact CD2-CZ 3.66Å; I342-F520 HydrophobicContact CD1-CE1 3.87Å; I342-F520 HydrophobicContact CG2-CD1 4.11Å; L498-F520 HydrophobicContact CD1-CE1 4.13Å; L498-F520 HydrophobicContact CD1-CZ 3.92Å; L515-F520 HydrophobicContact CD2-CE2 4Å; L515-F520 HydrophobicContact CD2-CZ 3.85Å; I518-F520 VanDerWaalsContact C-N 3.32Å; I518-F520 HydrophobicContact CG2-CB 4.42Å; I518-F520 HydrophobicContact CG2-CD2 4.05Å; I518-F520 PolarHBondContact O-N 2.96Å; F520-L525 HydrophobicContact CB-CD2 4.02Å; F520-L525 HydrophobicContact CB-CG 4.3Å; F520-L525 HydrophobicContact CD2-CD2 4.48Å; F520-F530 HydrophobicContact CD1-CE1 4.2Å; F520-F530 AromaticContact CD1-CZ 3.6Å; F520-F530 HydrophobicContact CD1-CZ 3.6Å; F520-F530 HydrophobicContact CD2-CZ 4.41Å; F520-F530 HydrophobicContact CE1-CE2 4.33Å; F520-F530 AromaticContact CE1-CZ 3.6Å; F520-F530 HydrophobicContact CE1-CZ 3.6Å; F520-F530 HydrophobicContact CE2-CZ 4.41Å; F520-F530 HydrophobicContact CG-CE1 4.22Å; F520-F530 HydrophobicContact CG-CZ 4.02Å; F520-F530 HydrophobicContact CZ-CZ 4.02Å; F520-L534 HydrophobicContact CD2-CD2 4.44Å; F520-L534 HydrophobicContact CE2-CD1 4.24Å; F520-L534 HydrophobicContact CE2-CD2 4.26Å; F520-L534 HydrophobicContact CZ-CD1 4.45Å; F520-W563 AromaticContact CD2-CH2 3.68Å; F520-W563 HydrophobicContact CD2-CH2 3.68Å; F520-W563 HydrophobicContact CD2-CZ2 4.25Å; F520-W563 AromaticContact CE2-CH2 3.67Å; F520-W563 HydrophobicContact CE2-CH2 3.67Å; F520-W563 HydrophobicContact CE2-CZ2 4.02Å
521	P	82.6	Confident	83.7	Confident	9 Å²	9	38.7 Å²	38.7	6%	0.058	22%	0.219	C	C	.	.			trans	-68.6	153	174.1	29.6	-32.3	0	0	0	110.8	Y343 Y346 I350 E523 A524 L525	Y343-P521 HydrophobicContact CD1-CB 4.35Å; Y343-P521 HydrophobicContact CD1-CG 4.08Å; Y343-P521 HydrophobicContact CE1-CB 4.06Å; Y343-P521 HydrophobicContact CE1-CG 4.09Å; Y346-P521 HydrophobicContact CD2-CG 4.08Å; Y346-P521 HydrophobicContact CG-CG 4.32Å; I350-P521 HydrophobicContact CD1-CB 3.92Å; I350-P521 HydrophobicContact CD1-CG 4.44Å; I350-P521 HydrophobicContact CG1-CB 4.42Å; P521-E523 PolarHBondContact O-N 3.13Å; P521-A524 HydrophobicContact CG-CB 3.79Å; P521-A524 WeakPolarHBondContact O-CB 3.34Å; P521-A524 PolarHBondContact O-N 3.26Å; P521-L525 PolarHBondContact O-N 2.75Å
522	K	80.2	Confident	83.5	Confident	153 Å²	153	44.9 Å²	44.9	67%	0.665	25%	0.246	S	C	*	.	H	α-helix	trans	-61.6	-30.3	-177.8	-68	-176.1	176.3	-174.9	0	111.8	L525 A526	K522-L525 PolarHBondContact O-N 3.45Å; K522-A526 PolarHBondContact O-N 3.35Å; K522-A526 VanDerWaalsContact O-N 3.09Å
523	E	82.4	Confident	83.5	Confident	20 Å²	20	47 Å²	47	9%	0.093	26%	0.256	C	S	.	.	H	α-helix	trans	-65	-38.1	176.9	-63.5	64.3	-145	0	0	111.5	Y346 F349 R353 I481 P521 A526 H527	Y346-E523 HydrophobicContact CD1-CB 3.61Å; Y346-E523 HydrophobicContact CE1-CB 4.13Å; Y346-E523 HydrophobicContact CG-CB 4.16Å; F349-E523 HydrophobicContact CB-CG 4.13Å; R353-E523 WeakPolarHBondContact CD-OE1 3.03Å; R353-E523 IonicContact CZ-OE1 3.09Å; R353-E523 IonicContact NE-OE1 3.9Å; R353-E523 IonicContact NH1-OE1 2.75Å; R353-E523 PolarHBondContact NH1-OE1 2.65Å; I481-E523 HydrophobicContact CD1-CB 4.03Å; I481-E523 HydrophobicContact CD1-CG 4.43Å; P521-E523 PolarHBondContact O-N 3.13Å; E523-A526 PolarHBondContact O-N 3.14Å; E523-H527 PolarHBondContact O-N 3.07Å
524	A	82.6	Confident	83.6	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-68.5	-43.5	172.5	0	0	0	0	0	111.2	I342 Y346 P521 A526 H527 F530	I342-A524 HydrophobicContact CG2-CB 4.39Å; Y346-A524 HydrophobicContact CD2-CB 3.96Å; Y346-A524 HydrophobicContact CE2-CB 3.48Å; Y346-A524 VanDerWaalsContact CE2-CB 3.48Å; P521-A524 HydrophobicContact CG-CB 3.79Å; P521-A524 WeakPolarHBondContact O-CB 3.34Å; P521-A524 PolarHBondContact O-N 3.26Å; A524-A526 PolarHBondContact O-N 3.41Å; A524-H527 WeakPolarHBondContact O-CB 3.39Å; A524-H527 PolarHBondContact O-N 2.82Å; A524-F530 HydrophobicContact CB-CD1 3.95Å; A524-F530 HydrophobicContact CB-CE1 3.97Å; A524-F530 VanDerWaalsContact O-CD1 3.26Å; A524-F530 WeakPolarHBondContact O-CD1 3.32Å
525	L	83.1	Confident	83.7	Confident	20 Å²	20	41.6 Å²	41.6	11%	0.105	22%	0.22	C	C	.	.	H	α-helix	trans	-66.7	-14.2	178.3	-56.9	177.2	0	0	0	113.7	I518 F520 P521 K522 F530 T531 L534 W563 L566	I518-L525 HydrophobicContact CG2-CD1 3.92Å; I518-L525 HydrophobicContact CG2-CD2 4.25Å; F520-L525 HydrophobicContact CB-CD2 4.02Å; F520-L525 HydrophobicContact CB-CG 4.3Å; F520-L525 HydrophobicContact CD2-CD2 4.48Å; P521-L525 PolarHBondContact O-N 2.75Å; K522-L525 PolarHBondContact O-N 3.45Å; L525-F530 HydrophobicContact CD2-CE1 4.38Å; L525-T531 WeakPolarHBondContact O-CG2 3.28Å; L525-L534 HydrophobicContact CD2-CD2 4.4Å; L525-W563 HydrophobicContact CD2-CZ3 4.39Å; L525-L566 HydrophobicContact CD1-CD1 4.48Å; L525-L566 HydrophobicContact CD1-CD2 4.44Å; L525-L566 HydrophobicContact CD2-CD2 3.94Å
526	A	80.7	Confident	83.9	Confident	37 Å²	37	45.5 Å²	45.5	31%	0.306	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93	-8.4	171.6	0	0	0	0	0	113.6	I481 K522 E523 A524 A528 V572	I481-A526 HydrophobicContact CD1-CB 4.18Å; K522-A526 PolarHBondContact O-N 3.35Å; K522-A526 VanDerWaalsContact O-N 3.09Å; E523-A526 PolarHBondContact O-N 3.14Å; A524-A526 PolarHBondContact O-N 3.41Å; A526-A528 PolarHBondContact O-N 3.36Å; A526-V572 HydrophobicContact CB-CG1 4.27Å
527	H	83.4	Confident	84.3	Confident	25 Å²	25	43 Å²	43	12%	0.116	22%	0.223	C	C	.	.			trans	-91.7	105.6	-175	-173	-104.2	0	0	0	111.6	Y346 I481 D488 L491 E523 A524 K529 F530 T531	Y346-H527 WeakPolarHBondContact OH-CB 3.38Å; I481-H527 PolarHBondContact O-CD2 3.21Å; D488-H527 IonicContact OD1-CE1 3.72Å; L491-H527 WeakPolarHBondContact CD2-ND1 3.43Å; E523-H527 PolarHBondContact O-N 3.07Å; A524-H527 WeakPolarHBondContact O-CB 3.39Å; A524-H527 PolarHBondContact O-N 2.82Å; H527-K529 VanDerWaalsContact C-N 3.28Å; H527-K529 PolarHBondContact O-N 3.14Å; H527-K529 VanDerWaalsContact O-N 3.08Å; H527-F530 HydrophobicContact CB-CB 4.33Å; H527-F530 WeakPolarHBondContact O-CA 3.48Å; H527-F530 WeakPolarHBondContact O-CB 3.37Å; H527-F530 PolarHBondContact O-N 3.05Å; H527-T531 PolarHBondContact O-N 2.92Å
528	A	80.3	Confident	84.7	Confident	72 Å²	72	38.5 Å²	38.5	60%	0.595	19%	0.194	S	C	*	.	H	α-helix	trans	-51.5	-37.3	-170.8	0	0	0	0	0	115.5	A526 F530 T531 K532	A526-A528 PolarHBondContact O-N 3.36Å; A528-F530 VanDerWaalsContact C-N 3.33Å; A528-T531 WeakPolarHBondContact CA-OG1 3.23Å; A528-T531 PolarHBondContact O-OG1 3.18Å; A528-T531 VanDerWaalsContact O-OG1 3.06Å; A528-K532 VanDerWaalsContact O-CB 3.28Å; A528-K532 WeakPolarHBondContact O-CB 3.29Å; A528-K532 PolarHBondContact O-N 3.42Å
529	K	82.4	Confident	85	Confident	95 Å²	95	39.9 Å²	39.9	41%	0.413	20%	0.2	S	C	.	.	H	α-helix	trans	-69.2	-32	177.8	-174.1	-173.7	172.6	-161	0	112.3	D488 H527	D488-K529 PolarHBondContact O-NZ 3.05Å; D488-K529 WeakPolarHBondContact OD1-CD 3.47Å; D488-K529 IonicContact OD1-NZ 2.78Å; D488-K529 PolarHBondContact OD1-NZ 3.37Å; D488-K529 IonicContact OD2-NZ 2.69Å; D488-K529 PolarHBondContact OD2-NZ 3.34Å; H527-K529 VanDerWaalsContact C-N 3.28Å; H527-K529 PolarHBondContact O-N 3.14Å; H527-K529 VanDerWaalsContact O-N 3.08Å
530	F	86.5	Confident	85.3	Confident	2 Å²	2	41.4 Å²	41.4	1%	0.009	20%	0.202	C	C	.	.	H	α-helix	trans	-77.9	-46.6	177.3	175.3	-103.8	0	0	0	111.3	I342 L491 A495 F520 A524 L525 H527 A528 K532 E533 L534	I342-F530 HydrophobicContact CD1-CE2 3.87Å; I342-F530 HydrophobicContact CD1-CZ 4.44Å; I342-F530 HydrophobicContact CG1-CE2 4.46Å; I342-F530 HydrophobicContact CG2-CE2 4.24Å; I342-F530 HydrophobicContact CG2-CZ 4.4Å; L491-F530 HydrophobicContact CD1-CB 4.34Å; L491-F530 HydrophobicContact CD1-CD2 3.63Å; L491-F530 HydrophobicContact CD1-CE2 4.3Å; L491-F530 HydrophobicContact CD1-CG 4.19Å; L491-F530 HydrophobicContact CD2-CB 4.26Å; L491-F530 HydrophobicContact CG-CD2 4.41Å; A495-F530 HydrophobicContact CB-CD2 4Å; A495-F530 HydrophobicContact CB-CE2 4.29Å; F520-F530 HydrophobicContact CD1-CE1 4.2Å; F520-F530 AromaticContact CD1-CZ 3.6Å; F520-F530 HydrophobicContact CD1-CZ 3.6Å; F520-F530 HydrophobicContact CD2-CZ 4.41Å; F520-F530 HydrophobicContact CE1-CE2 4.33Å; F520-F530 AromaticContact CE1-CZ 3.6Å; F520-F530 HydrophobicContact CE1-CZ 3.6Å; F520-F530 HydrophobicContact CE2-CZ 4.41Å; F520-F530 HydrophobicContact CG-CE1 4.22Å; F520-F530 HydrophobicContact CG-CZ 4.02Å; F520-F530 HydrophobicContact CZ-CZ 4.02Å; A524-F530 HydrophobicContact CB-CD1 3.95Å; A524-F530 HydrophobicContact CB-CE1 3.97Å; A524-F530 VanDerWaalsContact O-CD1 3.26Å; A524-F530 WeakPolarHBondContact O-CD1 3.32Å; L525-F530 HydrophobicContact CD2-CE1 4.38Å; H527-F530 HydrophobicContact CB-CB 4.33Å; H527-F530 WeakPolarHBondContact O-CA 3.48Å; H527-F530 WeakPolarHBondContact O-CB 3.37Å; H527-F530 PolarHBondContact O-N 3.05Å; A528-F530 VanDerWaalsContact C-N 3.33Å; F530-K532 VanDerWaalsContact C-N 3.25Å; F530-K532 PolarHBondContact O-N 3.37Å; F530-E533 PolarHBondContact O-N 3.42Å; F530-L534 HydrophobicContact CD1-CD2 4.37Å; F530-L534 HydrophobicContact CE1-CD2 3.6Å; F530-L534 HydrophobicContact CZ-CD2 3.89Å; F530-L534 VanDerWaalsContact O-CB 3.29Å; F530-L534 WeakPolarHBondContact O-CB 3.37Å; F530-L534 PolarHBondContact O-N 3.11Å
531	T	85.1	Confident	85.5	Confident	8 Å²	8	40.8 Å²	40.8	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-59.3	-37.8	176.4	53.5	0	0	0	0	111.5	L525 H527 A528 L534 K535 Y567 A573	L525-T531 WeakPolarHBondContact O-CG2 3.28Å; H527-T531 PolarHBondContact O-N 2.92Å; A528-T531 WeakPolarHBondContact CA-OG1 3.23Å; A528-T531 PolarHBondContact O-OG1 3.18Å; A528-T531 VanDerWaalsContact O-OG1 3.06Å; T531-L534 PolarHBondContact O-N 3.2Å; T531-K535 WeakPolarHBondContact O-CB 3.39Å; T531-K535 PolarHBondContact O-N 3.37Å; T531-Y567 PolarHBondContact O-OH 2.94Å; T531-A573 HydrophobicContact CG2-CB 3.72Å
532	K	85.5	Confident	85.6	Confident	131 Å²	131	40.4 Å²	40.4	57%	0.57	20%	0.197	S	C	*	.	H	α-helix	trans	-62.3	-42.9	176.1	-176.3	172.8	-178.9	172.5	0	114.5	A528 F530 K535	A528-K532 VanDerWaalsContact O-CB 3.28Å; A528-K532 WeakPolarHBondContact O-CB 3.29Å; A528-K532 PolarHBondContact O-N 3.42Å; F530-K532 VanDerWaalsContact C-N 3.25Å; F530-K532 PolarHBondContact O-N 3.37Å; K532-K535 WeakPolarHBondContact O-CB 3.34Å
533	E	87.4	Confident	85.9	Confident	44 Å²	44	37.4 Å²	37.4	21%	0.206	19%	0.186	C	C	.	.	H	α-helix	trans	-74	-36.6	176.6	-65.1	-56.9	150.4	0	0	111.6	A495 L496 K499 F530 K535 Y536	A495-E533 HydrophobicContact CB-CB 4.1Å; L496-E533 HydrophobicContact CD2-CG 4.36Å; L496-E533 WeakPolarHBondContact CD2-OE2 3.26Å; K499-E533 WeakPolarHBondContact CD-OE2 3.12Å; K499-E533 WeakPolarHBondContact CE-OE2 3.33Å; K499-E533 IonicContact NZ-OE2 2.86Å; K499-E533 PolarHBondContact NZ-OE2 2.88Å; F530-E533 PolarHBondContact O-N 3.42Å; E533-K535 VanDerWaalsContact C-N 3.34Å; E533-Y536 WeakPolarHBondContact O-CB 3.45Å; E533-Y536 PolarHBondContact O-N 3.04Å
534	L	88.6	Confident	86	Confident	4 Å²	4	36.5 Å²	36.5	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-67.9	-33.1	176.1	-177.5	61.4	0	0	0	112.5	F520 L525 F530 T531 Y536 V537 I538 W563	F520-L534 HydrophobicContact CD2-CD2 4.44Å; F520-L534 HydrophobicContact CE2-CD1 4.24Å; F520-L534 HydrophobicContact CE2-CD2 4.26Å; F520-L534 HydrophobicContact CZ-CD1 4.45Å; L525-L534 HydrophobicContact CD2-CD2 4.4Å; F530-L534 HydrophobicContact CD1-CD2 4.37Å; F530-L534 HydrophobicContact CE1-CD2 3.6Å; F530-L534 HydrophobicContact CZ-CD2 3.89Å; F530-L534 VanDerWaalsContact O-CB 3.29Å; F530-L534 WeakPolarHBondContact O-CB 3.37Å; F530-L534 PolarHBondContact O-N 3.11Å; T531-L534 PolarHBondContact O-N 3.2Å; L534-Y536 PolarHBondContact O-N 3.48Å; L534-V537 HydrophobicContact CD1-CB 4.39Å; L534-V537 WeakPolarHBondContact O-CA 3.43Å; L534-V537 WeakPolarHBondContact O-CB 3.32Å; L534-V537 PolarHBondContact O-N 3.06Å; L534-I538 PolarHBondContact O-N 2.86Å; L534-W563 HydrophobicContact CD1-CH2 4.3Å; L534-W563 HydrophobicContact CD2-CH2 3.69Å; L534-W563 HydrophobicContact CD2-CZ3 3.63Å; L534-W563 HydrophobicContact CG-CH2 4.34Å; L534-W563 HydrophobicContact CG-CZ3 4.26Å
535	K	87.8	Confident	85.8	Confident	32 Å²	32	41.6 Å²	41.6	14%	0.139	22%	0.215	C	C	.	.	H	α-helix	trans	-54.7	-41.6	174.2	-177.5	-166.8	176.3	177.7	0	111.5	T531 K532 E533 V537 I538 Q539 Y567 D575 D576 L580	T531-K535 WeakPolarHBondContact O-CB 3.39Å; T531-K535 PolarHBondContact O-N 3.37Å; K532-K535 WeakPolarHBondContact O-CB 3.34Å; E533-K535 VanDerWaalsContact C-N 3.34Å; K535-V537 VanDerWaalsContact C-N 3.34Å; K535-V537 PolarHBondContact O-N 3.05Å; K535-I538 PolarHBondContact O-N 3.06Å; K535-Q539 WeakPolarHBondContact O-CB 3.5Å; K535-Q539 PolarHBondContact O-N 3.18Å; K535-Y567 HydrophobicContact CB-CE1 3.87Å; K535-Y567 HydrophobicContact CG-CE1 4.01Å; K535-Y567 PolarHBondContact N-OH 3.07Å; K535-D575 VanDerWaalsContact CD-OD1 3.31Å; K535-D575 WeakPolarHBondContact CD-OD1 3.49Å; K535-D575 WeakPolarHBondContact CE-OD1 3.5Å; K535-D575 IonicContact NZ-OD1 3.64Å; K535-D575 PolarHBondContact NZ-OD1 3.26Å; K535-D576 WeakPolarHBondContact CE-OD2 3.49Å; K535-D576 IonicContact NZ-OD2 3.6Å; K535-D576 PolarHBondContact NZ-OD2 3.2Å; K535-L580 HydrophobicContact CG-CD2 3.6Å
536	Y	90.4	Very high	85.9	Confident	81 Å²	81	45.3 Å²	45.3	32%	0.318	23%	0.227	S	C	.	.	H	α-helix	trans	-59.1	-45.1	175.2	-173.1	-86	0	0	0	111.4	K499 D503 E533 L534 I538 Q539 R540	K499-Y536 HydrophobicContact CD-CD1 4.02Å; K499-Y536 HydrophobicContact CD-CG 4.13Å; K499-Y536 HydrophobicContact CG-CD1 3.61Å; K499-Y536 HydrophobicContact CG-CE1 4.05Å; K499-Y536 HydrophobicContact CG-CG 4.22Å; D503-Y536 WeakPolarHBondContact OD1-CE1 3.31Å; D503-Y536 PolarHBondContact OD1-OH 3.33Å; E533-Y536 WeakPolarHBondContact O-CB 3.45Å; E533-Y536 PolarHBondContact O-N 3.04Å; L534-Y536 PolarHBondContact O-N 3.48Å; Y536-I538 VanDerWaalsContact C-N 3.33Å; Y536-I538 PolarHBondContact O-N 3.15Å; Y536-Q539 WeakPolarHBondContact O-CB 3.36Å; Y536-Q539 PolarHBondContact O-N 3.22Å; Y536-R540 HydrophobicContact CD1-CG 3.88Å; Y536-R540 HydrophobicContact CE1-CG 3.57Å; Y536-R540 WeakPolarHBondContact O-CG 3.36Å; Y536-R540 PolarHBondContact O-N 3.05Å
537	V	90.2	Very high	85.7	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-58.1	-45.4	175.9	178.2	0	0	0	0	111.2	L498 K499 L511 L515 L534 K535 R540 F541	L498-V537 HydrophobicContact CB-CG2 4.44Å; K499-V537 HydrophobicContact CB-CG2 4.4Å; L511-V537 HydrophobicContact CD2-CG1 4.33Å; L515-V537 HydrophobicContact CD1-CG1 3.96Å; L534-V537 HydrophobicContact CD1-CB 4.39Å; L534-V537 WeakPolarHBondContact O-CA 3.43Å; L534-V537 WeakPolarHBondContact O-CB 3.32Å; L534-V537 PolarHBondContact O-N 3.06Å; K535-V537 VanDerWaalsContact C-N 3.34Å; K535-V537 PolarHBondContact O-N 3.05Å; V537-R540 PolarHBondContact O-N 2.67Å; V537-F541 HydrophobicContact CG1-CD2 4.49Å; V537-F541 HydrophobicContact CG1-CE1 4.13Å; V537-F541 HydrophobicContact CG1-CE2 3.79Å; V537-F541 HydrophobicContact CG1-CZ 3.57Å; V537-F541 WeakPolarHBondContact O-CG 3.35Å; V537-F541 PolarHBondContact O-N 2.72Å; V537-F541 VanDerWaalsContact O-N 3.15Å
538	I	89.4	Confident	85.4	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.1	-34.5	178.8	-56.1	-52	0	0	0	111.7	L534 K535 Y536 F541 A542 L553 W563 Y567 L580 M584	L534-I538 PolarHBondContact O-N 2.86Å; K535-I538 PolarHBondContact O-N 3.06Å; Y536-I538 VanDerWaalsContact C-N 3.33Å; Y536-I538 PolarHBondContact O-N 3.15Å; I538-F541 HydrophobicContact CD1-CD2 3.87Å; I538-F541 HydrophobicContact CD1-CE2 4.05Å; I538-F541 WeakPolarHBondContact O-CB 3.47Å; I538-F541 PolarHBondContact O-N 3.41Å; I538-A542 PolarHBondContact O-N 3.09Å; I538-L553 HydrophobicContact CG2-CD2 3.94Å; I538-W563 HydrophobicContact CD1-CB 4.4Å; I538-W563 HydrophobicContact CD1-CD2 3.64Å; I538-W563 HydrophobicContact CD1-CE3 3.99Å; I538-W563 HydrophobicContact CD1-CG 3.83Å; I538-W563 HydrophobicContact CD1-CZ2 4.45Å; I538-W563 HydrophobicContact CG1-CD2 4.27Å; I538-W563 HydrophobicContact CG1-CE3 4.17Å; I538-W563 HydrophobicContact CG2-CB 4.42Å; I538-Y567 HydrophobicContact CB-CE2 4.38Å; I538-Y567 HydrophobicContact CG1-CE2 3.88Å; I538-Y567 HydrophobicContact CG2-CD2 4.43Å; I538-L580 HydrophobicContact CB-CD2 4.19Å; I538-L580 HydrophobicContact CG2-CD2 4.06Å; I538-M584 HydrophobicContact CG2-CE 4.39Å; I538-M584 HydrophobicContact CG2-SD 3.83Å
539	Q	89.5	Confident	85.4	Confident	70 Å²	70	49.4 Å²	49.4	33%	0.327	23%	0.227	S	C	.	.	H	α-helix	trans	-61.7	-45.2	171.6	-175	-178.3	-17.8	0	0	111.2	K535 Y536 F541 A542 E543 L580	K535-Q539 WeakPolarHBondContact O-CB 3.5Å; K535-Q539 PolarHBondContact O-N 3.18Å; Y536-Q539 WeakPolarHBondContact O-CB 3.36Å; Y536-Q539 PolarHBondContact O-N 3.22Å; Q539-F541 PolarHBondContact O-N 2.81Å; Q539-A542 CarbonylContact O-C 3.57Å; Q539-A542 WeakPolarHBondContact O-CB 3.45Å; Q539-A542 PolarHBondContact O-N 2.76Å; Q539-E543 HydrophobicContact CG-CG 4.43Å; Q539-E543 WeakPolarHBondContact CG-OE1 3.28Å; Q539-E543 PolarHBondContact NE2-OE1 3.42Å; Q539-E543 WeakPolarHBondContact O-CG 3.05Å; Q539-E543 PolarHBondContact O-N 2.91Å; Q539-L580 HydrophobicContact CB-CD1 3.9Å; Q539-L580 HydrophobicContact CG-CD1 4.38Å
540	R	88.8	Confident	85.3	Confident	54 Å²	54	45.1 Å²	45.1	20%	0.204	21%	0.209	C	C	.	.	H	α-helix	trans	-64.3	-21.4	175.6	-63.1	-60.6	-68.1	153.6	-3.8	113.6	R508 Y536 V537 E543	R508-R540 WeakPolarHBondContact CD-O 3.43Å; R508-R540 PolarHBondContact NH1-O 3.14Å; Y536-R540 HydrophobicContact CD1-CG 3.88Å; Y536-R540 HydrophobicContact CE1-CG 3.57Å; Y536-R540 WeakPolarHBondContact O-CG 3.36Å; Y536-R540 PolarHBondContact O-N 3.05Å; V537-R540 PolarHBondContact O-N 2.67Å; R540-E543 IonicContact CZ-OE2 2.79Å; R540-E543 IonicContact NH1-OE2 3.14Å; R540-E543 PolarHBondContact NH1-OE2 3.35Å
541	F	88.4	Confident	84.8	Confident	0 Å²	0	47.2 Å²	47.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-82.2	-33.1	169.7	-63.2	-17.9	0	0	0	113.3	L511 A512 L515 V537 I538 Q539 V549 L553	L511-F541 HydrophobicContact CB-CZ 4.36Å; L511-F541 HydrophobicContact CD2-CE1 4.17Å; L511-F541 HydrophobicContact CD2-CZ 4.05Å; L511-F541 HydrophobicContact CG-CE1 4.37Å; L511-F541 HydrophobicContact CG-CZ 3.94Å; A512-F541 HydrophobicContact CB-CD1 4.34Å; A512-F541 HydrophobicContact CB-CD2 4.39Å; A512-F541 HydrophobicContact CB-CE1 4.08Å; A512-F541 HydrophobicContact CB-CE2 4.13Å; A512-F541 HydrophobicContact CB-CG 4.5Å; A512-F541 HydrophobicContact CB-CZ 3.97Å; L515-F541 HydrophobicContact CD1-CE2 4.06Å; L515-F541 HydrophobicContact CD1-CZ 4.07Å; V537-F541 HydrophobicContact CG1-CD2 4.49Å; V537-F541 HydrophobicContact CG1-CE1 4.13Å; V537-F541 HydrophobicContact CG1-CE2 3.79Å; V537-F541 HydrophobicContact CG1-CZ 3.57Å; V537-F541 WeakPolarHBondContact O-CG 3.35Å; V537-F541 PolarHBondContact O-N 2.72Å; V537-F541 VanDerWaalsContact O-N 3.15Å; I538-F541 HydrophobicContact CD1-CD2 3.87Å; I538-F541 HydrophobicContact CD1-CE2 4.05Å; I538-F541 WeakPolarHBondContact O-CB 3.47Å; I538-F541 PolarHBondContact O-N 3.41Å; Q539-F541 PolarHBondContact O-N 2.81Å; F541-V549 HydrophobicContact CB-CG1 3.62Å; F541-V549 HydrophobicContact CD1-CG1 3.9Å; F541-V549 HydrophobicContact CG-CG1 3.93Å; F541-V549 WeakPolarHBondContact O-CG1 3.45Å; F541-L553 HydrophobicContact CB-CD2 3.96Å
542	A	85	Confident	84.5	Confident	1 Å²	1	46.9 Å²	46.9	1%	0.008	22%	0.222	C	C	.	.	H	α-helix	trans	-70.1	-34.3	171.6	0	0	0	0	0	111.6	I538 Q539 L580 M584 I587	I538-A542 PolarHBondContact O-N 3.09Å; Q539-A542 CarbonylContact O-C 3.57Å; Q539-A542 WeakPolarHBondContact O-CB 3.45Å; Q539-A542 PolarHBondContact O-N 2.76Å; A542-L580 HydrophobicContact CB-CD1 4.47Å; A542-M584 HydrophobicContact CB-CG 3.86Å; A542-I587 WeakPolarHBondContact O-CD1 3.43Å; A542-I587 WeakPolarHBondContact O-CG1 3.4Å; A542-I587 WeakPolarHBondContact O-CG2 3.28Å
543	E	86.1	Confident	84.2	Confident	90 Å²	90	40.7 Å²	40.7	42%	0.421	20%	0.195	S	C	.	.	S	Bend	trans	-79.1	-10.8	178.3	-70.1	170.6	-177.3	0	0	114.5	Q539 R540	Q539-E543 HydrophobicContact CG-CG 4.43Å; Q539-E543 WeakPolarHBondContact CG-OE1 3.28Å; Q539-E543 PolarHBondContact NE2-OE1 3.42Å; Q539-E543 WeakPolarHBondContact O-CG 3.05Å; Q539-E543 PolarHBondContact O-N 2.91Å; R540-E543 IonicContact CZ-OE2 2.79Å; R540-E543 IonicContact NH1-OE2 3.14Å; R540-E543 PolarHBondContact NH1-OE2 3.35Å
544	D	84.2	Confident	83.5	Confident	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.197	C	C	.	.			trans	-77.1	141.1	177.5	-162.2	-87.2	0	0	0	110.9	R508 R546 V549 H550	R508-D544 IonicContact CZ-OD2 3.86Å; R508-D544 IonicContact NE-OD2 2.68Å; R508-D544 PolarHBondContact NE-OD2 2.73Å; R508-D544 IonicContact NH1-OD2 3.31Å; R508-D544 PolarHBondContact NH1-OD2 3.09Å; R508-D544 IonicContact NH2-OD2 3.29Å; R508-D544 PolarHBondContact NH2-OD2 3.27Å; D544-R546 WeakPolarHBondContact OD1-CB 3.29Å; D544-R546 WeakPolarHBondContact OD1-CG 3.38Å; D544-R546 PolarHBondContact OD1-N 2.73Å; D544-V549 HydrophobicContact CB-CB 4.24Å; D544-V549 HydrophobicContact CB-CG1 4.04Å; D544-V549 HydrophobicContact CB-CG2 4.24Å; D544-H550 PolarHBondContact O-NE2 3.37Å
545	P	80.1	Confident	82.3	Confident	107 Å²	107	42.8 Å²	42.8	70%	0.695	21%	0.211	S	C	*	.			trans	-84.3	-5.5	178.4	32.9	-36.5	0	0	0	114.7
546	R	83.1	Confident	81	Confident	98 Å²	98	45.2 Å²	45.2	37%	0.37	23%	0.228	S	C	.	.			trans	-87.9	124.8	-171.6	-56.1	176	-162.4	173.9	16	111.8	D505 P509 D544 E548 V549 H550	D505-R546 PolarHBondContact O-NH1 2.75Å; D505-R546 PolarHBondContact O-NH2 3.44Å; P509-R546 VanDerWaalsContact CG-NH1 3.35Å; D544-R546 WeakPolarHBondContact OD1-CB 3.29Å; D544-R546 WeakPolarHBondContact OD1-CG 3.38Å; D544-R546 PolarHBondContact OD1-N 2.73Å; R546-E548 HydrophobicContact CB-CG 3.98Å; R546-E548 WeakPolarHBondContact CD-OE1 3.42Å; R546-E548 IonicContact NH1-OE1 3.79Å; R546-E548 PolarHBondContact O-N 3.23Å; R546-V549 HydrophobicContact CB-CG2 4.33Å; R546-V549 WeakPolarHBondContact O-CB 3.35Å; R546-V549 PolarHBondContact O-N 2.97Å; R546-H550 PolarHBondContact O-CD2 3.27Å; R546-H550 PolarHBondContact O-N 3.11Å; R546-H550 PolarHBondContact O-NE2 3.22Å
547	Q	77.4	Confident	79.4	Confident	108 Å²	108	49.6 Å²	49.6	51%	0.505	24%	0.244	S	C	.	.	H	α-helix	trans	-55.7	-30.8	-178.5	-59.4	-177.8	0.8	0	0	114.1	V549 H550 S551 Y593	Q547-V549 VanDerWaalsContact C-N 3.33Å; Q547-V549 PolarHBondContact O-N 3.32Å; Q547-H550 PolarHBondContact O-N 3.28Å; Q547-S551 PolarHBondContact O-N 3Å; Q547-Y593 PolarHBondContact O-OH 2.9Å
548	E	76.3	Confident	77.6	Confident	111 Å²	111	55.5 Å²	55.5	52%	0.519	29%	0.286	S	S	.	.	H	α-helix	trans	-60.3	-39.9	174.9	62.9	-169.6	171.4	0	0	112.4	P509 R546 S551	P509-E548 HydrophobicContact CB-CG 3.99Å; P509-E548 WeakPolarHBondContact CB-OE1 3.35Å; P509-E548 HydrophobicContact CG-CG 4.4Å; P509-E548 VanDerWaalsContact CG-OE1 3.26Å; P509-E548 WeakPolarHBondContact CG-OE1 3.47Å; R546-E548 HydrophobicContact CB-CG 3.98Å; R546-E548 WeakPolarHBondContact CD-OE1 3.42Å; R546-E548 IonicContact NH1-OE1 3.79Å; R546-E548 PolarHBondContact O-N 3.23Å; E548-S551 PolarHBondContact O-OG 3.21Å
549	V	81.3	Confident	76.1	Confident	0 Å²	0	59.7 Å²	59.7	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-69	-41.8	177.4	-179.7	0	0	0	0	110.5	P509 A512 F541 D544 R546 Q547 S551 C552	P509-V549 HydrophobicContact CB-CG2 4.27Å; P509-V549 HydrophobicContact CG-CG2 4.07Å; A512-V549 HydrophobicContact CB-CG1 4.17Å; F541-V549 HydrophobicContact CB-CG1 3.62Å; F541-V549 HydrophobicContact CD1-CG1 3.9Å; F541-V549 HydrophobicContact CG-CG1 3.93Å; F541-V549 WeakPolarHBondContact O-CG1 3.45Å; D544-V549 HydrophobicContact CB-CB 4.24Å; D544-V549 HydrophobicContact CB-CG1 4.04Å; D544-V549 HydrophobicContact CB-CG2 4.24Å; R546-V549 HydrophobicContact CB-CG2 4.33Å; R546-V549 WeakPolarHBondContact O-CB 3.35Å; R546-V549 PolarHBondContact O-N 2.97Å; Q547-V549 VanDerWaalsContact C-N 3.33Å; Q547-V549 PolarHBondContact O-N 3.32Å; V549-S551 PolarHBondContact O-N 3.01Å; V549-C552 VanDerWaalsContact O-CB 3.23Å; V549-C552 WeakPolarHBondContact O-CB 3.48Å; V549-C552 PolarHBondContact O-N 2.93Å
550	H	80.1	Confident	74.9	Confident	6 Å²	6	63 Å²	63	3%	0.028	34%	0.342	C	S	.	.	H	α-helix	trans	-63.2	-31.3	-177.9	-53.6	-176.4	0	0	0	111.9	D544 R546 Q547 C552 L553 I587 L588 S591 Y593	D544-H550 PolarHBondContact O-NE2 3.37Å; R546-H550 PolarHBondContact O-CD2 3.27Å; R546-H550 PolarHBondContact O-N 3.11Å; R546-H550 PolarHBondContact O-NE2 3.22Å; Q547-H550 PolarHBondContact O-N 3.28Å; H550-C552 PolarHBondContact O-N 3.06Å; H550-L553 WeakPolarHBondContact O-CB 3.28Å; H550-L553 PolarHBondContact O-N 3.43Å; H550-I587 WeakPolarHBondContact CE1-CG2 3.25Å; H550-I587 WeakPolarHBondContact NE2-CG2 3.41Å; H550-L588 HydrophobicContact CB-CD2 4.22Å; H550-S591 WeakPolarHBondContact ND1-CB 3.32Å; H550-S591 PolarHBondContact ND1-OG 3.15Å; H550-Y593 HydrophobicContact CB-CE2 4.49Å
551	S	76.9	Confident	73.9	Confident	46 Å²	46	66.2 Å²	66.2	32%	0.322	36%	0.363	S	S	.	.	H	α-helix	trans	-60.1	-27.9	177	79.3	0	0	0	0	112.9	Q516 Q547 E548 V549 L553	Q516-S551 PolarHBondContact NE2-O 3.35Å; Q547-S551 PolarHBondContact O-N 3Å; E548-S551 PolarHBondContact O-OG 3.21Å; V549-S551 PolarHBondContact O-N 3.01Å; S551-L553 VanDerWaalsContact C-N 3.34Å; S551-L553 PolarHBondContact O-N 2.89Å
552	C	78.3	Confident	73.4	Confident	1 Å²	1	66.4 Å²	66.4	1%	0.007	37%	0.366	C	S	.	.	H	α-helix	trans	-63.7	-37.6	174.1	177.3	0	0	0	0	112.5	A512 Q516 V549 H550 L554	A512-C552 HydrophobicContact CB-CB 3.75Å; A512-C552 PolarHBondContact O-SG 3.34Å; Q516-C552 PolarHBondContact NE2-O 3.25Å; V549-C552 VanDerWaalsContact O-CB 3.23Å; V549-C552 WeakPolarHBondContact O-CB 3.48Å; V549-C552 PolarHBondContact O-N 2.93Å; H550-C552 PolarHBondContact O-N 3.06Å; C552-L554 PolarHBondContact O-N 3.21Å
553	L	78.2	Confident	73.2	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-62.2	-34.5	-176.1	-59.1	-179	0	0	0	112.1	I538 F541 H550 S551 W563 F564 M584	I538-L553 HydrophobicContact CG2-CD2 3.94Å; F541-L553 HydrophobicContact CB-CD2 3.96Å; H550-L553 WeakPolarHBondContact O-CB 3.28Å; H550-L553 PolarHBondContact O-N 3.43Å; S551-L553 VanDerWaalsContact C-N 3.34Å; S551-L553 PolarHBondContact O-N 2.89Å; L553-W563 PolarHBondContact O-N 2.95Å; L553-F564 VanDerWaalsContact O-CB 3.29Å; L553-F564 WeakPolarHBondContact O-CB 3.21Å; L553-F564 PolarHBondContact O-N 3.47Å; L553-M584 HydrophobicContact CB-CE 3.9Å; L553-M584 HydrophobicContact CD1-CB 4.34Å; L553-M584 HydrophobicContact CD1-CE 4.35Å; L553-M584 HydrophobicContact CD1-CG 4.18Å; L553-M584 HydrophobicContact CD2-CE 3.95Å; L553-M584 HydrophobicContact CG-CE 4.27Å
554	L	73.4	Confident	72.9	Confident	48 Å²	48	62.6 Å²	62.6	25%	0.251	35%	0.347	S	S	.	.	S	Bend	trans	-78.6	161.5	177.9	-61.8	176.2	0	0	0	112.1	Q516 C552 L588 F598	Q516-L554 PolarHBondContact NE2-O 3.43Å; C552-L554 PolarHBondContact O-N 3.21Å; L554-L588 HydrophobicContact CD1-CD2 4.1Å; L554-L588 HydrophobicContact CD2-CD1 3.9Å; L554-L588 HydrophobicContact CD2-CD2 4.1Å; L554-L588 HydrophobicContact CG-CD2 3.93Å; L554-F598 HydrophobicContact CD2-CD2 4.49Å; L554-F598 HydrophobicContact CD2-CE2 4.05Å
555	S	64.4	Low	72.6	Confident	44 Å²	44	64.7 Å²	64.7	31%	0.308	36%	0.357	S	S	.	.			trans	-79.1	136.2	175.6	56.1	0	0	0	0	112.3	R557 K560	S555-R557 PolarHBondContact O-N 3.4Å; S555-K560 WeakPolarHBondContact CB-O 3.31Å
556	V	59	Low	72.6	Confident	84 Å²	84	60.5 Å²	60.5	51%	0.509	33%	0.329	S	S	.	.	S	Bend	trans	-68	-24	178	-174.8	0	0	0	0	112.3	Q516 P517	Q516-V556 HydrophobicContact CG-CG2 3.46Å; Q516-V556 VanDerWaalsContact CG-CG2 3.46Å; P517-V556 HydrophobicContact CB-CG2 4.39Å
557	R	57.3	Low	72.6	Confident	173 Å²	173	55.9 Å²	55.9	65%	0.653	31%	0.311	S	S	*	.	S	Bend	trans	-138.4	138.8	-176.4	-59.2	-173.6	-173.8	-174.4	2.1	110	S555 G559 K560	S555-R557 PolarHBondContact O-N 3.4Å; R557-G559 PolarHBondContact O-N 3.29Å; R557-K560 PolarHBondContact O-N 3.39Å
558	S	53.1	Low	72.7	Confident	124 Å²	124	50.7 Å²	50.7	87%	0.867	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	129.9	168	48.8	0	0	0	0	110.5
559	G	57.5	Low	72.7	Confident	88 Å²	88	46.2 Å²	46.2	91%	0.907	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.6	7.3	178.6	0	0	0	0	0	116.2	R557	R557-G559 PolarHBondContact O-N 3.29Å
560	K	65.1	Low	72.2	Confident	139 Å²	139	49 Å²	49	60%	0.604	30%	0.296	S	S	*	.	S	Bend	trans	-112.9	138.7	163.1	-76	-163.8	173.5	-165.3	0	110.6	S555 R557 G562	S555-K560 WeakPolarHBondContact CB-O 3.31Å; R557-K560 PolarHBondContact O-N 3.39Å; K560-G562 PolarHBondContact O-N 3.08Å
561	D	66.3	Low	71.9	Confident	121 Å²	121	49.3 Å²	49.3	65%	0.647	30%	0.301	S	S	*	.			trans	-64.2	126.4	174.3	-60.1	-50.8	0	0	0	110.8	Q565	D561-Q565 HydrophobicContact CB-CB 3.97Å; D561-Q565 WeakPolarHBondContact OD1-CB 3.41Å
562	G	77.8	Confident	71.8	Confident	5 Å²	5	51.6 Å²	51.6	5%	0.052	31%	0.313	C	S	.	.			trans	-97.6	-177.3	164.1	0	0	0	0	0	110.7	K560 F564 Q565 L566	K560-G562 PolarHBondContact O-N 3.08Å; G562-F564 PolarHBondContact O-N 2.96Å; G562-Q565 PolarHBondContact O-N 2.99Å; G562-Q565 VanDerWaalsContact O-N 3.07Å; G562-Q565 PolarHBondContact O-OE1 3.5Å; G562-L566 PolarHBondContact O-N 3.14Å; G562-L566 VanDerWaalsContact O-N 3.14Å
563	W	81.9	Confident	71.6	Confident	1 Å²	1	51.6 Å²	51.6	0%	0.004	31%	0.313	C	S	.	.	H	α-helix	trans	-56.9	-36.4	178.8	-62.5	115.7	0	0	0	112.1	L515 I518 F520 L525 L534 I538 L553 Q565 L566 Y567 M584	L515-W563 HydrophobicContact CB-CZ2 4.39Å; L515-W563 PolarHBondContact O-NE1 2.86Å; L515-W563 VanDerWaalsContact O-NE1 3.13Å; I518-W563 HydrophobicContact CB-CH2 4.39Å; I518-W563 HydrophobicContact CB-CZ2 4.22Å; I518-W563 HydrophobicContact CD1-CD2 4.14Å; I518-W563 HydrophobicContact CD1-CE3 4.08Å; I518-W563 HydrophobicContact CD1-CZ3 4.29Å; I518-W563 HydrophobicContact CG1-CD2 4.03Å; I518-W563 HydrophobicContact CG1-CE3 4.33Å; I518-W563 HydrophobicContact CG1-CH2 4.22Å; I518-W563 HydrophobicContact CG1-CZ2 3.91Å; I518-W563 HydrophobicContact CG1-CZ3 4.41Å; I518-W563 HydrophobicContact CG2-CH2 3.7Å; I518-W563 HydrophobicContact CG2-CZ2 3.99Å; I518-W563 HydrophobicContact CG2-CZ3 4.17Å; F520-W563 AromaticContact CD2-CH2 3.68Å; F520-W563 HydrophobicContact CD2-CH2 3.68Å; F520-W563 HydrophobicContact CD2-CZ2 4.25Å; F520-W563 AromaticContact CE2-CH2 3.67Å; F520-W563 HydrophobicContact CE2-CH2 3.67Å; F520-W563 HydrophobicContact CE2-CZ2 4.02Å; L525-W563 HydrophobicContact CD2-CZ3 4.39Å; L534-W563 HydrophobicContact CD1-CH2 4.3Å; L534-W563 HydrophobicContact CD2-CH2 3.69Å; L534-W563 HydrophobicContact CD2-CZ3 3.63Å; L534-W563 HydrophobicContact CG-CH2 4.34Å; L534-W563 HydrophobicContact CG-CZ3 4.26Å; I538-W563 HydrophobicContact CD1-CB 4.4Å; I538-W563 HydrophobicContact CD1-CD2 3.64Å; I538-W563 HydrophobicContact CD1-CE3 3.99Å; I538-W563 HydrophobicContact CD1-CG 3.83Å; I538-W563 HydrophobicContact CD1-CZ2 4.45Å; I538-W563 HydrophobicContact CG1-CD2 4.27Å; I538-W563 HydrophobicContact CG1-CE3 4.17Å; I538-W563 HydrophobicContact CG2-CB 4.42Å; L553-W563 PolarHBondContact O-N 2.95Å; W563-Q565 PolarHBondContact O-N 2.9Å; W563-L566 HydrophobicContact CE3-CD2 3.98Å; W563-L566 HydrophobicContact CZ3-CD2 3.87Å; W563-L566 PolarHBondContact O-N 3.22Å; W563-Y567 HydrophobicContact CE3-CE2 4.03Å; W563-Y567 HydrophobicContact CZ3-CE2 4.47Å; W563-Y567 PolarHBondContact O-N 3.1Å; W563-M584 HydrophobicContact CB-CE 4.46Å
564	F	80	Confident	71.5	Confident	10 Å²	10	53 Å²	53	4%	0.044	32%	0.323	C	S	.	.	H	α-helix	trans	-56.2	-43.5	173.8	-171	-91.9	0	0	0	114.3	L553 G562 S568 F581 M584 V585 L588 F598 L602	L553-F564 VanDerWaalsContact O-CB 3.29Å; L553-F564 WeakPolarHBondContact O-CB 3.21Å; L553-F564 PolarHBondContact O-N 3.47Å; G562-F564 PolarHBondContact O-N 2.96Å; F564-S568 PolarHBondContact O-N 2.85Å; F564-F581 HydrophobicContact CD1-CE2 4.21Å; F564-F581 HydrophobicContact CD2-CE2 4.42Å; F564-F581 AromaticContact CE1-CE2 3.61Å; F564-F581 HydrophobicContact CE1-CE2 3.61Å; F564-F581 HydrophobicContact CE1-CZ 4.19Å; F564-F581 HydrophobicContact CE2-CD2 4.36Å; F564-F581 AromaticContact CE2-CE2 3.87Å; F564-F581 HydrophobicContact CE2-CE2 3.87Å; F564-F581 HydrophobicContact CE2-CZ 4.49Å; F564-F581 HydrophobicContact CZ-CD2 4.3Å; F564-F581 AromaticContact CZ-CE2 3.39Å; F564-F581 HydrophobicContact CZ-CE2 3.39Å; F564-F581 AromaticContact CZ-CZ 3.8Å; F564-F581 HydrophobicContact CZ-CZ 3.8Å; F564-M584 VanDerWaalsContact CA-CE 3.48Å; F564-M584 HydrophobicContact CB-CE 4.03Å; F564-M584 HydrophobicContact CD2-CE 4.11Å; F564-V585 HydrophobicContact CE2-CG2 3.4Å; F564-V585 HydrophobicContact CZ-CG2 3.65Å; F564-L588 HydrophobicContact CD2-CD1 3.66Å; F564-L588 HydrophobicContact CE2-CD1 3.79Å; F564-F598 HydrophobicContact CE2-CE2 4.32Å; F564-F598 AromaticContact CE2-CZ 3.94Å; F564-F598 HydrophobicContact CE2-CZ 3.94Å; F564-F598 HydrophobicContact CZ-CE2 4.3Å; F564-F598 AromaticContact CZ-CZ 3.99Å; F564-F598 HydrophobicContact CZ-CZ 3.99Å; F564-L602 HydrophobicContact CE1-CD1 4.04Å; F564-L602 HydrophobicContact CZ-CD1 3.67Å
565	Q	77.5	Confident	71.7	Confident	45 Å²	45	54.8 Å²	54.8	21%	0.21	33%	0.332	C	S	.	.	H	α-helix	trans	-73.7	-38.7	178.4	-71	78	8.8	0	0	111.3	D561 G562 W563 S568	D561-Q565 HydrophobicContact CB-CB 3.97Å; D561-Q565 WeakPolarHBondContact OD1-CB 3.41Å; G562-Q565 PolarHBondContact O-N 2.99Å; G562-Q565 VanDerWaalsContact O-N 3.07Å; G562-Q565 PolarHBondContact O-OE1 3.5Å; W563-Q565 PolarHBondContact O-N 2.9Å; Q565-S568 PolarHBondContact O-N 3.17Å; Q565-S568 PolarHBondContact O-OG 3.15Å
566	L	80.3	Confident	72.3	Confident	19 Å²	19	53.5 Å²	53.5	10%	0.099	32%	0.322	C	S	.	.	H	α-helix	trans	-66.6	-40.6	-174.5	-171	73	0	0	0	113.5	L525 G562 W563 G571 V572 A573	L525-L566 HydrophobicContact CD1-CD1 4.48Å; L525-L566 HydrophobicContact CD1-CD2 4.44Å; L525-L566 HydrophobicContact CD2-CD2 3.94Å; G562-L566 PolarHBondContact O-N 3.14Å; G562-L566 VanDerWaalsContact O-N 3.14Å; W563-L566 HydrophobicContact CE3-CD2 3.98Å; W563-L566 HydrophobicContact CZ3-CD2 3.87Å; W563-L566 PolarHBondContact O-N 3.22Å; L566-G571 CarbonylContact O-C 3.59Å; L566-V572 HydrophobicContact CD1-CB 4.48Å; L566-A573 HydrophobicContact CD1-CB 4.42Å; L566-A573 HydrophobicContact CD2-CB 3.94Å; L566-A573 HydrophobicContact CG-CB 3.74Å; L566-A573 PolarHBondContact O-N 3.44Å
567	Y	81.9	Confident	73	Confident	0 Å²	0	54 Å²	54	0%	0	32%	0.322	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	3.5	178.9	-71.9	-79.1	0	0	0	114	T531 K535 I538 W563 A573 L580	T531-Y567 PolarHBondContact O-OH 2.94Å; K535-Y567 HydrophobicContact CB-CE1 3.87Å; K535-Y567 HydrophobicContact CG-CE1 4.01Å; K535-Y567 PolarHBondContact N-OH 3.07Å; I538-Y567 HydrophobicContact CB-CE2 4.38Å; I538-Y567 HydrophobicContact CG1-CE2 3.88Å; I538-Y567 HydrophobicContact CG2-CD2 4.43Å; W563-Y567 HydrophobicContact CE3-CE2 4.03Å; W563-Y567 HydrophobicContact CZ3-CE2 4.47Å; W563-Y567 PolarHBondContact O-N 3.1Å; Y567-A573 HydrophobicContact CD1-CB 3.84Å; Y567-A573 VanDerWaalsContact CD1-O 3.29Å; Y567-A573 WeakPolarHBondContact CD1-O 3.4Å; Y567-A573 HydrophobicContact CE1-CB 3.53Å; Y567-A573 VanDerWaalsContact CE1-O 3.28Å; Y567-A573 WeakPolarHBondContact CE1-O 3.47Å; Y567-A573 HydrophobicContact CE2-CB 4.38Å; Y567-A573 HydrophobicContact CG-CB 4.39Å; Y567-L580 HydrophobicContact CD1-CD2 3.87Å; Y567-L580 HydrophobicContact CD2-CD2 4.26Å; Y567-L580 HydrophobicContact CE1-CD2 4.27Å; Y567-L580 HydrophobicContact CG-CD2 3.87Å
568	S	80.3	Confident	74.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	29%	0.291	C	S	.	.	S	Bend	trans	-65.5	150.2	172.9	65.6	0	0	0	0	111.7	F564 Q565 G570 G571 K606	F564-S568 PolarHBondContact O-N 2.85Å; Q565-S568 PolarHBondContact O-N 3.17Å; Q565-S568 PolarHBondContact O-OG 3.15Å; S568-G570 PolarHBondContact O-N 3.29Å; S568-G571 WeakPolarHBondContact O-CA 3.25Å; S568-G571 PolarHBondContact O-N 3.27Å; S568-K606 PolarHBondContact OG-NZ 3.36Å
569	P	76.3	Confident	75.5	Confident	16 Å²	16	46.4 Å²	46.4	10%	0.104	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-49	125.1	174.3	-29.8	33.1	0	0	0	112.9	F581 P609 L612 L613	P569-F581 HydrophobicContact CG-CD1 4.46Å; P569-P609 HydrophobicContact CB-CB 3.98Å; P569-P609 HydrophobicContact CB-CG 4.47Å; P569-P609 HydrophobicContact CG-CB 3.92Å; P569-L612 HydrophobicContact CB-CD2 4.05Å; P569-L613 HydrophobicContact CG-CD1 3.87Å; P569-L613 HydrophobicContact CG-CG 4.22Å
570	G	69.8	Low	76.8	Confident	59 Å²	59	42.5 Å²	42.5	61%	0.608	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	86.2	-1.5	-172.3	0	0	0	0	0	115.3	S568	S568-G570 PolarHBondContact O-N 3.29Å
571	G	74.7	Confident	77.8	Confident	12 Å²	12	35.9 Å²	35.9	12%	0.124	21%	0.21	C	C	.	.	S	Bend	trans	-77.9	156	171.7	0	0	0	0	0	112.9	L566 S568 A573 C574	L566-G571 CarbonylContact O-C 3.59Å; S568-G571 WeakPolarHBondContact O-CA 3.25Å; S568-G571 PolarHBondContact O-N 3.27Å; G571-A573 PolarHBondContact O-N 3.02Å; G571-C574 WeakPolarHBondContact O-CB 3.37Å; G571-C574 PolarHBondContact O-N 3.15Å; G571-C574 VanDerWaalsContact O-N 3.15Å
572	V	74.5	Confident	78.7	Confident	94 Å²	94	30.2 Å²	30.2	57%	0.57	18%	0.18	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-26.4	-171.5	-175	0	0	0	0	113.3	A526 L566	A526-V572 HydrophobicContact CB-CG1 4.27Å; L566-V572 HydrophobicContact CD1-CB 4.48Å
573	A	74.4	Confident	79	Confident	2 Å²	2	32.8 Å²	32.8	2%	0.017	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.1	3.7	-179.8	0	0	0	0	0	114.2	T531 L566 Y567 G571 D575	T531-A573 HydrophobicContact CG2-CB 3.72Å; L566-A573 HydrophobicContact CD1-CB 4.42Å; L566-A573 HydrophobicContact CD2-CB 3.94Å; L566-A573 HydrophobicContact CG-CB 3.74Å; L566-A573 PolarHBondContact O-N 3.44Å; Y567-A573 HydrophobicContact CD1-CB 3.84Å; Y567-A573 VanDerWaalsContact CD1-O 3.29Å; Y567-A573 WeakPolarHBondContact CD1-O 3.4Å; Y567-A573 HydrophobicContact CE1-CB 3.53Å; Y567-A573 VanDerWaalsContact CE1-O 3.28Å; Y567-A573 WeakPolarHBondContact CE1-O 3.47Å; Y567-A573 HydrophobicContact CE2-CB 4.38Å; Y567-A573 HydrophobicContact CG-CB 4.39Å; G571-A573 PolarHBondContact O-N 3.02Å; A573-D575 PolarHBondContact O-N 3.41Å
574	C	77	Confident	79.2	Confident	30 Å²	30	32.8 Å²	32.8	20%	0.203	20%	0.197	C	C	.	.			trans	-76.7	101.9	-179.9	-175.5	0	0	0	0	110.4	G571	G571-C574 WeakPolarHBondContact O-CB 3.37Å; G571-C574 PolarHBondContact O-N 3.15Å; G571-C574 VanDerWaalsContact O-N 3.15Å
575	D	76.3	Confident	79.3	Confident	84 Å²	84	32.3 Å²	32.3	45%	0.449	20%	0.195	S	C	.	.			trans	-106.7	-0.5	-179.2	76.1	-13.1	0	0	0	114.5	K535 A573	K535-D575 VanDerWaalsContact CD-OD1 3.31Å; K535-D575 WeakPolarHBondContact CD-OD1 3.49Å; K535-D575 WeakPolarHBondContact CE-OD1 3.5Å; K535-D575 IonicContact NZ-OD1 3.64Å; K535-D575 PolarHBondContact NZ-OD1 3.26Å; A573-D575 PolarHBondContact O-N 3.41Å
576	D	76.9	Confident	79.7	Confident	18 Å²	18	34.8 Å²	34.8	10%	0.096	21%	0.206	C	C	.	.	S	Bend	trans	-133.9	29.7	-162.4	64.5	-8.2	0	0	0	114.5	K535 G578 E579 L580	K535-D576 WeakPolarHBondContact CE-OD2 3.49Å; K535-D576 IonicContact NZ-OD2 3.6Å; K535-D576 PolarHBondContact NZ-OD2 3.2Å; D576-G578 PolarHBondContact O-N 3.15Å; D576-G578 PolarHBondContact OD1-N 3.21Å; D576-E579 HydrophobicContact CB-CB 4.46Å; D576-E579 PolarHBondContact O-N 3.25Å; D576-E579 VanDerWaalsContact O-N 3.16Å; D576-L580 WeakPolarHBondContact OD2-CB 3.3Å; D576-L580 PolarHBondContact OD2-N 3.47Å
577	D	74.9	Confident	79.8	Confident	94 Å²	94	36 Å²	36	50%	0.503	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.6	12.2	177.2	-87.4	-50.1	0	0	0	114.6	L613 R616	D577-L613 VanDerWaalsContact O-CD2 3.28Å; D577-L613 WeakPolarHBondContact O-CD2 3.48Å; D577-R616 PolarHBondContact O-NH1 2.92Å; D577-R616 IonicContact OD1-CZ 2.88Å; D577-R616 IonicContact OD1-NH1 2.89Å; D577-R616 PolarHBondContact OD1-NH1 3.03Å; D577-R616 IonicContact OD1-NH2 3.29Å; D577-R616 PolarHBondContact OD1-NH2 2.91Å
578	G	78.9	Confident	79.6	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	99.2	13.7	176.5	0	0	0	0	0	116.2	D576 F581 A582	D576-G578 PolarHBondContact O-N 3.15Å; D576-G578 PolarHBondContact OD1-N 3.21Å; G578-F581 WeakPolarHBondContact O-CB 3.44Å; G578-F581 PolarHBondContact O-N 3.06Å; G578-A582 PolarHBondContact O-N 3.24Å
579	E	83.4	Confident	79.5	Confident	137 Å²	137	38 Å²	38	64%	0.64	22%	0.223	S	C	*	.	H	α-helix	trans	-58.6	-51.7	178.6	-73	-175.8	167	0	0	112.8	D576 F581 A582 S583	D576-E579 HydrophobicContact CB-CB 4.46Å; D576-E579 PolarHBondContact O-N 3.25Å; D576-E579 VanDerWaalsContact O-N 3.16Å; E579-F581 VanDerWaalsContact C-N 3.27Å; E579-F581 PolarHBondContact O-N 3.45Å; E579-A582 WeakPolarHBondContact O-CB 3.34Å; E579-A582 PolarHBondContact O-N 2.98Å; E579-A582 VanDerWaalsContact O-N 3.08Å; E579-S583 PolarHBondContact O-N 3.06Å; E579-S583 VanDerWaalsContact O-N 3.08Å; E579-S583 PolarHBondContact O-OG 3.4Å
580	L	84.6	Confident	79.1	Confident	6 Å²	6	40.2 Å²	40.2	3%	0.031	25%	0.248	C	C	.	.	H	α-helix	trans	-59.3	-39.5	177.2	174.5	59.7	0	0	0	111.9	K535 I538 Q539 A542 Y567 D576 A582 S583 M584	K535-L580 HydrophobicContact CG-CD2 3.6Å; I538-L580 HydrophobicContact CB-CD2 4.19Å; I538-L580 HydrophobicContact CG2-CD2 4.06Å; Q539-L580 HydrophobicContact CB-CD1 3.9Å; Q539-L580 HydrophobicContact CG-CD1 4.38Å; A542-L580 HydrophobicContact CB-CD1 4.47Å; Y567-L580 HydrophobicContact CD1-CD2 3.87Å; Y567-L580 HydrophobicContact CD2-CD2 4.26Å; Y567-L580 HydrophobicContact CE1-CD2 4.27Å; Y567-L580 HydrophobicContact CG-CD2 3.87Å; D576-L580 WeakPolarHBondContact OD2-CB 3.3Å; D576-L580 PolarHBondContact OD2-N 3.47Å; L580-A582 VanDerWaalsContact C-N 3.3Å; L580-A582 PolarHBondContact O-N 3.43Å; L580-S583 PolarHBondContact O-N 3.08Å; L580-M584 HydrophobicContact CD1-CG 4.04Å; L580-M584 HydrophobicContact CD1-SD 4.2Å; L580-M584 HydrophobicContact CD2-SD 4.44Å; L580-M584 HydrophobicContact CG-CG 4.31Å; L580-M584 HydrophobicContact CG-SD 3.91Å; L580-M584 VanDerWaalsContact O-CG 3.26Å; L580-M584 WeakPolarHBondContact O-CG 3.47Å; L580-M584 PolarHBondContact O-N 3.04Å
581	F	85.7	Confident	78.9	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.2	-40.9	176.3	175.3	-97	0	0	0	111.6	F564 P569 G578 E579 M584 V585 L602 L613 M621	F564-F581 HydrophobicContact CD1-CE2 4.21Å; F564-F581 HydrophobicContact CD2-CE2 4.42Å; F564-F581 AromaticContact CE1-CE2 3.61Å; F564-F581 HydrophobicContact CE1-CE2 3.61Å; F564-F581 HydrophobicContact CE1-CZ 4.19Å; F564-F581 HydrophobicContact CE2-CD2 4.36Å; F564-F581 AromaticContact CE2-CE2 3.87Å; F564-F581 HydrophobicContact CE2-CE2 3.87Å; F564-F581 HydrophobicContact CE2-CZ 4.49Å; F564-F581 HydrophobicContact CZ-CD2 4.3Å; F564-F581 AromaticContact CZ-CE2 3.39Å; F564-F581 HydrophobicContact CZ-CE2 3.39Å; F564-F581 AromaticContact CZ-CZ 3.8Å; F564-F581 HydrophobicContact CZ-CZ 3.8Å; P569-F581 HydrophobicContact CG-CD1 4.46Å; G578-F581 WeakPolarHBondContact O-CB 3.44Å; G578-F581 PolarHBondContact O-N 3.06Å; E579-F581 VanDerWaalsContact C-N 3.27Å; E579-F581 PolarHBondContact O-N 3.45Å; F581-M584 PolarHBondContact O-N 3.34Å; F581-V585 HydrophobicContact CD1-CG2 4.31Å; F581-V585 HydrophobicContact CE1-CG2 4Å; F581-V585 HydrophobicContact CE2-CG2 4.2Å; F581-V585 HydrophobicContact CZ-CG2 3.94Å; F581-V585 VanDerWaalsContact O-CB 3.31Å; F581-V585 WeakPolarHBondContact O-CB 3.42Å; F581-V585 VanDerWaalsContact O-CG2 3.25Å; F581-V585 WeakPolarHBondContact O-CG2 3.19Å; F581-V585 PolarHBondContact O-N 3.47Å; F581-L602 HydrophobicContact CZ-CD1 4.25Å; F581-L613 HydrophobicContact CD1-CD1 3.59Å; F581-L613 HydrophobicContact CE1-CD1 4.16Å; F581-M621 HydrophobicContact CD1-CE 3.63Å; F581-M621 HydrophobicContact CE1-CE 3.55Å; F581-M621 HydrophobicContact CE1-SD 4.32Å
582	A	85	Confident	77.9	Confident	3 Å²	3	42.5 Å²	42.5	3%	0.025	25%	0.251	C	S	.	.	H	α-helix	trans	-64.5	-43	175.2	0	0	0	0	0	112.7	G578 E579 L580 V585 H586 N618 M621	G578-A582 PolarHBondContact O-N 3.24Å; E579-A582 WeakPolarHBondContact O-CB 3.34Å; E579-A582 PolarHBondContact O-N 2.98Å; E579-A582 VanDerWaalsContact O-N 3.08Å; L580-A582 VanDerWaalsContact C-N 3.3Å; L580-A582 PolarHBondContact O-N 3.43Å; A582-V585 PolarHBondContact O-N 3.3Å; A582-H586 PolarHBondContact O-N 2.74Å; A582-N618 WeakPolarHBondContact CB-ND2 3.3Å; A582-M621 HydrophobicContact CB-CE 3.96Å
583	S	85.3	Confident	77	Confident	59 Å²	59	42.1 Å²	42.1	41%	0.413	24%	0.24	S	C	.	.	H	α-helix	trans	-61.1	-45.5	175.4	-56.2	0	0	0	0	112.3	E579 L580 V585 H586 I587	E579-S583 PolarHBondContact O-N 3.06Å; E579-S583 VanDerWaalsContact O-N 3.08Å; E579-S583 PolarHBondContact O-OG 3.4Å; L580-S583 PolarHBondContact O-N 3.08Å; S583-V585 VanDerWaalsContact C-N 3.33Å; S583-V585 PolarHBondContact O-N 3.45Å; S583-H586 PolarHBondContact O-N 2.84Å; S583-I587 PolarHBondContact O-N 2.98Å
584	M	84.8	Confident	76.4	Confident	0 Å²	0	49.9 Å²	49.9	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-60	-43.5	175.2	-69.6	172.5	59.5	0	0	111.6	I538 A542 L553 W563 F564 L580 F581 I587 L588	I538-M584 HydrophobicContact CG2-CE 4.39Å; I538-M584 HydrophobicContact CG2-SD 3.83Å; A542-M584 HydrophobicContact CB-CG 3.86Å; L553-M584 HydrophobicContact CB-CE 3.9Å; L553-M584 HydrophobicContact CD1-CB 4.34Å; L553-M584 HydrophobicContact CD1-CE 4.35Å; L553-M584 HydrophobicContact CD1-CG 4.18Å; L553-M584 HydrophobicContact CD2-CE 3.95Å; L553-M584 HydrophobicContact CG-CE 4.27Å; W563-M584 HydrophobicContact CB-CE 4.46Å; F564-M584 VanDerWaalsContact CA-CE 3.48Å; F564-M584 HydrophobicContact CB-CE 4.03Å; F564-M584 HydrophobicContact CD2-CE 4.11Å; L580-M584 HydrophobicContact CD1-CG 4.04Å; L580-M584 HydrophobicContact CD1-SD 4.2Å; L580-M584 HydrophobicContact CD2-SD 4.44Å; L580-M584 HydrophobicContact CG-CG 4.31Å; L580-M584 HydrophobicContact CG-SD 3.91Å; L580-M584 VanDerWaalsContact O-CG 3.26Å; L580-M584 WeakPolarHBondContact O-CG 3.47Å; L580-M584 PolarHBondContact O-N 3.04Å; F581-M584 PolarHBondContact O-N 3.34Å; M584-I587 PolarHBondContact O-N 3.47Å; M584-L588 WeakPolarHBondContact O-CB 3.28Å; M584-L588 WeakPolarHBondContact O-CD1 3.48Å; M584-L588 WeakPolarHBondContact O-CG 3.43Å; M584-L588 PolarHBondContact O-N 3.28Å
585	V	83.5	Confident	76	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-65.6	-41.9	178.8	162.9	0	0	0	0	112.1	F564 F581 A582 S583 I587 L588 M589 T620 M621 I624	F564-V585 HydrophobicContact CE2-CG2 3.4Å; F564-V585 HydrophobicContact CZ-CG2 3.65Å; F581-V585 HydrophobicContact CD1-CG2 4.31Å; F581-V585 HydrophobicContact CE1-CG2 4Å; F581-V585 HydrophobicContact CE2-CG2 4.2Å; F581-V585 HydrophobicContact CZ-CG2 3.94Å; F581-V585 VanDerWaalsContact O-CB 3.31Å; F581-V585 WeakPolarHBondContact O-CB 3.42Å; F581-V585 VanDerWaalsContact O-CG2 3.25Å; F581-V585 WeakPolarHBondContact O-CG2 3.19Å; F581-V585 PolarHBondContact O-N 3.47Å; A582-V585 PolarHBondContact O-N 3.3Å; S583-V585 VanDerWaalsContact C-N 3.33Å; S583-V585 PolarHBondContact O-N 3.45Å; V585-I587 VanDerWaalsContact C-N 3.32Å; V585-I587 PolarHBondContact O-N 3.18Å; V585-L588 PolarHBondContact O-N 3.23Å; V585-M589 WeakPolarHBondContact O-CB 3.4Å; V585-M589 WeakPolarHBondContact O-CG 3.39Å; V585-M589 PolarHBondContact O-N 3.42Å; V585-T620 HydrophobicContact CG1-CG2 4.15Å; V585-M621 HydrophobicContact CB-CE 3.71Å; V585-M621 HydrophobicContact CG1-CE 3.67Å; V585-M621 HydrophobicContact CG1-SD 4.39Å; V585-M621 HydrophobicContact CG2-CE 3.86Å; V585-I624 HydrophobicContact CG1-CD1 3Å
586	H	84.8	Confident	75.8	Confident	98 Å²	98	52.5 Å²	52.5	45%	0.454	28%	0.283	S	S	.	.	H	α-helix	trans	-56.1	-47.2	176.3	-176.7	71.8	0	0	0	111.6	A582 S583 M589 G590 T620	A582-H586 PolarHBondContact O-N 2.74Å; S583-H586 PolarHBondContact O-N 2.84Å; H586-M589 WeakPolarHBondContact O-CB 3.48Å; H586-M589 PolarHBondContact O-N 2.97Å; H586-G590 PolarHBondContact O-N 3.08Å; H586-T620 HydrophobicContact CB-CG2 3.71Å; H586-T620 PolarHBondContact ND1-OG1 3.39Å
587	I	82.3	Confident	75.6	Confident	44 Å²	44	58.7 Å²	58.7	23%	0.226	31%	0.309	C	S	.	.	H	α-helix	trans	-76.7	-36.2	-174.5	-70	-86.5	0	0	0	111.4	A542 H550 S583 M584 V585 M589 G590 S591	A542-I587 WeakPolarHBondContact O-CD1 3.43Å; A542-I587 WeakPolarHBondContact O-CG1 3.4Å; A542-I587 WeakPolarHBondContact O-CG2 3.28Å; H550-I587 WeakPolarHBondContact CE1-CG2 3.25Å; H550-I587 WeakPolarHBondContact NE2-CG2 3.41Å; S583-I587 PolarHBondContact O-N 2.98Å; M584-I587 PolarHBondContact O-N 3.47Å; V585-I587 VanDerWaalsContact C-N 3.32Å; V585-I587 PolarHBondContact O-N 3.18Å; I587-M589 VanDerWaalsContact C-N 3.27Å; I587-M589 PolarHBondContact O-N 3.45Å; I587-G590 PolarHBondContact O-N 3.09Å; I587-S591 PolarHBondContact O-N 3.49Å; I587-S591 PolarHBondContact O-OG 2.88Å; I587-S591 VanDerWaalsContact O-OG 3.06Å
588	L	79.3	Confident	75.7	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.021	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-32.2	170.3	-74.2	168.6	0	0	0	112.6	H550 L554 F564 M584 V585 S591 F598	H550-L588 HydrophobicContact CB-CD2 4.22Å; L554-L588 HydrophobicContact CD1-CD2 4.1Å; L554-L588 HydrophobicContact CD2-CD1 3.9Å; L554-L588 HydrophobicContact CD2-CD2 4.1Å; L554-L588 HydrophobicContact CG-CD2 3.93Å; F564-L588 HydrophobicContact CD2-CD1 3.66Å; F564-L588 HydrophobicContact CE2-CD1 3.79Å; M584-L588 WeakPolarHBondContact O-CB 3.28Å; M584-L588 WeakPolarHBondContact O-CD1 3.48Å; M584-L588 WeakPolarHBondContact O-CG 3.43Å; M584-L588 PolarHBondContact O-N 3.28Å; V585-L588 PolarHBondContact O-N 3.23Å; L588-S591 PolarHBondContact O-OG 2.77Å; L588-F598 HydrophobicContact CB-CE1 4.21Å; L588-F598 HydrophobicContact CB-CE2 4.41Å; L588-F598 HydrophobicContact CB-CZ 3.96Å; L588-F598 HydrophobicContact CD1-CE2 4.1Å; L588-F598 HydrophobicContact CD1-CZ 3.98Å
589	M	76.3	Confident	75.7	Confident	39 Å²	39	55.5 Å²	55.5	19%	0.192	29%	0.29	C	S	.	.	H	α-helix	trans	-73.6	-37.3	172.3	-75.7	-66.7	-64.8	0	0	113.2	V585 H586 I587 F598 L599 I624 L627	V585-M589 WeakPolarHBondContact O-CB 3.4Å; V585-M589 WeakPolarHBondContact O-CG 3.39Å; V585-M589 PolarHBondContact O-N 3.42Å; H586-M589 WeakPolarHBondContact O-CB 3.48Å; H586-M589 PolarHBondContact O-N 2.97Å; I587-M589 VanDerWaalsContact C-N 3.27Å; I587-M589 PolarHBondContact O-N 3.45Å; M589-F598 HydrophobicContact CG-CE1 4.29Å; M589-F598 HydrophobicContact SD-CD1 3.85Å; M589-F598 HydrophobicContact SD-CE1 4.18Å; M589-L599 HydrophobicContact CE-CD1 4.32Å; M589-L599 HydrophobicContact CE-CD2 4.17Å; M589-L599 HydrophobicContact CE-CG 4.42Å; M589-L599 HydrophobicContact SD-CD2 3.86Å; M589-L599 HydrophobicContact SD-CG 4.15Å; M589-I624 HydrophobicContact CE-CG1 4.29Å; M589-I624 HydrophobicContact CG-CD1 3.75Å; M589-I624 HydrophobicContact CG-CG1 4.09Å; M589-I624 HydrophobicContact SD-CD1 4.48Å; M589-I624 HydrophobicContact SD-CG1 4.4Å; M589-L627 HydrophobicContact CE-CD1 3.59Å
590	G	69.1	Low	75.5	Confident	61 Å²	61	52 Å²	52	63%	0.629	28%	0.276	S	S	*	.	H	α-helix	trans	-72	-36.9	178	0	0	0	0	0	113.6	H586 I587	H586-G590 PolarHBondContact O-N 3.08Å; I587-G590 PolarHBondContact O-N 3.09Å
591	S	66	Low	75.2	Confident	7 Å²	7	54.7 Å²	54.7	5%	0.049	30%	0.295	C	S	.	.	S	Bend	trans	-74.6	135.3	172.2	58.6	0	0	0	0	112	H550 I587 L588 Y593	H550-S591 WeakPolarHBondContact ND1-CB 3.32Å; H550-S591 PolarHBondContact ND1-OG 3.15Å; I587-S591 PolarHBondContact O-N 3.49Å; I587-S591 PolarHBondContact O-OG 2.88Å; I587-S591 VanDerWaalsContact O-OG 3.06Å; L588-S591 PolarHBondContact O-OG 2.77Å; S591-Y593 PolarHBondContact O-N 3.32Å; S591-Y593 WeakPolarHBondContact OG-CD2 3.4Å
592	C	53.1	Low	74.9	Confident	113 Å²	113	54.8 Å²	54.8	76%	0.764	30%	0.295	S	S	*	.			trans	-72.4	39.5	-164.2	-50.7	0	0	0	0	116.5
593	Y	55.7	Low	74.6	Confident	85 Å²	85	55.5 Å²	55.5	33%	0.333	30%	0.301	S	S	.	.	S	Bend	trans	-68.9	142.5	163.6	-65.7	-75.6	0	0	0	109.8	Q547 H550 S591 T595	Q547-Y593 PolarHBondContact O-OH 2.9Å; H550-Y593 HydrophobicContact CB-CE2 4.49Å; S591-Y593 PolarHBondContact O-N 3.32Å; S591-Y593 WeakPolarHBondContact OG-CD2 3.4Å; Y593-T595 WeakPolarHBondContact O-CA 3.09Å; Y593-T595 PolarHBondContact O-N 3.03Å
594	K	61.8	Low	74.2	Confident	166 Å²	166	59.7 Å²	59.7	72%	0.722	31%	0.314	S	S	*	.			trans	-41.3	91	-179.9	-64	173.6	179.7	-179.6	0	111.4	K596 K597 F598	K594-K596 VanDerWaalsContact C-N 3.32Å; K594-K596 PolarHBondContact O-N 3.16Å; K594-K597 HydrophobicContact CB-CB 3.85Å; K594-K597 WeakPolarHBondContact O-CA 3.48Å; K594-K597 WeakPolarHBondContact O-CB 3.47Å; K594-K597 PolarHBondContact O-N 3.4Å; K594-F598 PolarHBondContact O-N 3.1Å
595	T	69.1	Low	73.7	Confident	57 Å²	57	64.8 Å²	64.8	35%	0.35	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-45.9	-164.4	50.3	0	0	0	0	111.3	Y593 K597 F598 L599	Y593-T595 WeakPolarHBondContact O-CA 3.09Å; Y593-T595 PolarHBondContact O-N 3.03Å; T595-K597 VanDerWaalsContact C-N 3.3Å; T595-K597 PolarHBondContact O-N 3.21Å; T595-F598 PolarHBondContact O-N 3.4Å; T595-L599 WeakPolarHBondContact O-CB 3.27Å; T595-L599 VanDerWaalsContact O-CG 3.28Å; T595-L599 WeakPolarHBondContact O-CG 3.36Å; T595-L599 PolarHBondContact O-N 2.75Å
596	K	71	Confident	73.3	Confident	112 Å²	112	67.1 Å²	67.1	49%	0.487	35%	0.352	S	S	.	.	H	α-helix	trans	-55.8	-37.6	173	-169.8	169.9	-175.4	170.8	0	113.7	K594 L600 I633	K594-K596 VanDerWaalsContact C-N 3.32Å; K594-K596 PolarHBondContact O-N 3.16Å; K596-L600 HydrophobicContact CG-CD1 4.29Å; K596-L600 WeakPolarHBondContact O-CB 3.31Å; K596-L600 WeakPolarHBondContact O-CD1 3.48Å; K596-L600 VanDerWaalsContact O-CG 3.25Å; K596-L600 WeakPolarHBondContact O-CG 3.5Å; K596-L600 PolarHBondContact O-N 2.68Å; K596-I633 HydrophobicContact CG-CD1 4.18Å; K596-I633 HydrophobicContact CG-CG1 4.33Å
597	K	73.8	Confident	73.1	Confident	148 Å²	148	63.7 Å²	63.7	64%	0.643	34%	0.337	S	S	*	.	H	α-helix	trans	-73.3	-39.3	177.9	-169.5	-176.1	178	-174.6	0	112	K594 T595 S601	K594-K597 HydrophobicContact CB-CB 3.85Å; K594-K597 WeakPolarHBondContact O-CA 3.48Å; K594-K597 WeakPolarHBondContact O-CB 3.47Å; K594-K597 PolarHBondContact O-N 3.4Å; T595-K597 VanDerWaalsContact C-N 3.3Å; T595-K597 PolarHBondContact O-N 3.21Å; K597-S601 PolarHBondContact O-N 2.93Å; K597-S601 VanDerWaalsContact O-N 3.11Å
598	F	77.1	Confident	73	Confident	26 Å²	26	63.3 Å²	63.3	11%	0.114	34%	0.343	C	S	.	.	H	α-helix	trans	-65.7	-46.7	174.8	178	-110.4	0	0	0	110.9	L554 F564 L588 M589 K594 T595 L600 S601 L602	L554-F598 HydrophobicContact CD2-CD2 4.49Å; L554-F598 HydrophobicContact CD2-CE2 4.05Å; F564-F598 HydrophobicContact CE2-CE2 4.32Å; F564-F598 AromaticContact CE2-CZ 3.94Å; F564-F598 HydrophobicContact CE2-CZ 3.94Å; F564-F598 HydrophobicContact CZ-CE2 4.3Å; F564-F598 AromaticContact CZ-CZ 3.99Å; F564-F598 HydrophobicContact CZ-CZ 3.99Å; L588-F598 HydrophobicContact CB-CE1 4.21Å; L588-F598 HydrophobicContact CB-CE2 4.41Å; L588-F598 HydrophobicContact CB-CZ 3.96Å; L588-F598 HydrophobicContact CD1-CE2 4.1Å; L588-F598 HydrophobicContact CD1-CZ 3.98Å; M589-F598 HydrophobicContact CG-CE1 4.29Å; M589-F598 HydrophobicContact SD-CD1 3.85Å; M589-F598 HydrophobicContact SD-CE1 4.18Å; K594-F598 PolarHBondContact O-N 3.1Å; T595-F598 PolarHBondContact O-N 3.4Å; F598-L600 PolarHBondContact O-N 2.9Å; F598-S601 PolarHBondContact O-N 2.77Å; F598-S601 VanDerWaalsContact O-N 3.17Å; F598-L602 HydrophobicContact CE1-CD2 4.41Å; F598-L602 WeakPolarHBondContact O-CB 3.39Å; F598-L602 PolarHBondContact O-N 3Å
599	L	78.3	Confident	73.1	Confident	0 Å²	0	64.3 Å²	64.3	0%	0	35%	0.35	C	S	.	.	H	α-helix	trans	-61.2	-38.2	175.8	-69.8	172.6	0	0	0	112.9	M589 T595 L602 A603 I624 L627 M628 Y631 I633	M589-L599 HydrophobicContact CE-CD1 4.32Å; M589-L599 HydrophobicContact CE-CD2 4.17Å; M589-L599 HydrophobicContact CE-CG 4.42Å; M589-L599 HydrophobicContact SD-CD2 3.86Å; M589-L599 HydrophobicContact SD-CG 4.15Å; T595-L599 WeakPolarHBondContact O-CB 3.27Å; T595-L599 VanDerWaalsContact O-CG 3.28Å; T595-L599 WeakPolarHBondContact O-CG 3.36Å; T595-L599 PolarHBondContact O-N 2.75Å; L599-L602 PolarHBondContact O-N 2.93Å; L599-A603 WeakPolarHBondContact O-CB 3.29Å; L599-A603 PolarHBondContact O-N 3.16Å; L599-I624 HydrophobicContact CD2-CG2 3.75Å; L599-L627 HydrophobicContact CD1-CB 4.32Å; L599-M628 HydrophobicContact CD2-CE 4.06Å; L599-M628 HydrophobicContact CD2-CG 4.19Å; L599-Y631 HydrophobicContact CD1-CD2 4.23Å; L599-I633 HydrophobicContact CB-CD1 3.34Å; L599-I633 HydrophobicContact CD1-CD1 3.69Å; L599-I633 HydrophobicContact CG-CD1 4.17Å
600	L	78.7	Confident	73.5	Confident	64 Å²	64	62.4 Å²	62.4	34%	0.335	34%	0.341	S	S	.	.	H	α-helix	trans	-58.4	-52.4	170.3	-82.8	161.1	0	0	0	111.4	K596 F598 L602 A603 E604 I633	K596-L600 HydrophobicContact CG-CD1 4.29Å; K596-L600 WeakPolarHBondContact O-CB 3.31Å; K596-L600 WeakPolarHBondContact O-CD1 3.48Å; K596-L600 VanDerWaalsContact O-CG 3.25Å; K596-L600 WeakPolarHBondContact O-CG 3.5Å; K596-L600 PolarHBondContact O-N 2.68Å; F598-L600 PolarHBondContact O-N 2.9Å; L600-L602 PolarHBondContact O-N 3.42Å; L600-A603 PolarHBondContact O-N 3.2Å; L600-E604 WeakPolarHBondContact O-CG 3.47Å; L600-E604 PolarHBondContact O-N 3.46Å; L600-I633 HydrophobicContact CD2-CG2 3.76Å; L600-I633 HydrophobicContact CG-CG2 3.93Å
601	S	78.8	Confident	74.2	Confident	62 Å²	62	60.2 Å²	60.2	43%	0.434	31%	0.314	S	S	.	.	H	α-helix	trans	-60.9	-33.8	178.8	-175.2	0	0	0	0	113	K597 F598 N605	K597-S601 PolarHBondContact O-N 2.93Å; K597-S601 VanDerWaalsContact O-N 3.11Å; F598-S601 PolarHBondContact O-N 2.77Å; F598-S601 VanDerWaalsContact O-N 3.17Å; S601-N605 PolarHBondContact O-N 3.33Å; S601-N605 PolarHBondContact O-ND2 3.08Å
602	L	79.4	Confident	75	Confident	3 Å²	3	61 Å²	61	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-70.7	-44.1	176.1	-168.2	67.7	0	0	0	111.7	F564 F581 F598 L599 L600 K606 L607 I624 M628	F564-L602 HydrophobicContact CE1-CD1 4.04Å; F564-L602 HydrophobicContact CZ-CD1 3.67Å; F581-L602 HydrophobicContact CZ-CD1 4.25Å; F598-L602 HydrophobicContact CE1-CD2 4.41Å; F598-L602 WeakPolarHBondContact O-CB 3.39Å; F598-L602 PolarHBondContact O-N 3Å; L599-L602 PolarHBondContact O-N 2.93Å; L600-L602 PolarHBondContact O-N 3.42Å; L602-K606 HydrophobicContact CD1-CB 4.03Å; L602-K606 CarbonylContact O-C 3.53Å; L602-K606 VanDerWaalsContact O-C 3.28Å; L602-K606 WeakPolarHBondContact O-CA 3.42Å; L602-K606 PolarHBondContact O-N 3Å; L602-L607 PolarHBondContact O-N 3.26Å; L602-I624 HydrophobicContact CD2-CG2 3.81Å; L602-M628 HydrophobicContact CB-CE 3.92Å; L602-M628 HydrophobicContact CD2-CE 3.7Å; L602-M628 HydrophobicContact CG-CE 3.88Å
603	A	78.5	Confident	76.4	Confident	18 Å²	18	56 Å²	56	15%	0.149	28%	0.283	C	S	.	.	H	α-helix	trans	-65.2	-41.8	177.4	0	0	0	0	0	112.3	L599 L600 L607 M628 I633 I634	L599-A603 WeakPolarHBondContact O-CB 3.29Å; L599-A603 PolarHBondContact O-N 3.16Å; L600-A603 PolarHBondContact O-N 3.2Å; A603-L607 WeakPolarHBondContact O-CB 3.34Å; A603-M628 HydrophobicContact CB-CE 4.13Å; A603-M628 HydrophobicContact CB-SD 4.23Å; A603-I633 HydrophobicContact CB-CG2 4.24Å; A603-I634 HydrophobicContact CB-CD1 4.25Å; A603-I634 HydrophobicContact CB-CG1 4.08Å
604	E	77.6	Confident	77.8	Confident	146 Å²	146	51.9 Å²	51.9	68%	0.682	27%	0.267	S	S	*	.	H	α-helix	trans	-63.8	-41.8	178.4	-74.5	168.3	-175.1	0	0	113.1	L600	L600-E604 WeakPolarHBondContact O-CG 3.47Å; L600-E604 PolarHBondContact O-N 3.46Å
605	N	73.4	Confident	78.9	Confident	108 Å²	108	45.2 Å²	45.2	58%	0.578	24%	0.239	S	C	*	.	H	α-helix	trans	-113.4	-20	-164.9	-62	-85.1	0	0	0	114.8	S601	S601-N605 PolarHBondContact O-N 3.33Å; S601-N605 PolarHBondContact O-ND2 3.08Å
606	K	75.6	Confident	79.5	Confident	49 Å²	49	46.7 Å²	46.7	21%	0.213	24%	0.239	C	C	.	.	H	α-helix	trans	-145.6	22	-166	-64.9	-66.6	172	174.4	0	114.2	S568 L602 G608 P609 C610	S568-K606 PolarHBondContact OG-NZ 3.36Å; L602-K606 HydrophobicContact CD1-CB 4.03Å; L602-K606 CarbonylContact O-C 3.53Å; L602-K606 VanDerWaalsContact O-C 3.28Å; L602-K606 WeakPolarHBondContact O-CA 3.42Å; L602-K606 PolarHBondContact O-N 3Å; K606-G608 PolarHBondContact O-N 3.1Å; K606-P609 HydrophobicContact CD-CG 4.25Å; K606-P609 WeakPolarHBondContact O-CD 3.43Å; K606-C610 PolarHBondContact O-N 3.08Å; K606-C610 PolarHBondContact O-SG 3.11Å
607	L	80.4	Confident	79.9	Confident	26 Å²	26	43.5 Å²	43.5	14%	0.136	24%	0.237	C	C	.	.	H	α-helix	trans	-58.7	-45.2	177.6	-179.4	60.6	0	0	0	113	L602 A603 C610 M611 L625 M628 I634 I643	L602-L607 PolarHBondContact O-N 3.26Å; A603-L607 WeakPolarHBondContact O-CB 3.34Å; L607-C610 WeakPolarHBondContact O-CB 3.17Å; L607-C610 PolarHBondContact O-N 3.29Å; L607-C610 VanDerWaalsContact O-N 3.08Å; L607-M611 HydrophobicContact CD1-CG 4.25Å; L607-M611 HydrophobicContact CD1-SD 4.21Å; L607-M611 HydrophobicContact CD2-SD 4.34Å; L607-M611 HydrophobicContact CG-CG 4.4Å; L607-M611 HydrophobicContact CG-SD 3.84Å; L607-M611 WeakPolarHBondContact O-CG 3.47Å; L607-M611 PolarHBondContact O-N 3.13Å; L607-L625 HydrophobicContact CD1-CD2 3.85Å; L607-M628 HydrophobicContact CD1-SD 4.21Å; L607-I634 HydrophobicContact CD1-CD1 4.25Å; L607-I634 HydrophobicContact CD2-CD1 4.13Å; L607-I643 HydrophobicContact CD1-CD1 3.82Å; L607-I643 HydrophobicContact CD1-CG1 4.19Å; L607-I643 HydrophobicContact CD2-CD1 4.25Å
608	G	80.9	Confident	80.4	Confident	35 Å²	35	38.4 Å²	38.4	36%	0.361	22%	0.217	S	C	.	.	H	α-helix	trans	-55.5	-52.9	178.6	0	0	0	0	0	113.8	K606 C610 M611 L612	K606-G608 PolarHBondContact O-N 3.1Å; G608-C610 VanDerWaalsContact C-N 3.28Å; G608-C610 PolarHBondContact O-N 3.47Å; G608-M611 PolarHBondContact O-N 3.46Å; G608-L612 PolarHBondContact O-N 3.3Å
609	P	81.6	Confident	80.8	Confident	25 Å²	25	42.6 Å²	42.6	16%	0.162	24%	0.237	C	C	.	.	H	α-helix	trans	-53.2	-37.3	170.6	-33	37.3	0	0	0	115.3	P569 K606 L613	P569-P609 HydrophobicContact CB-CB 3.98Å; P569-P609 HydrophobicContact CB-CG 4.47Å; P569-P609 HydrophobicContact CG-CB 3.92Å; K606-P609 HydrophobicContact CD-CG 4.25Å; K606-P609 WeakPolarHBondContact O-CD 3.43Å; P609-L613 PolarHBondContact O-N 2.84Å; P609-L613 VanDerWaalsContact O-N 3.15Å
610	C	83.1	Confident	81.2	Confident	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-69.5	-41.7	177.1	-58.9	0	0	0	0	111.6	K606 L607 G608 L613 A614 M621 L625	K606-C610 PolarHBondContact O-N 3.08Å; K606-C610 PolarHBondContact O-SG 3.11Å; L607-C610 WeakPolarHBondContact O-CB 3.17Å; L607-C610 PolarHBondContact O-N 3.29Å; L607-C610 VanDerWaalsContact O-N 3.08Å; G608-C610 VanDerWaalsContact C-N 3.28Å; G608-C610 PolarHBondContact O-N 3.47Å; C610-L613 PolarHBondContact O-N 3.19Å; C610-A614 WeakPolarHBondContact O-CB 3.48Å; C610-A614 PolarHBondContact O-N 3.41Å; C610-M621 HydrophobicContact CB-SD 3.91Å; C610-L625 HydrophobicContact CB-CD2 4.5Å
611	M	83.4	Confident	81.5	Confident	14 Å²	14	40.7 Å²	40.7	7%	0.069	23%	0.228	C	C	.	.	H	α-helix	trans	-64.1	-42.6	174.7	-68.3	168.1	66.4	0	0	112	L607 G608 L613 A614 L615 L625 Q642 I643 T646	L607-M611 HydrophobicContact CD1-CG 4.25Å; L607-M611 HydrophobicContact CD1-SD 4.21Å; L607-M611 HydrophobicContact CD2-SD 4.34Å; L607-M611 HydrophobicContact CG-CG 4.4Å; L607-M611 HydrophobicContact CG-SD 3.84Å; L607-M611 WeakPolarHBondContact O-CG 3.47Å; L607-M611 PolarHBondContact O-N 3.13Å; G608-M611 PolarHBondContact O-N 3.46Å; M611-L613 PolarHBondContact O-N 2.91Å; M611-A614 PolarHBondContact O-N 3.18Å; M611-L615 WeakPolarHBondContact O-CG 3.38Å; M611-L615 PolarHBondContact O-N 3.45Å; M611-L625 HydrophobicContact CG-CD1 4.34Å; M611-L625 HydrophobicContact CG-CD2 4.35Å; M611-Q642 HydrophobicContact CE-CB 3.89Å; M611-I643 HydrophobicContact CG-CG1 4.45Å; M611-I643 HydrophobicContact SD-CG1 4.23Å; M611-T646 HydrophobicContact CB-CG2 3.96Å; M611-T646 VanDerWaalsContact CE-OG1 3.25Å; M611-T646 WeakPolarHBondContact CE-OG1 3.36Å; M611-T646 HydrophobicContact CG-CG2 4.31Å; M611-T646 WeakPolarHBondContact O-CG2 3.38Å
612	L	83.8	Confident	81.9	Confident	23 Å²	23	37.7 Å²	37.7	12%	0.12	21%	0.207	C	C	.	.	H	α-helix	trans	-55.5	-49.8	175.1	179.4	72.7	0	0	0	111.7	L470 P569 G608 L615 R616	L470-L612 HydrophobicContact CB-CD1 4.14Å; L470-L612 WeakPolarHBondContact O-CD1 3.33Å; P569-L612 HydrophobicContact CB-CD2 4.05Å; G608-L612 PolarHBondContact O-N 3.3Å; L612-L615 PolarHBondContact O-N 3.46Å; L612-R616 WeakPolarHBondContact O-CG 3.19Å; L612-R616 PolarHBondContact O-N 2.96Å; L612-R616 VanDerWaalsContact O-N 3.11Å
613	L	83.1	Confident	82.2	Confident	8 Å²	8	40.3 Å²	40.3	4%	0.042	22%	0.219	C	C	.	.	H	α-helix	trans	-69.6	-33	179.9	-76.8	170	0	0	0	112.6	P569 D577 F581 P609 C610 M611 R616 G617 N618 M621	P569-L613 HydrophobicContact CG-CD1 3.87Å; P569-L613 HydrophobicContact CG-CG 4.22Å; D577-L613 VanDerWaalsContact O-CD2 3.28Å; D577-L613 WeakPolarHBondContact O-CD2 3.48Å; F581-L613 HydrophobicContact CD1-CD1 3.59Å; F581-L613 HydrophobicContact CE1-CD1 4.16Å; P609-L613 PolarHBondContact O-N 2.84Å; P609-L613 VanDerWaalsContact O-N 3.15Å; C610-L613 PolarHBondContact O-N 3.19Å; M611-L613 PolarHBondContact O-N 2.91Å; L613-R616 PolarHBondContact O-N 3.48Å; L613-G617 PolarHBondContact O-N 3.45Å; L613-N618 HydrophobicContact CB-CB 4.27Å; L613-N618 VanDerWaalsContact O-CB 3.23Å; L613-N618 WeakPolarHBondContact O-CB 3.36Å; L613-N618 PolarHBondContact O-N 2.89Å; L613-M621 HydrophobicContact CB-CB 4.2Å; L613-M621 HydrophobicContact CB-CG 3.66Å; L613-M621 HydrophobicContact CD1-CE 4.01Å; L613-M621 HydrophobicContact CD1-CG 4.23Å; L613-M621 HydrophobicContact CD1-SD 4.45Å
614	A	84.5	Confident	82.5	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-64.4	-43.3	172.2	0	0	0	0	0	111.8	C610 M611 R616 G617 M621 V622 L625 T646 T650	C610-A614 WeakPolarHBondContact O-CB 3.48Å; C610-A614 PolarHBondContact O-N 3.41Å; M611-A614 PolarHBondContact O-N 3.18Å; A614-R616 VanDerWaalsContact C-N 3.27Å; A614-R616 PolarHBondContact O-N 2.93Å; A614-G617 WeakPolarHBondContact O-CA 3.35Å; A614-G617 PolarHBondContact O-N 3.32Å; A614-M621 HydrophobicContact CB-CB 4.15Å; A614-V622 HydrophobicContact CB-CG2 4.05Å; A614-L625 HydrophobicContact CB-CD1 3.52Å; A614-T646 HydrophobicContact CB-CG2 4.18Å; A614-T650 WeakPolarHBondContact O-CG2 3.16Å
615	L	84.4	Confident	82.9	Confident	26 Å²	26	32.6 Å²	32.6	14%	0.136	18%	0.18	C	C	.	.	H	α-helix	trans	-60	-36.1	173.4	-70.5	167.7	0	0	0	112.4	I467 L470 M611 L612 G617 T646	I467-L615 HydrophobicContact CG2-CD1 4.09Å; I467-L615 HydrophobicContact CG2-CD2 4.17Å; L470-L615 HydrophobicContact CB-CD1 4.5Å; L470-L615 HydrophobicContact CD1-CD1 4.18Å; M611-L615 WeakPolarHBondContact O-CG 3.38Å; M611-L615 PolarHBondContact O-N 3.45Å; L612-L615 PolarHBondContact O-N 3.46Å; L615-G617 PolarHBondContact O-N 3.1Å; L615-T646 HydrophobicContact CD1-CG2 4.41Å; L615-T646 HydrophobicContact CD2-CG2 3.87Å; L615-T646 HydrophobicContact CG-CG2 3.7Å
616	R	82.1	Confident	83.5	Confident	88 Å²	88	27.8 Å²	27.8	33%	0.332	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	-0.7	173.2	-69.4	170.6	171	-167.1	-15	113.7	S473 D577 L612 L613 A614	S473-R616 PolarHBondContact OG-NH2 2.99Å; D577-R616 PolarHBondContact O-NH1 2.92Å; D577-R616 IonicContact OD1-CZ 2.88Å; D577-R616 IonicContact OD1-NH1 2.89Å; D577-R616 PolarHBondContact OD1-NH1 3.03Å; D577-R616 IonicContact OD1-NH2 3.29Å; D577-R616 PolarHBondContact OD1-NH2 2.91Å; L612-R616 WeakPolarHBondContact O-CG 3.19Å; L612-R616 PolarHBondContact O-N 2.96Å; L612-R616 VanDerWaalsContact O-N 3.11Å; L613-R616 PolarHBondContact O-N 3.48Å; A614-R616 VanDerWaalsContact C-N 3.27Å; A614-R616 PolarHBondContact O-N 2.93Å
617	G	79.8	Confident	83.8	Confident	44 Å²	44	27.8 Å²	27.8	45%	0.454	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	88.3	13.7	175.4	0	0	0	0	0	115.2	L613 A614 L615 Q619	L613-G617 PolarHBondContact O-N 3.45Å; A614-G617 WeakPolarHBondContact O-CA 3.35Å; A614-G617 PolarHBondContact O-N 3.32Å; L615-G617 PolarHBondContact O-N 3.1Å; G617-Q619 PolarHBondContact O-N 3.01Å
618	N	84.5	Confident	84	Confident	42 Å²	42	26.6 Å²	26.6	23%	0.225	15%	0.15	C	C	.	.			trans	-70.4	112.9	178.7	-171.9	-75.3	0	0	0	111.6	A582 L613 T620 M621 V622	A582-N618 WeakPolarHBondContact CB-ND2 3.3Å; L613-N618 HydrophobicContact CB-CB 4.27Å; L613-N618 VanDerWaalsContact O-CB 3.23Å; L613-N618 WeakPolarHBondContact O-CB 3.36Å; L613-N618 PolarHBondContact O-N 2.89Å; N618-T620 PolarHBondContact O-N 3.38Å; N618-T620 WeakPolarHBondContact OD1-CB 3.36Å; N618-T620 PolarHBondContact OD1-N 2.9Å; N618-M621 HydrophobicContact CB-CB 4.39Å; N618-M621 HydrophobicContact CB-CG 4.31Å; N618-M621 PolarHBondContact O-N 3.26Å; N618-M621 PolarHBondContact OD1-N 3.36Å; N618-V622 PolarHBondContact O-N 3.18Å; N618-V622 VanDerWaalsContact O-N 3.16Å
619	Q	86	Confident	84.1	Confident	114 Å²	114	25.5 Å²	25.5	53%	0.533	14%	0.137	S	C	.	.	H	α-helix	trans	-60.7	-39.2	-174.7	-175.7	-178.8	-31.9	0	0	113.6	G617 M621 V622 E623	G617-Q619 PolarHBondContact O-N 3.01Å; Q619-M621 VanDerWaalsContact C-N 3.28Å; Q619-M621 PolarHBondContact O-N 3.33Å; Q619-V622 WeakPolarHBondContact O-CB 3.33Å; Q619-V622 PolarHBondContact O-N 3.41Å; Q619-E623 WeakPolarHBondContact CG-OE1 3.46Å; Q619-E623 PolarHBondContact NE2-OE1 3.31Å; Q619-E623 WeakPolarHBondContact O-CG 3.43Å; Q619-E623 PolarHBondContact O-N 2.67Å
620	T	85	Confident	84.1	Confident	23 Å²	23	27.3 Å²	27.3	14%	0.141	14%	0.143	C	C	.	.	H	α-helix	trans	-61.9	-38.5	179.2	-62.3	0	0	0	0	111.5	V585 H586 N618 E623 I624	V585-T620 HydrophobicContact CG1-CG2 4.15Å; H586-T620 HydrophobicContact CB-CG2 3.71Å; H586-T620 PolarHBondContact ND1-OG1 3.39Å; N618-T620 PolarHBondContact O-N 3.38Å; N618-T620 WeakPolarHBondContact OD1-CB 3.36Å; N618-T620 PolarHBondContact OD1-N 2.9Å; T620-E623 PolarHBondContact O-N 3.21Å; T620-I624 HydrophobicContact CG2-CD1 3.94Å; T620-I624 WeakPolarHBondContact O-CB 3.3Å; T620-I624 WeakPolarHBondContact O-CD1 3.41Å; T620-I624 VanDerWaalsContact O-CG1 3.3Å; T620-I624 WeakPolarHBondContact O-CG1 3.3Å; T620-I624 PolarHBondContact O-N 3.45Å
621	M	86.2	Confident	83.8	Confident	0 Å²	0	32.6 Å²	32.6	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-72.3	-37.9	178.8	-65.6	-69.2	162.6	0	0	111.7	F581 A582 V585 C610 L613 A614 N618 Q619 I624 L625	F581-M621 HydrophobicContact CD1-CE 3.63Å; F581-M621 HydrophobicContact CE1-CE 3.55Å; F581-M621 HydrophobicContact CE1-SD 4.32Å; A582-M621 HydrophobicContact CB-CE 3.96Å; V585-M621 HydrophobicContact CB-CE 3.71Å; V585-M621 HydrophobicContact CG1-CE 3.67Å; V585-M621 HydrophobicContact CG1-SD 4.39Å; V585-M621 HydrophobicContact CG2-CE 3.86Å; C610-M621 HydrophobicContact CB-SD 3.91Å; L613-M621 HydrophobicContact CB-CB 4.2Å; L613-M621 HydrophobicContact CB-CG 3.66Å; L613-M621 HydrophobicContact CD1-CE 4.01Å; L613-M621 HydrophobicContact CD1-CG 4.23Å; L613-M621 HydrophobicContact CD1-SD 4.45Å; A614-M621 HydrophobicContact CB-CB 4.15Å; N618-M621 HydrophobicContact CB-CB 4.39Å; N618-M621 HydrophobicContact CB-CG 4.31Å; N618-M621 PolarHBondContact O-N 3.26Å; N618-M621 PolarHBondContact OD1-N 3.36Å; Q619-M621 VanDerWaalsContact C-N 3.28Å; Q619-M621 PolarHBondContact O-N 3.33Å; M621-I624 PolarHBondContact O-N 3.4Å; M621-L625 WeakPolarHBondContact O-CB 3.49Å; M621-L625 VanDerWaalsContact O-CG 3.29Å; M621-L625 WeakPolarHBondContact O-CG 3.15Å; M621-L625 PolarHBondContact O-N 3.12Å
622	V	86.4	Confident	83.4	Confident	0 Å²	0	37 Å²	37	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-58.5	-49.8	170.9	168.4	0	0	0	0	111.1	A614 N618 Q619 I624 L625 C626 L647 V652 M656	A614-V622 HydrophobicContact CB-CG2 4.05Å; N618-V622 PolarHBondContact O-N 3.18Å; N618-V622 VanDerWaalsContact O-N 3.16Å; Q619-V622 WeakPolarHBondContact O-CB 3.33Å; Q619-V622 PolarHBondContact O-N 3.41Å; V622-I624 VanDerWaalsContact C-N 3.31Å; V622-I624 PolarHBondContact O-N 2.88Å; V622-L625 PolarHBondContact O-N 2.89Å; V622-C626 PolarHBondContact O-N 3.37Å; V622-C626 PolarHBondContact O-SG 3.15Å; V622-L647 HydrophobicContact CB-CD2 4.3Å; V622-L647 HydrophobicContact CG1-CD2 3.83Å; V622-L647 HydrophobicContact CG2-CD2 4.39Å; V622-V652 HydrophobicContact CG1-CG1 4.49Å; V622-M656 HydrophobicContact CG1-CB 4.22Å; V622-M656 HydrophobicContact CG1-CG 4.32Å; V622-M656 HydrophobicContact CG1-SD 3.67Å
623	E	85.6	Confident	83	Confident	57 Å²	57	36.6 Å²	36.6	27%	0.266	19%	0.185	S	C	.	.	H	α-helix	trans	-54.7	-46.1	175.3	-80.6	166.7	-166.4	0	0	111.9	Q619 T620 C626 L627 M656	Q619-E623 WeakPolarHBondContact CG-OE1 3.46Å; Q619-E623 PolarHBondContact NE2-OE1 3.31Å; Q619-E623 WeakPolarHBondContact O-CG 3.43Å; Q619-E623 PolarHBondContact O-N 2.67Å; T620-E623 PolarHBondContact O-N 3.21Å; E623-C626 WeakPolarHBondContact O-CB 3.45Å; E623-C626 PolarHBondContact O-N 3.21Å; E623-L627 VanDerWaalsContact O-CG 3.3Å; E623-L627 WeakPolarHBondContact O-CG 3.48Å; E623-L627 PolarHBondContact O-N 2.77Å; E623-M656 HydrophobicContact CB-CE 4.42Å; E623-M656 HydrophobicContact CG-CE 3.36Å; E623-M656 HydrophobicContact CG-SD 4.13Å
624	I	85.7	Confident	82.7	Confident	3 Å²	3	37.1 Å²	37.1	2%	0.015	19%	0.188	C	C	.	.	H	α-helix	trans	-67.2	-41.4	-179	-77.2	169.3	0	0	0	112.7	V585 M589 L599 L602 T620 M621 V622 C626 L627 M628	V585-I624 HydrophobicContact CG1-CD1 3Å; M589-I624 HydrophobicContact CE-CG1 4.29Å; M589-I624 HydrophobicContact CG-CD1 3.75Å; M589-I624 HydrophobicContact CG-CG1 4.09Å; M589-I624 HydrophobicContact SD-CD1 4.48Å; M589-I624 HydrophobicContact SD-CG1 4.4Å; L599-I624 HydrophobicContact CD2-CG2 3.75Å; L602-I624 HydrophobicContact CD2-CG2 3.81Å; T620-I624 HydrophobicContact CG2-CD1 3.94Å; T620-I624 WeakPolarHBondContact O-CB 3.3Å; T620-I624 WeakPolarHBondContact O-CD1 3.41Å; T620-I624 VanDerWaalsContact O-CG1 3.3Å; T620-I624 WeakPolarHBondContact O-CG1 3.3Å; T620-I624 PolarHBondContact O-N 3.45Å; M621-I624 PolarHBondContact O-N 3.4Å; V622-I624 VanDerWaalsContact C-N 3.31Å; V622-I624 PolarHBondContact O-N 2.88Å; I624-C626 VanDerWaalsContact C-N 3.34Å; I624-L627 PolarHBondContact O-N 3.32Å; I624-M628 HydrophobicContact CG2-CE 3.85Å; I624-M628 WeakPolarHBondContact O-CG 3.31Å; I624-M628 PolarHBondContact O-N 3.37Å
625	L	86	Confident	82.1	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-63.8	-40.5	174.8	-71.5	177.5	0	0	0	111.1	L607 C610 M611 A614 M621 V622 M628 L629 I643 T646 L647	L607-L625 HydrophobicContact CD1-CD2 3.85Å; C610-L625 HydrophobicContact CB-CD2 4.5Å; M611-L625 HydrophobicContact CG-CD1 4.34Å; M611-L625 HydrophobicContact CG-CD2 4.35Å; A614-L625 HydrophobicContact CB-CD1 3.52Å; M621-L625 WeakPolarHBondContact O-CB 3.49Å; M621-L625 VanDerWaalsContact O-CG 3.29Å; M621-L625 WeakPolarHBondContact O-CG 3.15Å; M621-L625 PolarHBondContact O-N 3.12Å; V622-L625 PolarHBondContact O-N 2.89Å; L625-M628 HydrophobicContact CD2-SD 4.25Å; L625-M628 PolarHBondContact O-N 3.31Å; L625-L629 WeakPolarHBondContact O-CG 3.43Å; L625-L629 PolarHBondContact O-N 3.49Å; L625-L629 VanDerWaalsContact O-N 3.16Å; L625-I643 HydrophobicContact CB-CG2 3.78Å; L625-I643 HydrophobicContact CD1-CG2 4.3Å; L625-I643 HydrophobicContact CD2-CD1 4.26Å; L625-I643 HydrophobicContact CD2-CG1 4.14Å; L625-I643 HydrophobicContact CD2-CG2 3.92Å; L625-I643 HydrophobicContact CG-CG2 4.2Å; L625-T646 HydrophobicContact CD1-CG2 4.41Å; L625-L647 HydrophobicContact CB-CD1 4.32Å; L625-L647 HydrophobicContact CB-CD2 4.08Å; L625-L647 HydrophobicContact CB-CG 4.38Å; L625-L647 HydrophobicContact CD1-CD2 4.47Å
626	C	84.9	Confident	82	Confident	7 Å²	7	48.6 Å²	48.6	5%	0.047	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-44.5	170.4	-73.8	0	0	0	0	112.1	V622 E623 I624 L629 E630 L660	V622-C626 PolarHBondContact O-N 3.37Å; V622-C626 PolarHBondContact O-SG 3.15Å; E623-C626 WeakPolarHBondContact O-CB 3.45Å; E623-C626 PolarHBondContact O-N 3.21Å; I624-C626 VanDerWaalsContact C-N 3.34Å; C626-L629 PolarHBondContact O-N 3.05Å; C626-E630 WeakPolarHBondContact O-CB 3.26Å; C626-E630 PolarHBondContact O-N 3.2Å; C626-L660 HydrophobicContact CB-CD2 4.35Å; C626-L660 WeakPolarHBondContact O-CD2 3.46Å
627	L	83.5	Confident	82	Confident	48 Å²	48	51.9 Å²	51.9	25%	0.251	26%	0.26	S	S	.	.	H	α-helix	trans	-65.9	-36.7	177.1	-69.1	170.8	0	0	0	112.7	M589 L599 E623 I624 L629 E630 Y631	M589-L627 HydrophobicContact CE-CD1 3.59Å; L599-L627 HydrophobicContact CD1-CB 4.32Å; E623-L627 VanDerWaalsContact O-CG 3.3Å; E623-L627 WeakPolarHBondContact O-CG 3.48Å; E623-L627 PolarHBondContact O-N 2.77Å; I624-L627 PolarHBondContact O-N 3.32Å; L627-L629 VanDerWaalsContact C-N 3.33Å; L627-L629 PolarHBondContact O-N 2.86Å; L627-E630 PolarHBondContact O-N 3.5Å; L627-Y631 HydrophobicContact CB-CD2 4.36Å; L627-Y631 HydrophobicContact CB-CE2 4.44Å; L627-Y631 HydrophobicContact CD2-CE2 4.05Å; L627-Y631 VanDerWaalsContact O-CD2 3.22Å; L627-Y631 WeakPolarHBondContact O-CD2 3.13Å; L627-Y631 PolarHBondContact O-N 3.36Å
628	M	83.3	Confident	82.2	Confident	1 Å²	1	54.7 Å²	54.7	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-61.8	-40.6	174.8	-74.9	-179.4	179.1	0	0	112.2	L599 L602 A603 L607 I624 L625 N632 I633 I634	L599-M628 HydrophobicContact CD2-CE 4.06Å; L599-M628 HydrophobicContact CD2-CG 4.19Å; L602-M628 HydrophobicContact CB-CE 3.92Å; L602-M628 HydrophobicContact CD2-CE 3.7Å; L602-M628 HydrophobicContact CG-CE 3.88Å; A603-M628 HydrophobicContact CB-CE 4.13Å; A603-M628 HydrophobicContact CB-SD 4.23Å; L607-M628 HydrophobicContact CD1-SD 4.21Å; I624-M628 HydrophobicContact CG2-CE 3.85Å; I624-M628 WeakPolarHBondContact O-CG 3.31Å; I624-M628 PolarHBondContact O-N 3.37Å; L625-M628 HydrophobicContact CD2-SD 4.25Å; L625-M628 PolarHBondContact O-N 3.31Å; M628-N632 PolarHBondContact O-N 3.36Å; M628-I633 PolarHBondContact O-N 2.92Å; M628-I634 HydrophobicContact CB-CD1 4.4Å; M628-I634 HydrophobicContact SD-CD1 4.17Å
629	L	83.1	Confident	82.1	Confident	13 Å²	13	54.3 Å²	54.3	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-69	-41.6	173.7	-67.1	175.1	0	0	0	111.6	L625 C626 L627 N632 Q640 I643 I644 L647 Y657 L660	L625-L629 WeakPolarHBondContact O-CG 3.43Å; L625-L629 PolarHBondContact O-N 3.49Å; L625-L629 VanDerWaalsContact O-N 3.16Å; C626-L629 PolarHBondContact O-N 3.05Å; L627-L629 VanDerWaalsContact C-N 3.33Å; L627-L629 PolarHBondContact O-N 2.86Å; L629-N632 PolarHBondContact O-N 2.89Å; L629-Q640 HydrophobicContact CD2-CB 4.03Å; L629-Q640 HydrophobicContact CD2-CG 4.02Å; L629-I643 HydrophobicContact CD1-CG2 3.94Å; L629-I643 HydrophobicContact CD2-CG2 4.46Å; L629-I643 HydrophobicContact CG-CG2 4.17Å; L629-I644 HydrophobicContact CD1-CG1 3.9Å; L629-L647 HydrophobicContact CD1-CD1 3.83Å; L629-Y657 HydrophobicContact CD1-CD2 4.14Å; L629-Y657 HydrophobicContact CD1-CE2 3.99Å; L629-L660 HydrophobicContact CB-CD2 3.93Å
630	E	81.8	Confident	82	Confident	63 Å²	63	51 Å²	51	29%	0.294	25%	0.248	S	C	.	.	H	α-helix	trans	-62.6	-46.9	179.5	-168.7	166.8	165.6	0	0	112.7	C626 L627 N632 L660 R663	C626-E630 WeakPolarHBondContact O-CB 3.26Å; C626-E630 PolarHBondContact O-N 3.2Å; L627-E630 PolarHBondContact O-N 3.5Å; E630-N632 PolarHBondContact O-N 2.85Å; E630-N632 PolarHBondContact O-ND2 3.5Å; E630-L660 HydrophobicContact CB-CD1 3.64Å; E630-L660 HydrophobicContact CG-CD1 3.73Å; E630-L660 WeakPolarHBondContact OE2-CD1 3.47Å; E630-R663 IonicContact OE1-CZ 3.15Å; E630-R663 IonicContact OE1-NH1 2.77Å; E630-R663 PolarHBondContact OE1-NH1 3.02Å; E630-R663 IonicContact OE2-CZ 2.57Å; E630-R663 VanDerWaalsContact OE2-CZ 3.29Å; E630-R663 IonicContact OE2-NH1 2.77Å; E630-R663 PolarHBondContact OE2-NH1 2.92Å; E630-R663 IonicContact OE2-NH2 3.08Å; E630-R663 PolarHBondContact OE2-NH2 3.45Å
631	Y	76.6	Confident	82	Confident	110 Å²	110	55 Å²	55	43%	0.431	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.8	2.6	179.5	-72.3	-63	0	0	0	114.3	L599 L627 I633	L599-Y631 HydrophobicContact CD1-CD2 4.23Å; L627-Y631 HydrophobicContact CB-CD2 4.36Å; L627-Y631 HydrophobicContact CB-CE2 4.44Å; L627-Y631 HydrophobicContact CD2-CE2 4.05Å; L627-Y631 VanDerWaalsContact O-CD2 3.22Å; L627-Y631 WeakPolarHBondContact O-CD2 3.13Å; L627-Y631 PolarHBondContact O-N 3.36Å; Y631-I633 VanDerWaalsContact C-N 3.27Å; Y631-I633 PolarHBondContact O-N 2.97Å
632	N	74.8	Confident	82	Confident	108 Å²	108	58.9 Å²	58.9	58%	0.578	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.8	49.1	-174	-67.5	-88	0	0	0	112	M628 L629 E630 I634	M628-N632 PolarHBondContact O-N 3.36Å; L629-N632 PolarHBondContact O-N 2.89Å; E630-N632 PolarHBondContact O-N 2.85Å; E630-N632 PolarHBondContact O-ND2 3.5Å; N632-I634 VanDerWaalsContact C-N 3.35Å
633	I	75	Confident	81.9	Confident	13 Å²	13	58.9 Å²	58.9	7%	0.067	29%	0.287	C	S	.	.			trans	-75.6	-29.2	-176.3	-71.1	-179.8	0	0	0	111.7	K596 L599 L600 A603 M628 Y631	K596-I633 HydrophobicContact CG-CD1 4.18Å; K596-I633 HydrophobicContact CG-CG1 4.33Å; L599-I633 HydrophobicContact CB-CD1 3.34Å; L599-I633 HydrophobicContact CD1-CD1 3.69Å; L599-I633 HydrophobicContact CG-CD1 4.17Å; L600-I633 HydrophobicContact CD2-CG2 3.76Å; L600-I633 HydrophobicContact CG-CG2 3.93Å; A603-I633 HydrophobicContact CB-CG2 4.24Å; M628-I633 PolarHBondContact O-N 2.92Å; Y631-I633 VanDerWaalsContact C-N 3.27Å; Y631-I633 PolarHBondContact O-N 2.97Å
634	I	76.6	Confident	81.9	Confident	19 Å²	19	57.5 Å²	57.5	10%	0.097	28%	0.281	C	S	.	.			trans	-104.1	111.6	-178.4	-64.5	171.5	0	0	0	107.5	A603 L607 M628 N632 T639 Q640 I643	A603-I634 HydrophobicContact CB-CD1 4.25Å; A603-I634 HydrophobicContact CB-CG1 4.08Å; L607-I634 HydrophobicContact CD1-CD1 4.25Å; L607-I634 HydrophobicContact CD2-CD1 4.13Å; M628-I634 HydrophobicContact CB-CD1 4.4Å; M628-I634 HydrophobicContact SD-CD1 4.17Å; N632-I634 VanDerWaalsContact C-N 3.35Å; I634-T639 WeakPolarHBondContact CG2-OG1 3.46Å; I634-Q640 HydrophobicContact CB-CG 4.44Å; I634-Q640 HydrophobicContact CG2-CG 4.18Å; I634-Q640 PolarHBondContact O-NE2 3.08Å; I634-I643 HydrophobicContact CD1-CD1 3.29Å
635	E	72.6	Confident	81.9	Confident	183 Å²	183	59.9 Å²	59.9	86%	0.855	30%	0.298	S	S	*	.			trans	-79.4	-25	-177.3	-61.1	-177.1	172	0	0	112.9	K637	E635-K637 PolarHBondContact O-N 3.24Å
636	N	83.4	Confident	81.9	Confident	84 Å²	84	60.1 Å²	60.1	45%	0.449	30%	0.299	S	S	.	.			trans	-78.9	118.6	-179.4	179	1.7	0	0	0	111.5	D638 T639 Q640	N636-D638 VanDerWaalsContact C-N 3.32Å; N636-D638 PolarHBondContact O-N 3.21Å; N636-D638 PolarHBondContact OD1-N 2.82Å; N636-T639 WeakPolarHBondContact CB-OG1 3.29Å; N636-T639 PolarHBondContact O-N 3.01Å; N636-T639 PolarHBondContact O-OG1 3.46Å; N636-Q640 WeakPolarHBondContact O-CG 3.46Å; N636-Q640 PolarHBondContact O-N 3.39Å; N636-Q640 VanDerWaalsContact O-N 3.08Å
637	K	80.9	Confident	82	Confident	157 Å²	157	59.8 Å²	59.8	68%	0.683	30%	0.297	S	S	*	.	H	α-helix	trans	-60.3	-35.2	179.6	-67.4	-177	179.2	178.1	0	113.5	E635 Q640 L641	E635-K637 PolarHBondContact O-N 3.24Å; K637-Q640 WeakPolarHBondContact O-CB 3.26Å; K637-Q640 PolarHBondContact O-N 2.93Å; K637-L641 WeakPolarHBondContact O-CG 3.37Å; K637-L641 PolarHBondContact O-N 3.47Å
638	D	83.6	Confident	82.2	Confident	104 Å²	104	62.2 Å²	62.2	56%	0.556	31%	0.307	S	S	*	.	H	α-helix	trans	-68.1	-42.2	-177.9	-59.6	-37.9	0	0	0	110.7	N636 L641 Q642	N636-D638 VanDerWaalsContact C-N 3.32Å; N636-D638 PolarHBondContact O-N 3.21Å; N636-D638 PolarHBondContact OD1-N 2.82Å; D638-L641 PolarHBondContact O-N 2.87Å; D638-Q642 WeakPolarHBondContact O-CG 3.38Å; D638-Q642 PolarHBondContact O-N 3.34Å
639	T	83.6	Confident	82.4	Confident	33 Å²	33	65.4 Å²	65.4	20%	0.202	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-33.1	172.9	42.8	0	0	0	0	112.8	I634 N636 Q642 I643	I634-T639 WeakPolarHBondContact CG2-OG1 3.46Å; N636-T639 WeakPolarHBondContact CB-OG1 3.29Å; N636-T639 PolarHBondContact O-N 3.01Å; N636-T639 PolarHBondContact O-OG1 3.46Å; T639-Q642 PolarHBondContact O-N 2.82Å; T639-I643 VanDerWaalsContact O-CG1 3.29Å; T639-I643 WeakPolarHBondContact O-CG1 3.45Å; T639-I643 PolarHBondContact O-N 2.67Å; T639-I643 VanDerWaalsContact O-N 3.1Å
640	Q	83.8	Confident	82.5	Confident	44 Å²	44	65.7 Å²	65.7	21%	0.206	33%	0.332	C	S	.	.	H	α-helix	trans	-62.5	-46.2	170.4	-69.2	-177.9	-10.8	0	0	111.1	L629 I634 N636 K637 Q642 I643 I644	L629-Q640 HydrophobicContact CD2-CB 4.03Å; L629-Q640 HydrophobicContact CD2-CG 4.02Å; I634-Q640 HydrophobicContact CB-CG 4.44Å; I634-Q640 HydrophobicContact CG2-CG 4.18Å; I634-Q640 PolarHBondContact O-NE2 3.08Å; N636-Q640 WeakPolarHBondContact O-CG 3.46Å; N636-Q640 PolarHBondContact O-N 3.39Å; N636-Q640 VanDerWaalsContact O-N 3.08Å; K637-Q640 WeakPolarHBondContact O-CB 3.26Å; K637-Q640 PolarHBondContact O-N 2.93Å; Q640-Q642 VanDerWaalsContact C-N 3.34Å; Q640-Q642 PolarHBondContact O-N 3.3Å; Q640-I643 PolarHBondContact O-N 3.33Å; Q640-I644 WeakPolarHBondContact O-CD1 3.21Å; Q640-I644 VanDerWaalsContact O-CG1 3.22Å; Q640-I644 WeakPolarHBondContact O-CG1 3.42Å; Q640-I644 PolarHBondContact O-N 3.13Å
641	L	85.3	Confident	82.7	Confident	108 Å²	108	68.8 Å²	68.8	57%	0.565	35%	0.346	S	S	*	.	H	α-helix	trans	-62.7	-38.4	177.9	-72.4	170.1	0	0	0	112.3	K637 D638 I644 S645	K637-L641 WeakPolarHBondContact O-CG 3.37Å; K637-L641 PolarHBondContact O-N 3.47Å; D638-L641 PolarHBondContact O-N 2.87Å; L641-I644 PolarHBondContact O-N 3.05Å; L641-S645 WeakPolarHBondContact O-CB 3.47Å; L641-S645 PolarHBondContact O-N 3.45Å
642	Q	85.1	Confident	83.1	Confident	82 Å²	82	66.7 Å²	66.7	38%	0.383	35%	0.345	S	S	.	.	H	α-helix	trans	-60.8	-43.6	172.8	-72.9	173.4	4.2	0	0	112	M611 D638 T639 Q640 S645 T646	M611-Q642 HydrophobicContact CE-CB 3.89Å; D638-Q642 WeakPolarHBondContact O-CG 3.38Å; D638-Q642 PolarHBondContact O-N 3.34Å; T639-Q642 PolarHBondContact O-N 2.82Å; Q640-Q642 VanDerWaalsContact C-N 3.34Å; Q640-Q642 PolarHBondContact O-N 3.3Å; Q642-S645 PolarHBondContact O-N 3.49Å; Q642-T646 WeakPolarHBondContact O-CB 3.47Å; Q642-T646 PolarHBondContact O-N 3.03Å; Q642-T646 PolarHBondContact O-OG1 3.41Å
643	I	85.1	Confident	83.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-64.9	-42.8	175.6	-66.4	165.5	0	0	0	111.1	L607 M611 L625 L629 I634 T639 Q640 S645 T646 L647	L607-I643 HydrophobicContact CD1-CD1 3.82Å; L607-I643 HydrophobicContact CD1-CG1 4.19Å; L607-I643 HydrophobicContact CD2-CD1 4.25Å; M611-I643 HydrophobicContact CG-CG1 4.45Å; M611-I643 HydrophobicContact SD-CG1 4.23Å; L625-I643 HydrophobicContact CB-CG2 3.78Å; L625-I643 HydrophobicContact CD1-CG2 4.3Å; L625-I643 HydrophobicContact CD2-CD1 4.26Å; L625-I643 HydrophobicContact CD2-CG1 4.14Å; L625-I643 HydrophobicContact CD2-CG2 3.92Å; L625-I643 HydrophobicContact CG-CG2 4.2Å; L629-I643 HydrophobicContact CD1-CG2 3.94Å; L629-I643 HydrophobicContact CD2-CG2 4.46Å; L629-I643 HydrophobicContact CG-CG2 4.17Å; I634-I643 HydrophobicContact CD1-CD1 3.29Å; T639-I643 VanDerWaalsContact O-CG1 3.29Å; T639-I643 WeakPolarHBondContact O-CG1 3.45Å; T639-I643 PolarHBondContact O-N 2.67Å; T639-I643 VanDerWaalsContact O-N 3.1Å; Q640-I643 PolarHBondContact O-N 3.33Å; I643-S645 PolarHBondContact O-N 3.07Å; I643-T646 WeakPolarHBondContact O-CB 3.5Å; I643-T646 PolarHBondContact O-N 3.16Å; I643-L647 HydrophobicContact CG2-CD1 3.93Å; I643-L647 HydrophobicContact CG2-CG 4.33Å; I643-L647 WeakPolarHBondContact O-CG 3.39Å; I643-L647 PolarHBondContact O-N 3.43Å
644	I	84.7	Confident	84.1	Confident	28 Å²	28	65.1 Å²	65.1	14%	0.144	33%	0.332	C	S	.	.	H	α-helix	trans	-61.4	-45.6	178	-66.7	162.9	0	0	0	110.5	L629 Q640 L641 T646 L647 Q648 Y657	L629-I644 HydrophobicContact CD1-CG1 3.9Å; Q640-I644 WeakPolarHBondContact O-CD1 3.21Å; Q640-I644 VanDerWaalsContact O-CG1 3.22Å; Q640-I644 WeakPolarHBondContact O-CG1 3.42Å; Q640-I644 PolarHBondContact O-N 3.13Å; L641-I644 PolarHBondContact O-N 3.05Å; I644-T646 VanDerWaalsContact C-N 3.35Å; I644-T646 PolarHBondContact O-N 3.08Å; I644-L647 PolarHBondContact O-N 2.71Å; I644-Q648 HydrophobicContact CG2-CG 4.35Å; I644-Q648 WeakPolarHBondContact O-CB 3.22Å; I644-Q648 VanDerWaalsContact O-CG 3.26Å; I644-Q648 WeakPolarHBondContact O-CG 3.23Å; I644-Q648 PolarHBondContact O-N 3.02Å; I644-Y657 HydrophobicContact CD1-CE2 4.33Å; I644-Y657 HydrophobicContact CG1-CE2 3.74Å; I644-Y657 HydrophobicContact CG2-CE1 3.84Å; I644-Y657 HydrophobicContact CG2-CE2 4.23Å
645	S	87	Confident	84.6	Confident	53 Å²	53	71.4 Å²	71.4	37%	0.371	36%	0.355	S	S	.	.	H	α-helix	trans	-60.2	-42.6	174.3	-178.2	0	0	0	0	112.2	L641 Q642 I643 L647 Q648 S649	L641-S645 WeakPolarHBondContact O-CB 3.47Å; L641-S645 PolarHBondContact O-N 3.45Å; Q642-S645 PolarHBondContact O-N 3.49Å; I643-S645 PolarHBondContact O-N 3.07Å; S645-L647 PolarHBondContact O-N 3.44Å; S645-Q648 PolarHBondContact O-N 2.85Å; S645-S649 WeakPolarHBondContact O-CB 3.45Å; S645-S649 PolarHBondContact O-N 3.17Å; S645-S649 PolarHBondContact O-OG 3.35Å
646	T	85.9	Confident	85.1	Confident	5 Å²	5	64.8 Å²	64.8	3%	0.031	32%	0.324	C	S	.	.	H	α-helix	trans	-60.2	-45.3	175.2	-56.7	0	0	0	0	111.5	M611 A614 L615 L625 Q642 I643 I644 S649	M611-T646 HydrophobicContact CB-CG2 3.96Å; M611-T646 VanDerWaalsContact CE-OG1 3.25Å; M611-T646 WeakPolarHBondContact CE-OG1 3.36Å; M611-T646 HydrophobicContact CG-CG2 4.31Å; M611-T646 WeakPolarHBondContact O-CG2 3.38Å; A614-T646 HydrophobicContact CB-CG2 4.18Å; L615-T646 HydrophobicContact CD1-CG2 4.41Å; L615-T646 HydrophobicContact CD2-CG2 3.87Å; L615-T646 HydrophobicContact CG-CG2 3.7Å; L625-T646 HydrophobicContact CD1-CG2 4.41Å; Q642-T646 WeakPolarHBondContact O-CB 3.47Å; Q642-T646 PolarHBondContact O-N 3.03Å; Q642-T646 PolarHBondContact O-OG1 3.41Å; I643-T646 WeakPolarHBondContact O-CB 3.5Å; I643-T646 PolarHBondContact O-N 3.16Å; I644-T646 VanDerWaalsContact C-N 3.35Å; I644-T646 PolarHBondContact O-N 3.08Å; T646-S649 PolarHBondContact O-N 2.94Å
647	L	87.2	Confident	85.3	Confident	0 Å²	0	63 Å²	63	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.7	-47.1	177.5	-72.3	169.5	0	0	0	111.6	V622 L625 L629 I643 I644 S645 S649 T650 G653 F654 Y657	V622-L647 HydrophobicContact CB-CD2 4.3Å; V622-L647 HydrophobicContact CG1-CD2 3.83Å; V622-L647 HydrophobicContact CG2-CD2 4.39Å; L625-L647 HydrophobicContact CB-CD1 4.32Å; L625-L647 HydrophobicContact CB-CD2 4.08Å; L625-L647 HydrophobicContact CB-CG 4.38Å; L625-L647 HydrophobicContact CD1-CD2 4.47Å; L629-L647 HydrophobicContact CD1-CD1 3.83Å; I643-L647 HydrophobicContact CG2-CD1 3.93Å; I643-L647 HydrophobicContact CG2-CG 4.33Å; I643-L647 WeakPolarHBondContact O-CG 3.39Å; I643-L647 PolarHBondContact O-N 3.43Å; I644-L647 PolarHBondContact O-N 2.71Å; S645-L647 PolarHBondContact O-N 3.44Å; L647-S649 PolarHBondContact O-N 2.93Å; L647-T650 PolarHBondContact O-N 3.49Å; L647-T650 VanDerWaalsContact O-N 3.15Å; L647-T650 VanDerWaalsContact O-O 3.14Å; L647-T650 PolarHBondContact O-OG1 2.98Å; L647-G653 CarbonylContact O-C 3.53Å; L647-G653 WeakPolarHBondContact O-CA 3.33Å; L647-F654 PolarHBondContact O-N 2.96Å; L647-F654 VanDerWaalsContact O-N 3.08Å; L647-Y657 HydrophobicContact CD1-CD2 4.12Å
648	Q	86.9	Confident	85.6	Confident	99 Å²	99	60.2 Å²	60.2	46%	0.463	30%	0.301	S	S	.	.	H	α-helix	trans	-63.5	-27.3	179	-74	175.7	-20.8	0	0	113.2	I644 S645 T650 F654 Y657	I644-Q648 HydrophobicContact CG2-CG 4.35Å; I644-Q648 WeakPolarHBondContact O-CB 3.22Å; I644-Q648 VanDerWaalsContact O-CG 3.26Å; I644-Q648 WeakPolarHBondContact O-CG 3.23Å; I644-Q648 PolarHBondContact O-N 3.02Å; S645-Q648 PolarHBondContact O-N 2.85Å; Q648-T650 PolarHBondContact O-N 3.15Å; Q648-F654 HydrophobicContact CG-CD2 4.34Å; Q648-Y657 HydrophobicContact CG-CD1 4.47Å
649	S	86.9	Confident	85.7	Confident	67 Å²	67	61 Å²	61	47%	0.469	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-10.4	176	-60.9	0	0	0	0	113.7	S645 T646 L647	S645-S649 WeakPolarHBondContact O-CB 3.45Å; S645-S649 PolarHBondContact O-N 3.17Å; S645-S649 PolarHBondContact O-OG 3.35Å; T646-S649 PolarHBondContact O-N 2.94Å; L647-S649 PolarHBondContact O-N 2.93Å
650	T	86.6	Confident	85.8	Confident	20 Å²	20	59.5 Å²	59.5	12%	0.123	29%	0.292	C	S	.	.	S	Bend	trans	-122.2	142.5	178.3	69.1	0	0	0	0	112	A614 L647 Q648 V652 G653 F654	A614-T650 WeakPolarHBondContact O-CG2 3.16Å; L647-T650 PolarHBondContact O-N 3.49Å; L647-T650 VanDerWaalsContact O-N 3.15Å; L647-T650 VanDerWaalsContact O-O 3.14Å; L647-T650 PolarHBondContact O-OG1 2.98Å; Q648-T650 PolarHBondContact O-N 3.15Å; T650-V652 VanDerWaalsContact C-N 3.27Å; T650-V652 PolarHBondContact O-N 3.14Å; T650-G653 PolarHBondContact O-N 3.19Å; T650-G653 WeakPolarHBondContact OG1-CA 3.46Å; T650-G653 PolarHBondContact OG1-N 3.05Å; T650-G653 VanDerWaalsContact OG1-N 3.08Å; T650-F654 WeakPolarHBondContact O-CB 3.32Å; T650-F654 PolarHBondContact O-N 3Å
651	Q	84.5	Confident	85.9	Confident	127 Å²	127	59.1 Å²	59.1	59%	0.593	29%	0.294	S	S	*	.	H	α-helix	trans	-64.4	-31.1	-177.4	-175.9	58.7	85.6	0	0	113.3	R655	Q651-R655 WeakPolarHBondContact O-CG 3.36Å
652	V	84.9	Confident	85.9	Confident	67 Å²	67	57.3 Å²	57.3	41%	0.406	29%	0.285	S	S	.	.	H	α-helix	trans	-75.4	-49.7	175.1	-178.6	0	0	0	0	110	V622 T650 F654 R655 M656	V622-V652 HydrophobicContact CG1-CG1 4.49Å; T650-V652 VanDerWaalsContact C-N 3.27Å; T650-V652 PolarHBondContact O-N 3.14Å; V652-F654 VanDerWaalsContact C-N 3.32Å; V652-F654 PolarHBondContact O-N 3.34Å; V652-R655 PolarHBondContact O-N 3.42Å; V652-M656 HydrophobicContact CG1-CG 4.41Å; V652-M656 HydrophobicContact CG1-SD 4.06Å; V652-M656 WeakPolarHBondContact O-CG 3.16Å; V652-M656 PolarHBondContact O-N 3Å
653	G	84.4	Confident	85.6	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-38.9	178.8	0	0	0	0	0	113.5	L647 T650 M656 Y657	L647-G653 CarbonylContact O-C 3.53Å; L647-G653 WeakPolarHBondContact O-CA 3.33Å; T650-G653 PolarHBondContact O-N 3.19Å; T650-G653 WeakPolarHBondContact OG1-CA 3.46Å; T650-G653 PolarHBondContact OG1-N 3.05Å; T650-G653 VanDerWaalsContact OG1-N 3.08Å; G653-M656 PolarHBondContact O-N 3.29Å; G653-Y657 WeakPolarHBondContact O-CB 3.33Å; G653-Y657 PolarHBondContact O-N 3.24Å
654	F	86.3	Confident	85.4	Confident	87 Å²	87	61.3 Å²	61.3	38%	0.382	30%	0.299	S	S	.	.	H	α-helix	trans	-56.9	-51.3	173.5	-178.6	-86.9	0	0	0	111.9	L647 Q648 T650 V652 M656 Y657 E658	L647-F654 PolarHBondContact O-N 2.96Å; L647-F654 VanDerWaalsContact O-N 3.08Å; Q648-F654 HydrophobicContact CG-CD2 4.34Å; T650-F654 WeakPolarHBondContact O-CB 3.32Å; T650-F654 PolarHBondContact O-N 3Å; V652-F654 VanDerWaalsContact C-N 3.32Å; V652-F654 PolarHBondContact O-N 3.34Å; F654-M656 PolarHBondContact O-N 3.36Å; F654-Y657 PolarHBondContact O-N 3.22Å; F654-E658 WeakPolarHBondContact O-CB 3.34Å; F654-E658 PolarHBondContact O-N 3Å
655	R	87.6	Confident	85.2	Confident	151 Å²	151	66.5 Å²	66.5	57%	0.57	32%	0.317	S	S	*	.	H	α-helix	trans	-63.5	-41.3	-179.4	-70.6	177.7	-177.6	-175.4	1.1	112.2	Q651 V652 E658 Q659	Q651-R655 WeakPolarHBondContact O-CG 3.36Å; V652-R655 PolarHBondContact O-N 3.42Å; R655-E658 PolarHBondContact O-N 3.39Å; R655-Q659 VanDerWaalsContact O-CG 3.32Å; R655-Q659 WeakPolarHBondContact O-CG 3.43Å; R655-Q659 PolarHBondContact O-N 2.94Å
656	M	84.3	Confident	84.8	Confident	44 Å²	44	69.9 Å²	69.9	22%	0.217	33%	0.327	C	S	.	.	H	α-helix	trans	-70.5	-34.9	179.2	-63.2	-166.9	72.1	0	0	112.1	V622 E623 V652 G653 F654 L660	V622-M656 HydrophobicContact CG1-CB 4.22Å; V622-M656 HydrophobicContact CG1-CG 4.32Å; V622-M656 HydrophobicContact CG1-SD 3.67Å; E623-M656 HydrophobicContact CB-CE 4.42Å; E623-M656 HydrophobicContact CG-CE 3.36Å; E623-M656 HydrophobicContact CG-SD 4.13Å; V652-M656 HydrophobicContact CG1-CG 4.41Å; V652-M656 HydrophobicContact CG1-SD 4.06Å; V652-M656 WeakPolarHBondContact O-CG 3.16Å; V652-M656 PolarHBondContact O-N 3Å; G653-M656 PolarHBondContact O-N 3.29Å; F654-M656 PolarHBondContact O-N 3.36Å; M656-L660 WeakPolarHBondContact O-CB 3.36Å; M656-L660 PolarHBondContact O-N 3.01Å
657	Y	87.3	Confident	84.1	Confident	47 Å²	47	74.4 Å²	74.4	18%	0.184	35%	0.35	C	S	.	.	H	α-helix	trans	-70.5	-38.2	173.8	-178.9	-105.4	0	0	0	112.5	L629 I644 L647 Q648 G653 F654 L660 C661	L629-Y657 HydrophobicContact CD1-CD2 4.14Å; L629-Y657 HydrophobicContact CD1-CE2 3.99Å; I644-Y657 HydrophobicContact CD1-CE2 4.33Å; I644-Y657 HydrophobicContact CG1-CE2 3.74Å; I644-Y657 HydrophobicContact CG2-CE1 3.84Å; I644-Y657 HydrophobicContact CG2-CE2 4.23Å; L647-Y657 HydrophobicContact CD1-CD2 4.12Å; Q648-Y657 HydrophobicContact CG-CD1 4.47Å; G653-Y657 WeakPolarHBondContact O-CB 3.33Å; G653-Y657 PolarHBondContact O-N 3.24Å; F654-Y657 PolarHBondContact O-N 3.22Å; Y657-L660 HydrophobicContact CD2-CD2 4.39Å; Y657-L660 WeakPolarHBondContact O-CB 3.49Å; Y657-L660 PolarHBondContact O-N 3.32Å; Y657-C661 WeakPolarHBondContact CE1-SG 3.46Å; Y657-C661 PolarHBondContact O-N 3.37Å; Y657-C661 PolarHBondContact O-SG 3.25Å
658	E	87.4	Confident	83.4	Confident	98 Å²	98	80.6 Å²	80.6	46%	0.458	38%	0.377	S	S	.	.	H	α-helix	trans	-60.4	-49.1	172.2	-177.4	173.1	-132.3	0	0	110.9	F654 R655 L660 C661 D662	F654-E658 WeakPolarHBondContact O-CB 3.34Å; F654-E658 PolarHBondContact O-N 3Å; R655-E658 PolarHBondContact O-N 3.39Å; E658-L660 VanDerWaalsContact C-N 3.3Å; E658-L660 PolarHBondContact O-N 3.07Å; E658-C661 WeakPolarHBondContact O-CB 3.42Å; E658-C661 PolarHBondContact O-N 3.24Å; E658-C661 VanDerWaalsContact O-N 3.08Å; E658-D662 PolarHBondContact O-N 3.49Å
659	Q	85.8	Confident	82.9	Confident	120 Å²	120	79.2 Å²	79.2	56%	0.561	37%	0.371	S	S	*	.	H	α-helix	trans	-58.9	-37.5	173.1	-72.3	174.3	-2.3	0	0	113	R655 R663	R655-Q659 VanDerWaalsContact O-CG 3.32Å; R655-Q659 WeakPolarHBondContact O-CG 3.43Å; R655-Q659 PolarHBondContact O-N 2.94Å; Q659-R663 WeakPolarHBondContact O-CB 3.4Å; Q659-R663 VanDerWaalsContact O-CG 3.26Å; Q659-R663 WeakPolarHBondContact O-CG 3.5Å; Q659-R663 PolarHBondContact O-N 3.04Å; Q659-R663 PolarHBondContact O-NE 3.49Å
660	L	85	Confident	81.9	Confident	2 Å²	2	79.9 Å²	79.9	1%	0.01	37%	0.369	C	S	.	.	H	α-helix	trans	-65.1	-44.5	173	174.8	62.9	0	0	0	111.4	C626 L629 E630 M656 Y657 E658 D662 R663 Q664	C626-L660 HydrophobicContact CB-CD2 4.35Å; C626-L660 WeakPolarHBondContact O-CD2 3.46Å; L629-L660 HydrophobicContact CB-CD2 3.93Å; E630-L660 HydrophobicContact CB-CD1 3.64Å; E630-L660 HydrophobicContact CG-CD1 3.73Å; E630-L660 WeakPolarHBondContact OE2-CD1 3.47Å; M656-L660 WeakPolarHBondContact O-CB 3.36Å; M656-L660 PolarHBondContact O-N 3.01Å; Y657-L660 HydrophobicContact CD2-CD2 4.39Å; Y657-L660 WeakPolarHBondContact O-CB 3.49Å; Y657-L660 PolarHBondContact O-N 3.32Å; E658-L660 VanDerWaalsContact C-N 3.3Å; E658-L660 PolarHBondContact O-N 3.07Å; L660-D662 VanDerWaalsContact C-N 3.34Å; L660-D662 PolarHBondContact O-N 3.35Å; L660-R663 PolarHBondContact O-N 2.87Å; L660-Q664 HydrophobicContact CD1-CG 4.21Å; L660-Q664 WeakPolarHBondContact O-CB 3.41Å; L660-Q664 WeakPolarHBondContact O-CG 3.35Å; L660-Q664 PolarHBondContact O-N 3.4Å
661	C	84.9	Confident	80.9	Confident	37 Å²	37	83.6 Å²	83.6	25%	0.25	39%	0.385	C	S	.	.	H	α-helix	trans	-61.7	-41	177.5	-71	0	0	0	0	112.2	Y657 E658 Q664 R665	Y657-C661 WeakPolarHBondContact CE1-SG 3.46Å; Y657-C661 PolarHBondContact O-N 3.37Å; Y657-C661 PolarHBondContact O-SG 3.25Å; E658-C661 WeakPolarHBondContact O-CB 3.42Å; E658-C661 PolarHBondContact O-N 3.24Å; E658-C661 VanDerWaalsContact O-N 3.08Å; C661-Q664 PolarHBondContact O-N 2.98Å; C661-R665 WeakPolarHBondContact O-CB 3.13Å; C661-R665 PolarHBondContact O-N 3.08Å
662	D	85.3	Confident	80.2	Confident	69 Å²	69	86.9 Å²	86.9	37%	0.369	39%	0.392	S	S	.	.	H	α-helix	trans	-67.8	-45.1	176.8	-75.5	-16.8	0	0	0	111.7	E658 L660 Q664 R665 E666	E658-D662 PolarHBondContact O-N 3.49Å; L660-D662 VanDerWaalsContact C-N 3.34Å; L660-D662 PolarHBondContact O-N 3.35Å; D662-Q664 VanDerWaalsContact C-N 3.32Å; D662-Q664 PolarHBondContact O-N 3.09Å; D662-R665 WeakPolarHBondContact O-CA 3.42Å; D662-R665 WeakPolarHBondContact O-CB 3.35Å; D662-R665 PolarHBondContact O-N 3.35Å; D662-R665 IonicContact OD1-CZ 2.65Å; D662-R665 IonicContact OD1-NH1 2.84Å; D662-R665 PolarHBondContact OD1-NH1 3.17Å; D662-R665 IonicContact OD1-NH2 3.12Å; D662-R665 PolarHBondContact OD1-NH2 2.68Å; D662-E666 PolarHBondContact O-N 3.14Å
663	R	79.8	Confident	79.4	Confident	107 Å²	107	89.4 Å²	89.4	40%	0.404	40%	0.397	S	S	.	.	H	α-helix	trans	-60.1	-39.9	173	-71.7	-178.3	-58.1	119.9	-4	112.2	E630 Q659 L660 R665 E666 L667	E630-R663 IonicContact OE1-CZ 3.15Å; E630-R663 IonicContact OE1-NH1 2.77Å; E630-R663 PolarHBondContact OE1-NH1 3.02Å; E630-R663 IonicContact OE2-CZ 2.57Å; E630-R663 VanDerWaalsContact OE2-CZ 3.29Å; E630-R663 IonicContact OE2-NH1 2.77Å; E630-R663 PolarHBondContact OE2-NH1 2.92Å; E630-R663 IonicContact OE2-NH2 3.08Å; E630-R663 PolarHBondContact OE2-NH2 3.45Å; Q659-R663 WeakPolarHBondContact O-CB 3.4Å; Q659-R663 VanDerWaalsContact O-CG 3.26Å; Q659-R663 WeakPolarHBondContact O-CG 3.5Å; Q659-R663 PolarHBondContact O-N 3.04Å; Q659-R663 PolarHBondContact O-NE 3.49Å; L660-R663 PolarHBondContact O-N 2.87Å; R663-R665 VanDerWaalsContact C-N 3.35Å; R663-E666 PolarHBondContact O-N 3.22Å; R663-L667 WeakPolarHBondContact O-CB 3.4Å; R663-L667 PolarHBondContact O-N 3.4Å
664	Q	80.6	Confident	78.5	Confident	60 Å²	60	90.3 Å²	90.3	28%	0.28	41%	0.406	S	S	.	.	H	α-helix	trans	-67.1	-33.7	173.5	-74.4	-173.8	10.6	0	0	112.7	L660 C661 D662 K668	L660-Q664 HydrophobicContact CD1-CG 4.21Å; L660-Q664 WeakPolarHBondContact O-CB 3.41Å; L660-Q664 WeakPolarHBondContact O-CG 3.35Å; L660-Q664 PolarHBondContact O-N 3.4Å; C661-Q664 PolarHBondContact O-N 2.98Å; D662-Q664 VanDerWaalsContact C-N 3.32Å; D662-Q664 PolarHBondContact O-N 3.09Å; Q664-K668 WeakPolarHBondContact O-CB 3.36Å; Q664-K668 WeakPolarHBondContact O-CD 3.33Å; Q664-K668 VanDerWaalsContact O-CG 3.23Å; Q664-K668 WeakPolarHBondContact O-CG 3.28Å; Q664-K668 PolarHBondContact O-N 3.21Å
665	R	80.6	Confident	77.9	Confident	136 Å²	136	86.6 Å²	86.6	51%	0.513	39%	0.393	S	S	.	.	H	α-helix	trans	-68.4	-46	174.5	-165.8	-172.4	-53.2	120.1	15.8	110.6	C661 D662 R663 L667 K668 E669	C661-R665 WeakPolarHBondContact O-CB 3.13Å; C661-R665 PolarHBondContact O-N 3.08Å; D662-R665 WeakPolarHBondContact O-CA 3.42Å; D662-R665 WeakPolarHBondContact O-CB 3.35Å; D662-R665 PolarHBondContact O-N 3.35Å; D662-R665 IonicContact OD1-CZ 2.65Å; D662-R665 IonicContact OD1-NH1 2.84Å; D662-R665 PolarHBondContact OD1-NH1 3.17Å; D662-R665 IonicContact OD1-NH2 3.12Å; D662-R665 PolarHBondContact OD1-NH2 2.68Å; R663-R665 VanDerWaalsContact C-N 3.35Å; R665-L667 PolarHBondContact O-N 3.1Å; R665-K668 PolarHBondContact O-N 3.01Å; R665-E669 WeakPolarHBondContact O-CB 3.42Å; R665-E669 WeakPolarHBondContact O-CG 3.32Å; R665-E669 PolarHBondContact O-N 3.28Å
666	E	79.3	Confident	77.6	Confident	125 Å²	125	81.9 Å²	81.9	58%	0.584	38%	0.382	S	S	*	.	H	α-helix	trans	-59.9	-45	175.2	-174.8	176.9	-157.4	0	0	111.4	D662 R663 K668 E669 L670	D662-E666 PolarHBondContact O-N 3.14Å; R663-E666 PolarHBondContact O-N 3.22Å; E666-K668 PolarHBondContact O-N 3.19Å; E666-E669 CarbonylContact O-C 3.6Å; E666-E669 WeakPolarHBondContact O-CB 3.28Å; E666-E669 PolarHBondContact O-N 3.46Å; E666-L670 HydrophobicContact CG-CD1 4.06Å; E666-L670 WeakPolarHBondContact O-CB 3.47Å; E666-L670 WeakPolarHBondContact O-CG 3.48Å; E666-L670 PolarHBondContact O-N 3.2Å
667	L	70.6	Confident	77.6	Confident	100 Å²	100	83.5 Å²	83.5	52%	0.524	39%	0.394	S	S	.	.	H	α-helix	trans	-60.4	-45.4	174.9	-167	81.1	0	0	0	111.8	R663 R665 E669 L670 Q671	R663-L667 WeakPolarHBondContact O-CB 3.4Å; R663-L667 PolarHBondContact O-N 3.4Å; R665-L667 PolarHBondContact O-N 3.1Å; L667-E669 VanDerWaalsContact C-N 3.3Å; L667-E669 PolarHBondContact O-N 3.02Å; L667-L670 PolarHBondContact O-N 3.44Å; L667-Q671 WeakPolarHBondContact O-CB 3.34Å; L667-Q671 VanDerWaalsContact O-CG 3.26Å; L667-Q671 WeakPolarHBondContact O-CG 3.45Å; L667-Q671 PolarHBondContact O-N 2.98Å
668	K	71.9	Confident	77.6	Confident	129 Å²	129	89.3 Å²	89.3	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-64.8	-33.7	175.5	-75.2	167.6	-177	167.8	0	112.2	Q664 R665 E666 R672	Q664-K668 WeakPolarHBondContact O-CB 3.36Å; Q664-K668 WeakPolarHBondContact O-CD 3.33Å; Q664-K668 VanDerWaalsContact O-CG 3.23Å; Q664-K668 WeakPolarHBondContact O-CG 3.28Å; Q664-K668 PolarHBondContact O-N 3.21Å; R665-K668 PolarHBondContact O-N 3.01Å; E666-K668 PolarHBondContact O-N 3.19Å; K668-R672 VanDerWaalsContact O-CB 3.32Å; K668-R672 WeakPolarHBondContact O-CB 3.46Å; K668-R672 PolarHBondContact O-N 3.31Å
669	E	76.6	Confident	77.6	Confident	70 Å²	70	86.2 Å²	86.2	33%	0.327	40%	0.402	S	S	.	.	H	α-helix	trans	-70.7	-39.9	173.5	-82.4	-161.9	-152.9	0	0	112.8	R665 E666 L667 R672 K673	R665-E669 WeakPolarHBondContact O-CB 3.42Å; R665-E669 WeakPolarHBondContact O-CG 3.32Å; R665-E669 PolarHBondContact O-N 3.28Å; E666-E669 CarbonylContact O-C 3.6Å; E666-E669 WeakPolarHBondContact O-CB 3.28Å; E666-E669 PolarHBondContact O-N 3.46Å; L667-E669 VanDerWaalsContact C-N 3.3Å; L667-E669 PolarHBondContact O-N 3.02Å; E669-R672 CarbonylContact O-C 3.43Å; E669-R672 PolarHBondContact O-N 2.98Å; E669-K673 VanDerWaalsContact O-CB 3.27Å; E669-K673 WeakPolarHBondContact O-CB 3.4Å; E669-K673 WeakPolarHBondContact O-CD 3.4Å; E669-K673 WeakPolarHBondContact O-CG 3.36Å; E669-K673 PolarHBondContact O-N 2.99Å; E669-K673 IonicContact OE2-NZ 2.79Å; E669-K673 PolarHBondContact OE2-NZ 3.35Å
670	L	66.6	Low	77.8	Confident	81 Å²	81	85.2 Å²	85.2	42%	0.424	40%	0.404	S	S	.	.	H	α-helix	trans	-63.5	-42.1	173.2	-75.8	162	0	0	0	110.9	E666 L667 K673 G674 G675	E666-L670 HydrophobicContact CG-CD1 4.06Å; E666-L670 WeakPolarHBondContact O-CB 3.47Å; E666-L670 WeakPolarHBondContact O-CG 3.48Å; E666-L670 PolarHBondContact O-N 3.2Å; L667-L670 PolarHBondContact O-N 3.44Å; L670-K673 CarbonylContact O-C 3.55Å; L670-K673 PolarHBondContact O-N 3.19Å; L670-G674 PolarHBondContact O-N 2.89Å; L670-G674 VanDerWaalsContact O-N 3.09Å; L670-G675 PolarHBondContact O-N 3.04Å
671	Q	65.9	Low	78	Confident	98 Å²	98	86.1 Å²	86.1	46%	0.458	41%	0.409	S	S	.	.	H	α-helix	trans	-60.4	-46.6	171.2	-73.3	169.9	-7.6	0	0	111.5	L667 K673 G674	L667-Q671 WeakPolarHBondContact O-CB 3.34Å; L667-Q671 VanDerWaalsContact O-CG 3.26Å; L667-Q671 WeakPolarHBondContact O-CG 3.45Å; L667-Q671 PolarHBondContact O-N 2.98Å; Q671-K673 VanDerWaalsContact C-N 3.29Å; Q671-K673 PolarHBondContact O-N 2.66Å; Q671-G674 WeakPolarHBondContact O-CA 3.49Å; Q671-G674 PolarHBondContact O-N 3.42Å
672	R	69.1	Low	78.2	Confident	197 Å²	197	88.5 Å²	88.5	74%	0.743	42%	0.424	S	S	*	.	H	α-helix	trans	-64.5	-31.2	175.5	-169.7	-177.1	68	170.3	-3.2	112.9	K668 E669 G674	K668-R672 VanDerWaalsContact O-CB 3.32Å; K668-R672 WeakPolarHBondContact O-CB 3.46Å; K668-R672 PolarHBondContact O-N 3.31Å; E669-R672 CarbonylContact O-C 3.43Å; E669-R672 PolarHBondContact O-N 2.98Å; R672-G674 PolarHBondContact O-N 3.06Å
673	K	67.6	Low	78.2	Confident	120 Å²	120	88.6 Å²	88.6	52%	0.522	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	5.1	173.1	-70.6	161.2	176.7	157.1	0	112.5	E669 L670 Q671 G675 N701	E669-K673 VanDerWaalsContact O-CB 3.27Å; E669-K673 WeakPolarHBondContact O-CB 3.4Å; E669-K673 WeakPolarHBondContact O-CD 3.4Å; E669-K673 WeakPolarHBondContact O-CG 3.36Å; E669-K673 PolarHBondContact O-N 2.99Å; E669-K673 IonicContact OE2-NZ 2.79Å; E669-K673 PolarHBondContact OE2-NZ 3.35Å; L670-K673 CarbonylContact O-C 3.55Å; L670-K673 PolarHBondContact O-N 3.19Å; Q671-K673 VanDerWaalsContact C-N 3.29Å; Q671-K673 PolarHBondContact O-N 2.66Å; K673-G675 PolarHBondContact O-N 3.05Å; K673-N701 PolarHBondContact O-ND2 3.46Å
674	G	66	Low	78.5	Confident	18 Å²	18	92.1 Å²	92.1	19%	0.186	45%	0.448	C	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	13.1	172.1	0	0	0	0	0	116.1	L670 Q671 R672 G700 N701	L670-G674 PolarHBondContact O-N 2.89Å; L670-G674 VanDerWaalsContact O-N 3.09Å; Q671-G674 WeakPolarHBondContact O-CA 3.49Å; Q671-G674 PolarHBondContact O-N 3.42Å; R672-G674 PolarHBondContact O-N 3.06Å; G674-G700 PolarHBondContact O-N 3.27Å; G674-N701 WeakPolarHBondContact CA-ND2 3.31Å; G674-N701 WeakPolarHBondContact O-CB 3.49Å; G674-N701 PolarHBondContact O-N 2.83Å; G674-N701 VanDerWaalsContact O-N 3.07Å
675	G	74.4	Confident	79	Confident	10 Å²	10	90 Å²	90	10%	0.103	44%	0.44	C	S	.	.	S	Bend	trans	99.3	-179.1	176.4	0	0	0	0	0	116.2	L670 K673 S698	L670-G675 PolarHBondContact O-N 3.04Å; K673-G675 PolarHBondContact O-N 3.05Å; G675-S698 WeakPolarHBondContact CA-O 3.26Å
676	P	79.9	Confident	79.6	Confident	52 Å²	52	86 Å²	86	34%	0.338	43%	0.43	S	S	.	.			trans	-71.7	141.2	174.6	31	-34.2	0	0	0	111	F699 L702	P676-F699 HydrophobicContact CG-CD1 3.9Å; P676-F699 HydrophobicContact CG-CE1 3.7Å; P676-L702 WeakPolarHBondContact O-CA 3.4Å; P676-L702 WeakPolarHBondContact O-CD1 3.36Å
677	T	84.6	Confident	80.1	Confident	78 Å²	78	81.5 Å²	81.5	48%	0.479	41%	0.411	S	S	.	.	S	Bend	trans	-79.7	-18.5	174.5	55.9	0	0	0	0	113.2	N701 E703 N704	T677-N701 WeakPolarHBondContact CA-O 3.31Å; T677-E703 PolarHBondContact O-N 3.32Å; T677-N704 PolarHBondContact O-N 3.45Å
678	R	87.1	Confident	80.9	Confident	169 Å²	169	79.5 Å²	79.5	64%	0.638	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.7	137.6	176.9	-53.9	-161.2	172.1	-145.6	-4	111.2	N704	R678-N704 CarbonylContact C-O 3.53Å; R678-N704 WeakPolarHBondContact CA-O 3.46Å; R678-N704 HydrophobicContact CB-CB 4.28Å; R678-N704 HydrophobicContact CG-CB 3.91Å; R678-N704 VanDerWaalsContact CZ-ND2 3.31Å; R678-N704 PolarHBondContact NH1-ND2 3.07Å
679	L	89	Confident	81.6	Confident	32 Å²	32	75.8 Å²	75.8	17%	0.168	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	143.5	179.5	-178.5	61.8	0	0	0	110.4	L693 F699 L702 N704 L705 S706	L679-L693 HydrophobicContact CD1-CD2 4.39Å; L679-L693 HydrophobicContact CD2-CD2 3.77Å; L679-F699 HydrophobicContact CD2-CD1 4.24Å; L679-F699 HydrophobicContact CD2-CE1 3.92Å; L679-L702 HydrophobicContact CB-CD1 3.61Å; L679-L702 HydrophobicContact CB-CD2 4.12Å; L679-L702 HydrophobicContact CD2-CD2 4.04Å; L679-N704 PolarHBondContact N-O 3.13Å; L679-L705 HydrophobicContact CB-CD1 4.01Å; L679-L705 HydrophobicContact CD2-CD1 3.93Å; L679-L705 HydrophobicContact CG-CD1 3.98Å; L679-S706 PolarHBondContact O-N 3.11Å
680	T	90.2	Very high	82.1	Confident	100 Å²	100	72.5 Å²	72.5	61%	0.613	38%	0.379	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.3	132.1	173.1	-62.6	0	0	0	0	108.5	S706	T680-S706 WeakPolarHBondContact CA-O 3.5Å
681	L	88.7	Confident	83.1	Confident	20 Å²	20	69.9 Å²	69.9	11%	0.105	37%	0.37	C	S	.	.			trans	-94.4	147.9	177.1	-78	-174.5	0	0	0	112.4	L690 L693 S706 L707 T710	L681-L690 HydrophobicContact CD1-CB 4.01Å; L681-L690 HydrophobicContact CD1-CD1 3.95Å; L681-L690 HydrophobicContact CD1-CG 4.45Å; L681-L693 HydrophobicContact CD2-CD2 3.8Å; L681-S706 PolarHBondContact N-O 2.83Å; L681-S706 VanDerWaalsContact N-O 3.07Å; L681-L707 HydrophobicContact CB-CD2 4.22Å; L681-L707 HydrophobicContact CD1-CD2 3.7Å; L681-L707 HydrophobicContact CG-CD2 4.1Å; L681-T710 HydrophobicContact CB-CG2 4.19Å
682	P	87.9	Confident	84	Confident	88 Å²	88	72.7 Å²	72.7	57%	0.571	38%	0.376	S	S	*	.			trans	-62.1	147.7	170.5	-21.1	32.4	0	0	0	112.5	K684 S685 T710	P682-K684 PolarHBondContact O-N 3.4Å; P682-S685 VanDerWaalsContact O-CB 3.27Å; P682-S685 WeakPolarHBondContact O-CB 3.13Å; P682-S685 PolarHBondContact O-N 3.28Å; P682-S685 PolarHBondContact O-OG 3.48Å; P682-T710 WeakPolarHBondContact O-CG2 3.41Å
683	S	86.6	Confident	84.7	Confident	70 Å²	70	66 Å²	66	49%	0.49	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-19.6	-177.9	52.9	0	0	0	0	116	F709 T710	S683-F709 CarbonylContact C-O 3.53Å; S683-F709 WeakPolarHBondContact CA-O 3.37Å; S683-F709 WeakPolarHBondContact CB-O 3.21Å; S683-T710 WeakPolarHBondContact O-CA 3.25Å
684	K	86.5	Confident	85.3	Confident	182 Å²	182	61.3 Å²	61.3	79%	0.791	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.7	-2.3	176.1	-64.4	-176.3	179.6	179.3	0	114.2	P682	P682-K684 PolarHBondContact O-N 3.4Å
685	S	90.3	Very high	85.9	Confident	14 Å²	14	64.9 Å²	64.9	10%	0.098	36%	0.358	C	S	.	.			trans	-67.4	142.9	-177.9	-73.1	0	0	0	0	112.8	P682 N711	P682-S685 VanDerWaalsContact O-CB 3.27Å; P682-S685 WeakPolarHBondContact O-CB 3.13Å; P682-S685 PolarHBondContact O-N 3.28Å; P682-S685 PolarHBondContact O-OG 3.48Å; S685-N711 PolarHBondContact O-N 3.44Å
686	T	92.5	Very high	85.7	Confident	52 Å²	52	67.8 Å²	67.8	32%	0.319	38%	0.376	S	S	.	.	B	Isolated β-bridge	trans	-114.4	170	178.6	66.7	0	0	0	0	111.7	A688 D689 L690	T686-A688 PolarHBondContact O-N 3.48Å; T686-D689 PolarHBondContact N-OD2 2.88Å; T686-D689 VanDerWaalsContact N-OD2 3.08Å; T686-D689 PolarHBondContact O-N 3.39Å; T686-D689 PolarHBondContact OG1-OD2 2.92Å; T686-L690 PolarHBondContact O-N 2.86Å; T686-L690 VanDerWaalsContact O-N 3.1Å
687	D	89.3	Confident	84.9	Confident	32 Å²	32	68.8 Å²	68.8	17%	0.171	40%	0.396	C	S	.	.	H	α-helix	trans	-52.1	-37.2	173.8	-61.1	-40.3	0	0	0	112.7	D689 L690 A691 V712 T713 C716	D687-D689 PolarHBondContact O-N 3.46Å; D687-L690 PolarHBondContact O-N 2.71Å; D687-A691 VanDerWaalsContact O-CB 3.28Å; D687-A691 WeakPolarHBondContact O-CB 3.19Å; D687-A691 PolarHBondContact O-N 3.08Å; D687-V712 VanDerWaalsContact OD1-CA 3.27Å; D687-V712 WeakPolarHBondContact OD1-CA 3.43Å; D687-V712 WeakPolarHBondContact OD1-CB 3.24Å; D687-T713 PolarHBondContact OD1-N 3.42Å; D687-T713 WeakPolarHBondContact OD2-CB 3.4Å; D687-T713 WeakPolarHBondContact OD2-CG2 3.47Å; D687-T713 PolarHBondContact OD2-N 2.83Å; D687-T713 PolarHBondContact OD2-OG1 3Å; D687-C716 WeakPolarHBondContact OD1-CB 3.44Å
688	A	88.1	Confident	84.1	Confident	58 Å²	58	66 Å²	66	48%	0.479	38%	0.379	S	S	.	.	H	α-helix	trans	-69.6	-30.7	179.1	0	0	0	0	0	113	T686 R692	T686-A688 PolarHBondContact O-N 3.48Å; A688-R692 VanDerWaalsContact O-CB 3.27Å; A688-R692 WeakPolarHBondContact O-CB 3.37Å; A688-R692 PolarHBondContact O-N 3.43Å
689	D	87.1	Confident	83.5	Confident	51 Å²	51	59 Å²	59	27%	0.273	35%	0.354	S	S	.	.	H	α-helix	trans	-77.3	-40.1	176.9	-57.4	-56.1	0	0	0	111.1	T686 D687 R692 L693	T686-D689 PolarHBondContact N-OD2 2.88Å; T686-D689 VanDerWaalsContact N-OD2 3.08Å; T686-D689 PolarHBondContact O-N 3.39Å; T686-D689 PolarHBondContact OG1-OD2 2.92Å; D687-D689 PolarHBondContact O-N 3.46Å; D689-R692 PolarHBondContact O-N 3.36Å; D689-R692 IonicContact OD1-CZ 3.75Å; D689-R692 IonicContact OD1-NH1 3.71Å; D689-R692 PolarHBondContact OD1-NH1 2.88Å; D689-R692 IonicContact OD1-NH2 3.95Å; D689-L693 WeakPolarHBondContact O-CB 3.35Å; D689-L693 PolarHBondContact O-N 2.96Å
690	L	87.6	Confident	82.8	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-63.5	-44.7	172.6	177.9	56.4	0	0	0	111.3	L681 T686 D687 L693 L694 L707 V712 C716 L720	L681-L690 HydrophobicContact CD1-CB 4.01Å; L681-L690 HydrophobicContact CD1-CD1 3.95Å; L681-L690 HydrophobicContact CD1-CG 4.45Å; T686-L690 PolarHBondContact O-N 2.86Å; T686-L690 VanDerWaalsContact O-N 3.1Å; D687-L690 PolarHBondContact O-N 2.71Å; L690-L693 PolarHBondContact O-N 3.44Å; L690-L694 HydrophobicContact CD1-CD1 3.73Å; L690-L694 HydrophobicContact CD1-CG 3.92Å; L690-L694 HydrophobicContact CG-CD1 4.2Å; L690-L694 WeakPolarHBondContact O-CB 3.32Å; L690-L694 WeakPolarHBondContact O-CG 2.99Å; L690-L694 PolarHBondContact O-N 2.89Å; L690-L707 HydrophobicContact CD1-CD2 4.45Å; L690-L707 HydrophobicContact CD2-CD1 3.82Å; L690-L707 HydrophobicContact CD2-CD2 4.1Å; L690-V712 HydrophobicContact CD2-CG1 4.41Å; L690-C716 HydrophobicContact CD2-CB 3.68Å; L690-L720 HydrophobicContact CD2-CD2 4.25Å
691	A	86.8	Confident	82.3	Confident	27 Å²	27	58 Å²	58	22%	0.223	35%	0.353	C	S	.	.	H	α-helix	trans	-60.7	-45.3	174.2	0	0	0	0	0	112.1	D687 L693 S695 Q719	D687-A691 VanDerWaalsContact O-CB 3.28Å; D687-A691 WeakPolarHBondContact O-CB 3.19Å; D687-A691 PolarHBondContact O-N 3.08Å; A691-L693 PolarHBondContact O-N 2.97Å; A691-S695 VanDerWaalsContact O-CB 3.28Å; A691-S695 WeakPolarHBondContact O-CB 3.36Å; A691-S695 PolarHBondContact O-N 3.11Å; A691-S695 PolarHBondContact O-OG 3.42Å; A691-Q719 HydrophobicContact CB-CG 3.93Å
692	R	85.3	Confident	82.3	Confident	157 Å²	157	57 Å²	57	59%	0.592	35%	0.348	S	S	*	.	H	α-helix	trans	-61.5	-43.6	176.4	-169.3	-172.9	-54	121.5	12.7	111.4	A688 D689 S695	A688-R692 VanDerWaalsContact O-CB 3.27Å; A688-R692 WeakPolarHBondContact O-CB 3.37Å; A688-R692 PolarHBondContact O-N 3.43Å; D689-R692 PolarHBondContact O-N 3.36Å; D689-R692 IonicContact OD1-CZ 3.75Å; D689-R692 IonicContact OD1-NH1 3.71Å; D689-R692 PolarHBondContact OD1-NH1 2.88Å; D689-R692 IonicContact OD1-NH2 3.95Å; R692-S695 PolarHBondContact O-N 3.37Å; R692-S695 PolarHBondContact O-OG 2.89Å
693	L	83.4	Confident	82.4	Confident	56 Å²	56	56 Å²	56	29%	0.293	34%	0.335	S	S	.	.	H	α-helix	trans	-61.7	-54.3	178.5	-175.5	61.7	0	0	0	111.1	L679 L681 D689 L690 A691 S695 S696 F699	L679-L693 HydrophobicContact CD1-CD2 4.39Å; L679-L693 HydrophobicContact CD2-CD2 3.77Å; L681-L693 HydrophobicContact CD2-CD2 3.8Å; D689-L693 WeakPolarHBondContact O-CB 3.35Å; D689-L693 PolarHBondContact O-N 2.96Å; L690-L693 PolarHBondContact O-N 3.44Å; A691-L693 PolarHBondContact O-N 2.97Å; L693-S695 VanDerWaalsContact C-N 3.26Å; L693-S695 PolarHBondContact O-N 3.03Å; L693-S696 WeakPolarHBondContact O-CB 3.18Å; L693-S696 PolarHBondContact O-N 2.87Å; L693-S696 VanDerWaalsContact O-N 3.13Å; L693-S696 PolarHBondContact O-OG 3.17Å; L693-F699 HydrophobicContact CD1-CE2 4.25Å; L693-F699 HydrophobicContact CD1-CZ 3.82Å; L693-F699 HydrophobicContact CD2-CZ 4.44Å; L693-F699 HydrophobicContact CG-CE2 4.07Å; L693-F699 HydrophobicContact CG-CZ 3.81Å; L693-F699 VanDerWaalsContact O-CE2 3.27Å; L693-F699 WeakPolarHBondContact O-CE2 3.41Å
694	L	80.9	Confident	82.7	Confident	21 Å²	21	53.4 Å²	53.4	11%	0.11	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-27	-177.9	-65.2	-176.8	0	0	0	113	L690 S696 G697 F699 Q719 L723	L690-L694 HydrophobicContact CD1-CD1 3.73Å; L690-L694 HydrophobicContact CD1-CG 3.92Å; L690-L694 HydrophobicContact CG-CD1 4.2Å; L690-L694 WeakPolarHBondContact O-CB 3.32Å; L690-L694 WeakPolarHBondContact O-CG 2.99Å; L690-L694 PolarHBondContact O-N 2.89Å; L694-S696 PolarHBondContact O-N 2.98Å; L694-S696 VanDerWaalsContact O-N 3.13Å; L694-G697 PolarHBondContact O-N 3.27Å; L694-F699 HydrophobicContact CD2-CB 3.92Å; L694-F699 HydrophobicContact CD2-CD1 4.38Å; L694-F699 HydrophobicContact CD2-CD2 3.69Å; L694-F699 HydrophobicContact CD2-CE2 4.33Å; L694-F699 HydrophobicContact CD2-CG 3.72Å; L694-Q719 HydrophobicContact CD1-CB 3.89Å; L694-L723 HydrophobicContact CD1-CD1 4.22Å; L694-L723 HydrophobicContact CD1-CD2 4.49Å; L694-L723 HydrophobicContact CD1-CG 4.47Å; L694-L723 HydrophobicContact CD2-CD2 3.95Å
695	S	77.3	Confident	83.1	Confident	94 Å²	94	44.9 Å²	44.9	66%	0.657	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-14.6	173.9	75.9	0	0	0	0	114.7	A691 R692 L693 G697	A691-S695 VanDerWaalsContact O-CB 3.28Å; A691-S695 WeakPolarHBondContact O-CB 3.36Å; A691-S695 PolarHBondContact O-N 3.11Å; A691-S695 PolarHBondContact O-OG 3.42Å; R692-S695 PolarHBondContact O-N 3.37Å; R692-S695 PolarHBondContact O-OG 2.89Å; L693-S695 VanDerWaalsContact C-N 3.26Å; L693-S695 PolarHBondContact O-N 3.03Å; S695-G697 PolarHBondContact O-N 3.3Å
696	S	70.3	Confident	83.3	Confident	71 Å²	71	45.4 Å²	45.4	50%	0.497	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	1	176.2	72.8	0	0	0	0	114.5	L693 L694 S698 F699	L693-S696 WeakPolarHBondContact O-CB 3.18Å; L693-S696 PolarHBondContact O-N 2.87Å; L693-S696 VanDerWaalsContact O-N 3.13Å; L693-S696 PolarHBondContact O-OG 3.17Å; L694-S696 PolarHBondContact O-N 2.98Å; L694-S696 VanDerWaalsContact O-N 3.13Å; S696-S698 VanDerWaalsContact C-N 3.32Å; S696-S698 PolarHBondContact O-N 2.88Å; S696-F699 WeakPolarHBondContact OG-CE2 3.44Å
697	G	63.3	Low	83.4	Confident	73 Å²	73	42.9 Å²	42.9	75%	0.753	27%	0.268	S	S	*	.	S	Bend	trans	76.3	9	163.3	0	0	0	0	0	116.3	L694 S695	L694-G697 PolarHBondContact O-N 3.27Å; S695-G697 PolarHBondContact O-N 3.3Å
698	S	67.3	Low	83.6	Confident	18 Å²	18	42.1 Å²	42.1	13%	0.126	27%	0.266	C	S	.	.			trans	-123.1	43.1	-169.8	-173.4	0	0	0	0	113.7	G675 S696	G675-S698 WeakPolarHBondContact CA-O 3.26Å; S696-S698 VanDerWaalsContact C-N 3.32Å; S696-S698 PolarHBondContact O-N 2.88Å
699	F	76.3	Confident	83.8	Confident	23 Å²	23	44.2 Å²	44.2	10%	0.101	26%	0.264	C	S	.	.			trans	-130.2	19.1	-179.6	-62.8	-80.6	0	0	0	114.1	P676 L679 L693 L694 S696 N701 L702 L723	P676-F699 HydrophobicContact CG-CD1 3.9Å; P676-F699 HydrophobicContact CG-CE1 3.7Å; L679-F699 HydrophobicContact CD2-CD1 4.24Å; L679-F699 HydrophobicContact CD2-CE1 3.92Å; L693-F699 HydrophobicContact CD1-CE2 4.25Å; L693-F699 HydrophobicContact CD1-CZ 3.82Å; L693-F699 HydrophobicContact CD2-CZ 4.44Å; L693-F699 HydrophobicContact CG-CE2 4.07Å; L693-F699 HydrophobicContact CG-CZ 3.81Å; L693-F699 VanDerWaalsContact O-CE2 3.27Å; L693-F699 WeakPolarHBondContact O-CE2 3.41Å; L694-F699 HydrophobicContact CD2-CB 3.92Å; L694-F699 HydrophobicContact CD2-CD1 4.38Å; L694-F699 HydrophobicContact CD2-CD2 3.69Å; L694-F699 HydrophobicContact CD2-CE2 4.33Å; L694-F699 HydrophobicContact CD2-CG 3.72Å; S696-F699 WeakPolarHBondContact OG-CE2 3.44Å; F699-N701 PolarHBondContact O-N 2.93Å; F699-L702 HydrophobicContact CB-CB 4.31Å; F699-L702 HydrophobicContact CB-CD2 4.48Å; F699-L702 HydrophobicContact CD1-CD2 4.26Å; F699-L702 VanDerWaalsContact O-CB 3.27Å; F699-L702 WeakPolarHBondContact O-CB 3.48Å; F699-L702 PolarHBondContact O-N 3.4Å; F699-L702 VanDerWaalsContact O-N 3.12Å; F699-L723 HydrophobicContact CB-CD2 3.81Å
700	G	72.4	Confident	84.2	Confident	35 Å²	35	41.9 Å²	41.9	36%	0.361	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-29.4	-178.8	0	0	0	0	0	114	G674 S725	G674-G700 PolarHBondContact O-N 3.27Å; G700-S725 VanDerWaalsContact O-CB 3.27Å; G700-S725 WeakPolarHBondContact O-CB 3.12Å; G700-S725 PolarHBondContact O-OG 3.48Å
701	N	81.4	Confident	84.4	Confident	76 Å²	76	47 Å²	47	41%	0.406	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	13.2	179.3	-66.3	-10	0	0	0	113.7	K673 G674 T677 F699 E703	K673-N701 PolarHBondContact O-ND2 3.46Å; G674-N701 WeakPolarHBondContact CA-ND2 3.31Å; G674-N701 WeakPolarHBondContact O-CB 3.49Å; G674-N701 PolarHBondContact O-N 2.83Å; G674-N701 VanDerWaalsContact O-N 3.07Å; T677-N701 WeakPolarHBondContact CA-O 3.31Å; F699-N701 PolarHBondContact O-N 2.93Å; N701-E703 PolarHBondContact O-N 3.48Å
702	L	87.6	Confident	84.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	27%	0.269	C	S	.	.			trans	-72.4	109.5	-178.7	-176.1	61.1	0	0	0	110.7	P676 L679 F699 N704 L705 L723 S725 L726	P676-L702 WeakPolarHBondContact O-CA 3.4Å; P676-L702 WeakPolarHBondContact O-CD1 3.36Å; L679-L702 HydrophobicContact CB-CD1 3.61Å; L679-L702 HydrophobicContact CB-CD2 4.12Å; L679-L702 HydrophobicContact CD2-CD2 4.04Å; F699-L702 HydrophobicContact CB-CB 4.31Å; F699-L702 HydrophobicContact CB-CD2 4.48Å; F699-L702 HydrophobicContact CD1-CD2 4.26Å; F699-L702 VanDerWaalsContact O-CB 3.27Å; F699-L702 WeakPolarHBondContact O-CB 3.48Å; F699-L702 PolarHBondContact O-N 3.4Å; F699-L702 VanDerWaalsContact O-N 3.12Å; L702-N704 WeakPolarHBondContact CD1-O 3.24Å; L702-L705 HydrophobicContact CD2-CB 4.33Å; L702-L705 HydrophobicContact CD2-CD1 4.39Å; L702-L723 HydrophobicContact CB-CD2 4.38Å; L702-L723 HydrophobicContact CD2-CD1 4.02Å; L702-L723 HydrophobicContact CD2-CD2 4.18Å; L702-S725 CarbonylContact O-C 3.6Å; L702-L726 HydrophobicContact CG-CD1 4.36Å; L702-L726 WeakPolarHBondContact O-CA 3.34Å; L702-L726 PolarHBondContact O-N 2.82Å
703	E	90.7	Very high	85.2	Confident	65 Å²	65	40.8 Å²	40.8	30%	0.304	26%	0.256	S	S	.	.			trans	-94.5	-32.1	-179.2	-56.3	-157.9	160.3	0	0	112.9	T677 N701 S725 K727 Q728	T677-E703 PolarHBondContact O-N 3.32Å; N701-E703 PolarHBondContact O-N 3.48Å; E703-S725 WeakPolarHBondContact CA-O 3.36Å; E703-K727 HydrophobicContact CB-CD 4.43Å; E703-K727 PolarHBondContact O-N 2.89Å; E703-K727 WeakPolarHBondContact OE1-CE 3.36Å; E703-K727 IonicContact OE1-NZ 2.82Å; E703-K727 PolarHBondContact OE1-NZ 3.46Å; E703-K727 IonicContact OE2-NZ 3.75Å; E703-K727 PolarHBondContact OE2-NZ 2.94Å; E703-Q728 PolarHBondContact O-N 3.16Å
704	N	92.7	Very high	85.7	Confident	16 Å²	16	39.6 Å²	39.6	9%	0.086	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	120.3	-177.4	-50.6	57.5	0	0	0	111	T677 R678 L679 L702 Q728	T677-N704 PolarHBondContact O-N 3.45Å; R678-N704 CarbonylContact C-O 3.53Å; R678-N704 WeakPolarHBondContact CA-O 3.46Å; R678-N704 HydrophobicContact CB-CB 4.28Å; R678-N704 HydrophobicContact CG-CB 3.91Å; R678-N704 VanDerWaalsContact CZ-ND2 3.31Å; R678-N704 PolarHBondContact NH1-ND2 3.07Å; L679-N704 PolarHBondContact N-O 3.13Å; L702-N704 WeakPolarHBondContact CD1-O 3.24Å; N704-Q728 WeakPolarHBondContact CA-O 3.46Å; N704-Q728 HydrophobicContact CB-CB 4.21Å; N704-Q728 PolarHBondContact ND2-OE1 2.84Å
705	L	94.1	Very high	86.2	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	123.9	175	179.1	58.2	0	0	0	110.8	L679 L702 L707 L720 L723 L726 Q728 L729 N730	L679-L705 HydrophobicContact CB-CD1 4.01Å; L679-L705 HydrophobicContact CD2-CD1 3.93Å; L679-L705 HydrophobicContact CG-CD1 3.98Å; L702-L705 HydrophobicContact CD2-CB 4.33Å; L702-L705 HydrophobicContact CD2-CD1 4.39Å; L705-L707 HydrophobicContact CD1-CD2 3.96Å; L705-L707 HydrophobicContact CD1-CG 4.42Å; L705-L707 HydrophobicContact CD2-CD1 4.25Å; L705-L707 HydrophobicContact CD2-CD2 4.32Å; L705-L707 HydrophobicContact CD2-CG 4.28Å; L705-L707 HydrophobicContact CG-CD2 4.1Å; L705-L707 HydrophobicContact CG-CG 4.04Å; L705-L720 HydrophobicContact CD2-CD2 3.36Å; L705-L723 HydrophobicContact CD2-CD1 3.97Å; L705-L726 HydrophobicContact CB-CD1 3.74Å; L705-Q728 PolarHBondContact N-O 2.81Å; L705-L729 HydrophobicContact CB-CD1 4.28Å; L705-L729 HydrophobicContact CD2-CD1 4.26Å; L705-L729 HydrophobicContact CG-CD1 4.29Å; L705-L729 WeakPolarHBondContact O-CA 3.3Å; L705-N730 PolarHBondContact O-N 2.89Å
706	S	94.5	Very high	86.9	Confident	25 Å²	25	37.1 Å²	37.1	18%	0.175	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	119.3	172.1	-168.6	0	0	0	0	111.7	L679 T680 L681 N730	L679-S706 PolarHBondContact O-N 3.11Å; T680-S706 WeakPolarHBondContact CA-O 3.5Å; L681-S706 PolarHBondContact N-O 2.83Å; L681-S706 VanDerWaalsContact N-O 3.07Å; S706-N730 PolarHBondContact OG-ND2 2.81Å
707	L	94.9	Very high	87.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	22%	0.217	C	C	.	.			trans	-114.7	16.9	175	-56.5	179.5	0	0	0	111.1	L681 L690 L705 F709 T710 V712 L720 L729 N730 L731 T734	L681-L707 HydrophobicContact CB-CD2 4.22Å; L681-L707 HydrophobicContact CD1-CD2 3.7Å; L681-L707 HydrophobicContact CG-CD2 4.1Å; L690-L707 HydrophobicContact CD1-CD2 4.45Å; L690-L707 HydrophobicContact CD2-CD1 3.82Å; L690-L707 HydrophobicContact CD2-CD2 4.1Å; L705-L707 HydrophobicContact CD1-CD2 3.96Å; L705-L707 HydrophobicContact CD1-CG 4.42Å; L705-L707 HydrophobicContact CD2-CD1 4.25Å; L705-L707 HydrophobicContact CD2-CD2 4.32Å; L705-L707 HydrophobicContact CD2-CG 4.28Å; L705-L707 HydrophobicContact CG-CD2 4.1Å; L705-L707 HydrophobicContact CG-CG 4.04Å; L707-F709 PolarHBondContact O-N 3.44Å; L707-T710 WeakPolarHBondContact O-CB 3.35Å; L707-T710 VanDerWaalsContact O-CG2 3.31Å; L707-T710 WeakPolarHBondContact O-CG2 3.45Å; L707-T710 PolarHBondContact O-N 3.29Å; L707-T710 PolarHBondContact O-OG1 2.71Å; L707-V712 HydrophobicContact CB-CG2 4.28Å; L707-V712 HydrophobicContact CD1-CG2 4.3Å; L707-L720 HydrophobicContact CD1-CD1 4.39Å; L707-L720 HydrophobicContact CD1-CD2 4.21Å; L707-L729 HydrophobicContact CD1-CD1 4.34Å; L707-N730 CarbonylContact C-O 3.39Å; L707-N730 WeakPolarHBondContact CA-O 3.23Å; L707-N730 PolarHBondContact N-O 2.93Å; L707-L731 HydrophobicContact CB-CD2 4.26Å; L707-L731 HydrophobicContact CD1-CD2 3.87Å; L707-T734 WeakPolarHBondContact O-CG2 3.48Å
708	A	93.7	Very high	89.2	Confident	16 Å²	16	36 Å²	36	13%	0.132	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	138.6	-178	0	0	0	0	0	112.3	T710 N730 W732	A708-T710 PolarHBondContact O-N 3.16Å; A708-N730 PolarHBondContact N-O 3.42Å; A708-W732 CarbonylContact C-O 3.58Å; A708-W732 VanDerWaalsContact CA-O 3.25Å; A708-W732 WeakPolarHBondContact CA-O 3.31Å; A708-W732 HydrophobicContact CB-CB 4.05Å
709	F	93.4	Very high	90.3	Very high	101 Å²	101	36.9 Å²	36.9	44%	0.443	21%	0.21	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.9	27.8	-177.1	-50.6	-77.4	0	0	0	114.4	S683 L707 W732	S683-F709 CarbonylContact C-O 3.53Å; S683-F709 WeakPolarHBondContact CA-O 3.37Å; S683-F709 WeakPolarHBondContact CB-O 3.21Å; L707-F709 PolarHBondContact O-N 3.44Å; F709-W732 HydrophobicContact CE1-CD2 4.44Å; F709-W732 HydrophobicContact CE1-CZ2 4.41Å; F709-W732 HydrophobicContact CE2-CD2 4.07Å; F709-W732 AromaticContact CE2-CE3 3.76Å; F709-W732 HydrophobicContact CE2-CE3 3.76Å; F709-W732 HydrophobicContact CE2-CH2 4.25Å; F709-W732 AromaticContact CE2-CZ3 3.86Å; F709-W732 HydrophobicContact CE2-CZ3 3.86Å; F709-W732 AromaticContact CZ-CD2 3.73Å; F709-W732 HydrophobicContact CZ-CD2 3.73Å; F709-W732 AromaticContact CZ-CE2 3.62Å; F709-W732 AromaticContact CZ-CE3 3.8Å; F709-W732 HydrophobicContact CZ-CE3 3.8Å; F709-W732 HydrophobicContact CZ-CG 4.48Å; F709-W732 AromaticContact CZ-CH2 3.75Å; F709-W732 HydrophobicContact CZ-CH2 3.75Å; F709-W732 AromaticContact CZ-CZ2 3.65Å; F709-W732 HydrophobicContact CZ-CZ2 3.65Å; F709-W732 AromaticContact CZ-CZ3 3.81Å; F709-W732 HydrophobicContact CZ-CZ3 3.81Å; F709-W732 PolarHBondContact N-O 2.96Å
710	T	95	Very high	91	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.012	21%	0.205	C	C	.	.			trans	-100.9	157.6	176.2	67.3	0	0	0	0	112.4	L681 P682 S683 L707 A708 V712	L681-T710 HydrophobicContact CB-CG2 4.19Å; P682-T710 WeakPolarHBondContact O-CG2 3.41Å; S683-T710 WeakPolarHBondContact O-CA 3.25Å; L707-T710 WeakPolarHBondContact O-CB 3.35Å; L707-T710 VanDerWaalsContact O-CG2 3.31Å; L707-T710 WeakPolarHBondContact O-CG2 3.45Å; L707-T710 PolarHBondContact O-N 3.29Å; L707-T710 PolarHBondContact O-OG1 2.71Å; A708-T710 PolarHBondContact O-N 3.16Å; T710-V712 PolarHBondContact O-N 3.17Å; T710-V712 VanDerWaalsContact O-N 3.1Å; T710-V712 WeakPolarHBondContact OG1-CG1 3.24Å; T710-V712 VanDerWaalsContact OG1-CG2 3.32Å; T710-V712 WeakPolarHBondContact OG1-CG2 3.47Å
711	N	92.3	Very high	91.8	Very high	109 Å²	109	36.5 Å²	36.5	58%	0.583	20%	0.2	S	C	*	.	B	Isolated β-bridge	trans	-84.2	32.6	178.2	-69.6	0.5	0	0	0	112.4	S685	S685-N711 PolarHBondContact O-N 3.44Å
712	V	93.8	Very high	92.1	Very high	0 Å²	0	39 Å²	39	0%	0	21%	0.208	C	C	.	.			trans	-79	149.5	175	-60.1	0	0	0	0	111.2	D687 L690 L707 T710 T734 Q735	D687-V712 VanDerWaalsContact OD1-CA 3.27Å; D687-V712 WeakPolarHBondContact OD1-CA 3.43Å; D687-V712 WeakPolarHBondContact OD1-CB 3.24Å; L690-V712 HydrophobicContact CD2-CG1 4.41Å; L707-V712 HydrophobicContact CB-CG2 4.28Å; L707-V712 HydrophobicContact CD1-CG2 4.3Å; T710-V712 PolarHBondContact O-N 3.17Å; T710-V712 VanDerWaalsContact O-N 3.1Å; T710-V712 WeakPolarHBondContact OG1-CG1 3.24Å; T710-V712 VanDerWaalsContact OG1-CG2 3.32Å; T710-V712 WeakPolarHBondContact OG1-CG2 3.47Å; V712-T734 HydrophobicContact CG2-CG2 3.76Å; V712-Q735 PolarHBondContact O-N 2.81Å; V712-Q735 VanDerWaalsContact O-N 3.07Å
713	T	93.8	Very high	92.1	Very high	52 Å²	52	39.2 Å²	39.2	32%	0.319	21%	0.209	S	C	.	.	B	Isolated β-bridge	trans	-120.2	179.1	178.3	77.5	0	0	0	0	110.7	D687 A715 C716 Q735	D687-T713 PolarHBondContact OD1-N 3.42Å; D687-T713 WeakPolarHBondContact OD2-CB 3.4Å; D687-T713 WeakPolarHBondContact OD2-CG2 3.47Å; D687-T713 PolarHBondContact OD2-N 2.83Å; D687-T713 PolarHBondContact OD2-OG1 3Å; T713-A715 PolarHBondContact O-N 3.12Å; T713-A715 WeakPolarHBondContact OG1-CB 3.49Å; T713-A715 PolarHBondContact OG1-N 3.28Å; T713-C716 PolarHBondContact O-N 3.26Å; T713-C716 VanDerWaalsContact O-N 3.14Å; T713-C716 PolarHBondContact O-SG 3.17Å; T713-Q735 WeakPolarHBondContact CA-O 3.42Å; T713-Q735 HydrophobicContact CG2-CB 4.22Å
714	S	93.8	Very high	91.5	Very high	32 Å²	32	40.5 Å²	40.5	22%	0.224	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-54.4	-20.8	172.1	-59.4	0	0	0	0	114.1	C716 A717 G737	S714-C716 PolarHBondContact O-N 3.19Å; S714-A717 VanDerWaalsContact O-CB 3.24Å; S714-A717 WeakPolarHBondContact O-CB 3.36Å; S714-A717 PolarHBondContact O-N 3.35Å; S714-A717 VanDerWaalsContact O-N 3.14Å; S714-G737 PolarHBondContact OG-N 2.73Å; S714-G737 PolarHBondContact OG-O 2.94Å
715	A	91.6	Very high	91.2	Very high	61 Å²	61	41.6 Å²	41.6	50%	0.504	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-63.8	-25.3	178	0	0	0	0	0	113.6	T713 A717	T713-A715 PolarHBondContact O-N 3.12Å; T713-A715 WeakPolarHBondContact OG1-CB 3.49Å; T713-A715 PolarHBondContact OG1-N 3.28Å; A715-A717 PolarHBondContact O-N 3.08Å
716	C	92.2	Very high	91.1	Very high	1 Å²	1	41.5 Å²	41.5	1%	0.007	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-70.3	-13.6	175.1	69.4	0	0	0	0	114.1	D687 L690 T713 S714 E718 Q719 L720	D687-C716 WeakPolarHBondContact OD1-CB 3.44Å; L690-C716 HydrophobicContact CD2-CB 3.68Å; T713-C716 PolarHBondContact O-N 3.26Å; T713-C716 VanDerWaalsContact O-N 3.14Å; T713-C716 PolarHBondContact O-SG 3.17Å; S714-C716 PolarHBondContact O-N 3.19Å; C716-E718 PolarHBondContact O-N 3.18Å; C716-Q719 WeakPolarHBondContact O-CA 3.41Å; C716-Q719 WeakPolarHBondContact O-CB 3.41Å; C716-Q719 PolarHBondContact O-N 2.7Å; C716-L720 PolarHBondContact O-N 3.34Å
717	A	92.3	Very high	91.1	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-54.8	-39.6	-179	0	0	0	0	0	112.3	S714 A715 Q719 L720 I721 F736 L743 L744	S714-A717 VanDerWaalsContact O-CB 3.24Å; S714-A717 WeakPolarHBondContact O-CB 3.36Å; S714-A717 PolarHBondContact O-N 3.35Å; S714-A717 VanDerWaalsContact O-N 3.14Å; A715-A717 PolarHBondContact O-N 3.08Å; A717-Q719 PolarHBondContact O-N 3.06Å; A717-Q719 VanDerWaalsContact O-N 3.11Å; A717-L720 PolarHBondContact O-N 2.95Å; A717-L720 VanDerWaalsContact O-N 3.07Å; A717-I721 WeakPolarHBondContact O-CG2 3.48Å; A717-I721 PolarHBondContact O-N 2.58Å; A717-F736 HydrophobicContact CB-CE2 4.2Å; A717-F736 HydrophobicContact CB-CZ 4.08Å; A717-L743 HydrophobicContact CB-CB 4.14Å; A717-L743 HydrophobicContact CB-CD1 4.06Å; A717-L744 HydrophobicContact CB-CD2 4.3Å
718	E	90.6	Very high	91.1	Very high	122 Å²	122	46.9 Å²	46.9	57%	0.57	25%	0.252	S	S	*	.	H	α-helix	trans	-58.4	-23.8	175.1	-66.8	-172.7	-178.1	0	0	114.3	C716 I721 K722	C716-E718 PolarHBondContact O-N 3.18Å; E718-I721 WeakPolarHBondContact O-CG1 3.39Å; E718-K722 WeakPolarHBondContact O-CE 3.46Å
719	Q	90.1	Very high	91.3	Very high	36 Å²	36	46.2 Å²	46.2	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-93.1	-33.9	176.2	-45.9	-55.7	-33.3	0	0	111.2	A691 L694 C716 A717 K722	A691-Q719 HydrophobicContact CB-CG 3.93Å; L694-Q719 HydrophobicContact CD1-CB 3.89Å; C716-Q719 WeakPolarHBondContact O-CA 3.41Å; C716-Q719 WeakPolarHBondContact O-CB 3.41Å; C716-Q719 PolarHBondContact O-N 2.7Å; A717-Q719 PolarHBondContact O-N 3.06Å; A717-Q719 VanDerWaalsContact O-N 3.11Å; Q719-K722 WeakPolarHBondContact O-CB 3.27Å; Q719-K722 PolarHBondContact O-N 3.12Å
720	L	90.4	Very high	91.4	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-64.6	-38.9	176.5	-65.6	-179.7	0	0	0	112.7	L690 L705 L707 C716 A717 K722 L723 L729 F736 L744	L690-L720 HydrophobicContact CD2-CD2 4.25Å; L705-L720 HydrophobicContact CD2-CD2 3.36Å; L707-L720 HydrophobicContact CD1-CD1 4.39Å; L707-L720 HydrophobicContact CD1-CD2 4.21Å; C716-L720 PolarHBondContact O-N 3.34Å; A717-L720 PolarHBondContact O-N 2.95Å; A717-L720 VanDerWaalsContact O-N 3.07Å; L720-K722 PolarHBondContact O-N 3.15Å; L720-K722 VanDerWaalsContact O-N 3.08Å; L720-L723 HydrophobicContact CD2-CD1 4.23Å; L720-L723 WeakPolarHBondContact O-CB 3.42Å; L720-L723 PolarHBondContact O-N 3.34Å; L720-L723 VanDerWaalsContact O-N 3.1Å; L720-L729 HydrophobicContact CD1-CD1 4.42Å; L720-L729 HydrophobicContact CD1-CD2 4.12Å; L720-L729 HydrophobicContact CD2-CD1 4.49Å; L720-F736 HydrophobicContact CD1-CE2 4.21Å; L720-L744 HydrophobicContact CB-CD2 3.74Å; L720-L744 HydrophobicContact CD1-CD2 4.06Å
721	I	89.7	Confident	91.4	Very high	49 Å²	49	43.2 Å²	43.2	25%	0.251	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-11.9	177	64.1	174.4	0	0	0	113.8	A717 E718 L723 L744 H747	A717-I721 WeakPolarHBondContact O-CG2 3.48Å; A717-I721 PolarHBondContact O-N 2.58Å; E718-I721 WeakPolarHBondContact O-CG1 3.39Å; I721-L723 VanDerWaalsContact C-N 3.26Å; I721-L723 PolarHBondContact O-N 3.19Å; I721-L744 HydrophobicContact CG2-CD2 4.25Å; I721-H747 HydrophobicContact CB-CB 3.8Å; I721-H747 HydrophobicContact CG2-CB 3.64Å
722	K	86.8	Confident	91.6	Very high	130 Å²	130	42.3 Å²	42.3	57%	0.565	22%	0.223	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	5.4	175.5	-57.6	173.2	-176.7	163.4	0	113.1	E718 Q719 L720 P724	E718-K722 WeakPolarHBondContact O-CE 3.46Å; Q719-K722 WeakPolarHBondContact O-CB 3.27Å; Q719-K722 PolarHBondContact O-N 3.12Å; L720-K722 PolarHBondContact O-N 3.15Å; L720-K722 VanDerWaalsContact O-N 3.08Å; K722-P724 WeakPolarHBondContact O-CD 3.4Å
723	L	88.3	Confident	91.6	Very high	4 Å²	4	44.3 Å²	44.3	2%	0.021	24%	0.237	C	C	.	.			trans	-105.9	81.8	-179.8	-59.8	173.6	0	0	0	110.3	L694 F699 L702 L705 L720 I721 S725 L726	L694-L723 HydrophobicContact CD1-CD1 4.22Å; L694-L723 HydrophobicContact CD1-CD2 4.49Å; L694-L723 HydrophobicContact CD1-CG 4.47Å; L694-L723 HydrophobicContact CD2-CD2 3.95Å; F699-L723 HydrophobicContact CB-CD2 3.81Å; L702-L723 HydrophobicContact CB-CD2 4.38Å; L702-L723 HydrophobicContact CD2-CD1 4.02Å; L702-L723 HydrophobicContact CD2-CD2 4.18Å; L705-L723 HydrophobicContact CD2-CD1 3.97Å; L720-L723 HydrophobicContact CD2-CD1 4.23Å; L720-L723 WeakPolarHBondContact O-CB 3.42Å; L720-L723 PolarHBondContact O-N 3.34Å; L720-L723 VanDerWaalsContact O-N 3.1Å; I721-L723 VanDerWaalsContact C-N 3.26Å; I721-L723 PolarHBondContact O-N 3.19Å; L723-S725 PolarHBondContact O-N 2.72Å; L723-S725 VanDerWaalsContact O-N 3.14Å; L723-L726 HydrophobicContact CB-CB 4.04Å; L723-L726 HydrophobicContact CD1-CD1 4.45Å; L723-L726 HydrophobicContact CD1-CD2 4.3Å; L723-L726 WeakPolarHBondContact O-CB 3.33Å; L723-L726 PolarHBondContact O-N 3.19Å
724	P	78.3	Confident	91.7	Very high	92 Å²	92	41.9 Å²	41.9	60%	0.597	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21	-170.3	28.2	-37.5	0	0	0	114	K722	K722-P724 WeakPolarHBondContact O-CD 3.4Å
725	S	86.6	Confident	91.7	Very high	38 Å²	38	46.6 Å²	46.6	27%	0.266	24%	0.241	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.8	3.4	-178.4	-54.7	0	0	0	0	114	G700 L702 E703 L723 K727	G700-S725 VanDerWaalsContact O-CB 3.27Å; G700-S725 WeakPolarHBondContact O-CB 3.12Å; G700-S725 PolarHBondContact O-OG 3.48Å; L702-S725 CarbonylContact O-C 3.6Å; E703-S725 WeakPolarHBondContact CA-O 3.36Å; L723-S725 PolarHBondContact O-N 2.72Å; L723-S725 VanDerWaalsContact O-N 3.14Å; S725-K727 PolarHBondContact O-N 3.46Å
726	L	91.9	Very high	91.9	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	22%	0.217	C	C	.	.			trans	-70.1	118.3	-171	-163.6	71.1	0	0	0	111.7	L702 L705 L723 L729 L748 L751	L702-L726 HydrophobicContact CG-CD1 4.36Å; L702-L726 WeakPolarHBondContact O-CA 3.34Å; L702-L726 PolarHBondContact O-N 2.82Å; L705-L726 HydrophobicContact CB-CD1 3.74Å; L723-L726 HydrophobicContact CB-CB 4.04Å; L723-L726 HydrophobicContact CD1-CD1 4.45Å; L723-L726 HydrophobicContact CD1-CD2 4.3Å; L723-L726 WeakPolarHBondContact O-CB 3.33Å; L723-L726 PolarHBondContact O-N 3.19Å; L726-L729 HydrophobicContact CD2-CB 4.18Å; L726-L729 HydrophobicContact CD2-CD1 4.38Å; L726-L748 HydrophobicContact CD2-CD1 4.11Å; L726-L751 HydrophobicContact CD2-CD1 4.23Å; L726-L751 HydrophobicContact CG-CD1 4.07Å
727	K	94	Very high	92	Very high	66 Å²	66	44.1 Å²	44.1	29%	0.287	22%	0.222	S	C	.	.			trans	-107.8	-29.2	179.1	-64.1	174.4	-165	163.3	0	112.6	E703 S725 Q752 V753	E703-K727 HydrophobicContact CB-CD 4.43Å; E703-K727 PolarHBondContact O-N 2.89Å; E703-K727 WeakPolarHBondContact OE1-CE 3.36Å; E703-K727 IonicContact OE1-NZ 2.82Å; E703-K727 PolarHBondContact OE1-NZ 3.46Å; E703-K727 IonicContact OE2-NZ 3.75Å; E703-K727 PolarHBondContact OE2-NZ 2.94Å; S725-K727 PolarHBondContact O-N 3.46Å; K727-Q752 WeakPolarHBondContact O-CA 3.25Å; K727-Q752 PolarHBondContact O-N 2.79Å; K727-V753 PolarHBondContact O-N 3.31Å
728	Q	95.4	Very high	92.2	Very high	73 Å²	73	45.9 Å²	45.9	34%	0.341	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131	124.8	-178.2	-51.8	-165.2	-7.1	0	0	110.9	E703 N704 L705 V753	E703-Q728 PolarHBondContact O-N 3.16Å; N704-Q728 WeakPolarHBondContact CA-O 3.46Å; N704-Q728 HydrophobicContact CB-CB 4.21Å; N704-Q728 PolarHBondContact ND2-OE1 2.84Å; L705-Q728 PolarHBondContact N-O 2.81Å; Q728-V753 WeakPolarHBondContact CA-O 3.3Å; Q728-V753 HydrophobicContact CB-CB 4.14Å; Q728-V753 HydrophobicContact CG-CB 3.88Å; Q728-V753 HydrophobicContact CG-CG2 3.94Å
729	L	96.3	Very high	92.3	Very high	2 Å²	2	43.4 Å²	43.4	1%	0.01	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	123.1	177.4	178.5	60	0	0	0	110	L705 L707 L720 L726 L731 L744 L751 V753 L754 N755	L705-L729 HydrophobicContact CB-CD1 4.28Å; L705-L729 HydrophobicContact CD2-CD1 4.26Å; L705-L729 HydrophobicContact CG-CD1 4.29Å; L705-L729 WeakPolarHBondContact O-CA 3.3Å; L707-L729 HydrophobicContact CD1-CD1 4.34Å; L720-L729 HydrophobicContact CD1-CD1 4.42Å; L720-L729 HydrophobicContact CD1-CD2 4.12Å; L720-L729 HydrophobicContact CD2-CD1 4.49Å; L726-L729 HydrophobicContact CD2-CB 4.18Å; L726-L729 HydrophobicContact CD2-CD1 4.38Å; L729-L731 HydrophobicContact CD1-CD2 4.45Å; L729-L731 HydrophobicContact CD1-CG 4.29Å; L729-L731 HydrophobicContact CD2-CD1 3.9Å; L729-L731 HydrophobicContact CD2-CG 4.3Å; L729-L731 HydrophobicContact CG-CD1 4.12Å; L729-L731 HydrophobicContact CG-CG 4.02Å; L729-L744 HydrophobicContact CD2-CD1 3.56Å; L729-L751 HydrophobicContact CB-CD1 3.93Å; L729-L751 HydrophobicContact CB-CD2 4.29Å; L729-V753 PolarHBondContact N-O 3.41Å; L729-L754 HydrophobicContact CB-CD1 4.14Å; L729-L754 HydrophobicContact CD2-CD1 4.12Å; L729-L754 HydrophobicContact CG-CD1 4.18Å; L729-L754 WeakPolarHBondContact O-CA 3.4Å; L729-N755 PolarHBondContact O-N 3.36Å
730	N	95.9	Very high	92.4	Very high	40 Å²	40	41.7 Å²	41.7	21%	0.214	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	113.2	177.8	-178.7	16.8	0	0	0	110.6	L705 S706 L707 A708 W732 N755	L705-N730 PolarHBondContact O-N 2.89Å; S706-N730 PolarHBondContact OG-ND2 2.81Å; L707-N730 CarbonylContact C-O 3.39Å; L707-N730 WeakPolarHBondContact CA-O 3.23Å; L707-N730 PolarHBondContact N-O 2.93Å; A708-N730 PolarHBondContact N-O 3.42Å; N730-W732 WeakPolarHBondContact OD1-CB 3.43Å; N730-W732 PolarHBondContact OD1-N 2.94Å; N730-N755 HydrophobicContact CB-CB 4.43Å; N730-N755 WeakPolarHBondContact OD1-CB 3.46Å; N730-N755 PolarHBondContact OD1-ND2 3.19Å
731	L	96.1	Very high	92.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	22%	0.223	C	C	.	.			trans	-114.1	19.1	-178.4	-68.4	163.5	0	0	0	112.1	L707 L729 S733 T734 F736 L744 L754 N755 L756 T759	L707-L731 HydrophobicContact CB-CD2 4.26Å; L707-L731 HydrophobicContact CD1-CD2 3.87Å; L729-L731 HydrophobicContact CD1-CD2 4.45Å; L729-L731 HydrophobicContact CD1-CG 4.29Å; L729-L731 HydrophobicContact CD2-CD1 3.9Å; L729-L731 HydrophobicContact CD2-CG 4.3Å; L729-L731 HydrophobicContact CG-CD1 4.12Å; L729-L731 HydrophobicContact CG-CG 4.02Å; L731-S733 PolarHBondContact O-N 2.8Å; L731-T734 WeakPolarHBondContact O-CB 3.25Å; L731-T734 VanDerWaalsContact O-CG2 3.3Å; L731-T734 WeakPolarHBondContact O-CG2 3.3Å; L731-T734 PolarHBondContact O-N 3Å; L731-T734 PolarHBondContact O-OG1 2.79Å; L731-F736 HydrophobicContact CD1-CB 4.4Å; L731-F736 HydrophobicContact CD1-CD1 3.7Å; L731-F736 HydrophobicContact CD1-CD2 4.24Å; L731-F736 HydrophobicContact CD1-CE1 3.95Å; L731-F736 HydrophobicContact CD1-CE2 4.47Å; L731-F736 HydrophobicContact CD1-CG 3.85Å; L731-F736 HydrophobicContact CD1-CZ 4.34Å; L731-F736 HydrophobicContact CD2-CB 4.3Å; L731-F736 HydrophobicContact CD2-CD2 3.96Å; L731-F736 HydrophobicContact CD2-CG 4.1Å; L731-L744 HydrophobicContact CD1-CD1 4.4Å; L731-L754 HydrophobicContact CD1-CD1 4.26Å; L731-N755 WeakPolarHBondContact CA-O 3.3Å; L731-N755 WeakPolarHBondContact CB-O 3.5Å; L731-N755 PolarHBondContact N-O 2.85Å; L731-L756 HydrophobicContact CB-CD2 4.48Å; L731-L756 HydrophobicContact CD1-CD2 3.92Å; L731-T759 HydrophobicContact CB-CG2 4.45Å; L731-T759 VanDerWaalsContact O-CG2 3.24Å; L731-T759 WeakPolarHBondContact O-CG2 3.3Å
732	W	95.7	Very high	92.7	Very high	90 Å²	90	45.1 Å²	45.1	34%	0.341	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	127.8	-177.6	178.7	17.9	0	0	0	112.2	A708 F709 N730 C757 E758	A708-W732 CarbonylContact C-O 3.58Å; A708-W732 VanDerWaalsContact CA-O 3.25Å; A708-W732 WeakPolarHBondContact CA-O 3.31Å; A708-W732 HydrophobicContact CB-CB 4.05Å; F709-W732 HydrophobicContact CE1-CD2 4.44Å; F709-W732 HydrophobicContact CE1-CZ2 4.41Å; F709-W732 HydrophobicContact CE2-CD2 4.07Å; F709-W732 AromaticContact CE2-CE3 3.76Å; F709-W732 HydrophobicContact CE2-CE3 3.76Å; F709-W732 HydrophobicContact CE2-CH2 4.25Å; F709-W732 AromaticContact CE2-CZ3 3.86Å; F709-W732 HydrophobicContact CE2-CZ3 3.86Å; F709-W732 AromaticContact CZ-CD2 3.73Å; F709-W732 HydrophobicContact CZ-CD2 3.73Å; F709-W732 AromaticContact CZ-CE2 3.62Å; F709-W732 AromaticContact CZ-CE3 3.8Å; F709-W732 HydrophobicContact CZ-CE3 3.8Å; F709-W732 HydrophobicContact CZ-CG 4.48Å; F709-W732 AromaticContact CZ-CH2 3.75Å; F709-W732 HydrophobicContact CZ-CH2 3.75Å; F709-W732 AromaticContact CZ-CZ2 3.65Å; F709-W732 HydrophobicContact CZ-CZ2 3.65Å; F709-W732 AromaticContact CZ-CZ3 3.81Å; F709-W732 HydrophobicContact CZ-CZ3 3.81Å; F709-W732 PolarHBondContact N-O 2.96Å; N730-W732 WeakPolarHBondContact OD1-CB 3.43Å; N730-W732 PolarHBondContact OD1-N 2.94Å; W732-C757 CarbonylContact C-O 3.25Å; W732-C757 VanDerWaalsContact CA-O 3.29Å; W732-C757 WeakPolarHBondContact CA-O 3.45Å; W732-C757 HydrophobicContact CB-CB 4.34Å; W732-C757 HydrophobicContact CG-CB 4Å; W732-E758 PolarHBondContact NE1-OE1 3.26Å
733	S	94.4	Very high	93	Very high	41 Å²	41	41.8 Å²	41.8	29%	0.287	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	51.8	177.1	-157	0	0	0	0	112.1	L731 C757	L731-S733 PolarHBondContact O-N 2.8Å; S733-C757 PolarHBondContact N-O 3.44Å
734	T	95.8	Very high	93.3	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.012	22%	0.22	C	C	.	.	S	Bend	trans	-124.6	164.7	175.3	64.8	0	0	0	0	110.9	L707 V712 L731 F736 P760	L707-T734 WeakPolarHBondContact O-CG2 3.48Å; V712-T734 HydrophobicContact CG2-CG2 3.76Å; L731-T734 WeakPolarHBondContact O-CB 3.25Å; L731-T734 VanDerWaalsContact O-CG2 3.3Å; L731-T734 WeakPolarHBondContact O-CG2 3.3Å; L731-T734 PolarHBondContact O-N 3Å; L731-T734 PolarHBondContact O-OG1 2.79Å; T734-F736 PolarHBondContact O-N 3.09Å; T734-F736 WeakPolarHBondContact OG1-CB 3.29Å; T734-P760 WeakPolarHBondContact O-CD 3.49Å
735	Q	93.8	Very high	93.9	Very high	130 Å²	130	37.7 Å²	37.7	61%	0.607	20%	0.195	S	C	*	.	B	Isolated β-bridge	trans	-87.5	33.2	177.1	-60	-60.7	-43	0	0	112	V712 T713	V712-Q735 PolarHBondContact O-N 2.81Å; V712-Q735 VanDerWaalsContact O-N 3.07Å; T713-Q735 WeakPolarHBondContact CA-O 3.42Å; T713-Q735 HydrophobicContact CG2-CB 4.22Å
736	F	95.6	Very high	94	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.21	C	C	.	.			trans	-84	138	179.9	-158.4	-88.2	0	0	0	110.8	A717 L720 L731 T734 G740 L741 L744 P760	A717-F736 HydrophobicContact CB-CE2 4.2Å; A717-F736 HydrophobicContact CB-CZ 4.08Å; L720-F736 HydrophobicContact CD1-CE2 4.21Å; L731-F736 HydrophobicContact CD1-CB 4.4Å; L731-F736 HydrophobicContact CD1-CD1 3.7Å; L731-F736 HydrophobicContact CD1-CD2 4.24Å; L731-F736 HydrophobicContact CD1-CE1 3.95Å; L731-F736 HydrophobicContact CD1-CE2 4.47Å; L731-F736 HydrophobicContact CD1-CG 3.85Å; L731-F736 HydrophobicContact CD1-CZ 4.34Å; L731-F736 HydrophobicContact CD2-CB 4.3Å; L731-F736 HydrophobicContact CD2-CD2 3.96Å; L731-F736 HydrophobicContact CD2-CG 4.1Å; T734-F736 PolarHBondContact O-N 3.09Å; T734-F736 WeakPolarHBondContact OG1-CB 3.29Å; F736-G740 VanDerWaalsContact CZ-C 3.49Å; F736-L741 HydrophobicContact CE1-CB 4.26Å; F736-L741 HydrophobicContact CE1-CD1 4.41Å; F736-L744 HydrophobicContact CE1-CD1 3.78Å; F736-L744 HydrophobicContact CE1-CG 4.38Å; F736-L744 HydrophobicContact CZ-CD1 3.55Å; F736-L744 HydrophobicContact CZ-CD2 4.45Å; F736-L744 HydrophobicContact CZ-CG 3.91Å; F736-P760 WeakPolarHBondContact O-CD 3.36Å; F736-P760 WeakPolarHBondContact O-CG 3.45Å
737	G	94.4	Very high	93.9	Very high	11 Å²	11	46.9 Å²	46.9	11%	0.113	23%	0.234	C	C	.	.			trans	-146.3	-175.3	-171	0	0	0	0	0	113.9	S714 A739 G740 L741	S714-G737 PolarHBondContact OG-N 2.73Å; S714-G737 PolarHBondContact OG-O 2.94Å; G737-A739 VanDerWaalsContact C-N 3.29Å; G737-A739 PolarHBondContact O-N 3.4Å; G737-A739 VanDerWaalsContact O-N 3.11Å; G737-G740 PolarHBondContact O-N 2.82Å; G737-L741 PolarHBondContact O-N 3Å
738	D	95	Very high	93.7	Very high	37 Å²	37	44.1 Å²	44.1	20%	0.198	22%	0.222	C	C	.	.	H	α-helix	trans	-52.8	-38.7	-166.5	-57.5	-13.1	0	0	0	115	L741 R742 V761 T762 G765	D738-L741 PolarHBondContact O-N 3.15Å; D738-R742 PolarHBondContact O-N 2.95Å; D738-V761 VanDerWaalsContact OD1-CA 3.32Å; D738-V761 WeakPolarHBondContact OD1-CA 3.35Å; D738-T762 PolarHBondContact OD1-N 2.88Å; D738-T762 PolarHBondContact OD2-OG1 3.33Å; D738-G765 WeakPolarHBondContact OD1-CA 3.44Å
739	A	92.7	Very high	93.2	Very high	69 Å²	69	43.7 Å²	43.7	57%	0.57	23%	0.231	S	C	*	.	H	α-helix	trans	-65.3	-41.7	178.8	0	0	0	0	0	112.2	G737	G737-A739 VanDerWaalsContact C-N 3.29Å; G737-A739 PolarHBondContact O-N 3.4Å; G737-A739 VanDerWaalsContact O-N 3.11Å
740	G	92.9	Very high	92.8	Very high	0 Å²	0	47 Å²	47	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-68.1	-41.7	173.5	0	0	0	0	0	111.1	F736 G737 R742 L743 L744	F736-G740 VanDerWaalsContact CZ-C 3.49Å; G737-G740 PolarHBondContact O-N 2.82Å; G740-R742 VanDerWaalsContact C-N 3.33Å; G740-R742 PolarHBondContact O-N 3.39Å; G740-L743 WeakPolarHBondContact O-CB 3.45Å; G740-L743 PolarHBondContact O-N 2.75Å; G740-L744 WeakPolarHBondContact O-CG 3.31Å; G740-L744 PolarHBondContact O-N 3.26Å
741	L	94.1	Very high	92.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.5	-37.8	-177	-164.1	60.1	0	0	0	112.9	F736 G737 D738 L744 S745 L754 L756 V761 G765 L766 L769	F736-L741 HydrophobicContact CE1-CB 4.26Å; F736-L741 HydrophobicContact CE1-CD1 4.41Å; G737-L741 PolarHBondContact O-N 3Å; D738-L741 PolarHBondContact O-N 3.15Å; L741-L744 PolarHBondContact O-N 3.47Å; L741-S745 PolarHBondContact O-N 3.3Å; L741-L754 HydrophobicContact CD1-CD2 4Å; L741-L756 HydrophobicContact CD1-CD1 4.06Å; L741-L756 HydrophobicContact CD1-CD2 4.05Å; L741-L756 HydrophobicContact CD2-CD1 3.83Å; L741-V761 HydrophobicContact CD2-CG1 3.57Å; L741-V761 HydrophobicContact CD2-CG2 4.18Å; L741-G765 WeakPolarHBondContact CD2-O 3.47Å; L741-L766 HydrophobicContact CD2-CD2 4.12Å; L741-L769 HydrophobicContact CD1-CD2 3.78Å; L741-L769 HydrophobicContact CD2-CD1 4.25Å; L741-L769 HydrophobicContact CD2-CD2 4.34Å; L741-L769 HydrophobicContact CD2-CG 4.22Å; L741-L769 HydrophobicContact CG-CD2 3.89Å; L741-L769 HydrophobicContact CG-CG 4.27Å
742	R	93.3	Very high	92.6	Very high	122 Å²	122	49.1 Å²	49.1	46%	0.46	26%	0.262	S	S	.	.	H	α-helix	trans	-61.7	-45.1	172.7	-171.1	-180	-57.5	163.4	5	112.5	D738 G740 L744 S745 E746 A768	D738-R742 PolarHBondContact O-N 2.95Å; G740-R742 VanDerWaalsContact C-N 3.33Å; G740-R742 PolarHBondContact O-N 3.39Å; R742-L744 VanDerWaalsContact C-N 3.29Å; R742-L744 PolarHBondContact O-N 2.94Å; R742-S745 PolarHBondContact O-N 3.46Å; R742-S745 VanDerWaalsContact O-N 3.11Å; R742-S745 PolarHBondContact O-OG 3.21Å; R742-S745 VanDerWaalsContact O-OG 3.07Å; R742-E746 WeakPolarHBondContact CG-OE1 3.13Å; R742-E746 WeakPolarHBondContact O-CG 3.09Å; R742-E746 PolarHBondContact O-N 2.93Å; R742-A768 HydrophobicContact CB-CB 4.26Å; R742-A768 HydrophobicContact CG-CB 4.29Å
743	L	93.4	Very high	92.6	Very high	59 Å²	59	46.9 Å²	46.9	31%	0.309	26%	0.258	S	S	.	.	H	α-helix	trans	-61.7	-37.7	175.3	-70.9	170.4	0	0	0	112.1	A717 G740 H747	A717-L743 HydrophobicContact CB-CB 4.14Å; A717-L743 HydrophobicContact CB-CD1 4.06Å; G740-L743 WeakPolarHBondContact O-CB 3.45Å; G740-L743 PolarHBondContact O-N 2.75Å; L743-H747 PolarHBondContact O-CD2 3.48Å; L743-H747 PolarHBondContact O-N 2.93Å
744	L	93.1	Very high	92.6	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-65.2	-39.3	173.8	-58.1	-173.7	0	0	0	111.6	A717 L720 I721 L729 L731 F736 G740 L741 R742 H747 L748	A717-L744 HydrophobicContact CB-CD2 4.3Å; L720-L744 HydrophobicContact CB-CD2 3.74Å; L720-L744 HydrophobicContact CD1-CD2 4.06Å; I721-L744 HydrophobicContact CG2-CD2 4.25Å; L729-L744 HydrophobicContact CD2-CD1 3.56Å; L731-L744 HydrophobicContact CD1-CD1 4.4Å; F736-L744 HydrophobicContact CE1-CD1 3.78Å; F736-L744 HydrophobicContact CE1-CG 4.38Å; F736-L744 HydrophobicContact CZ-CD1 3.55Å; F736-L744 HydrophobicContact CZ-CD2 4.45Å; F736-L744 HydrophobicContact CZ-CG 3.91Å; G740-L744 WeakPolarHBondContact O-CG 3.31Å; G740-L744 PolarHBondContact O-N 3.26Å; L741-L744 PolarHBondContact O-N 3.47Å; R742-L744 VanDerWaalsContact C-N 3.29Å; R742-L744 PolarHBondContact O-N 2.94Å; L744-H747 PolarHBondContact O-N 2.88Å; L744-L748 HydrophobicContact CB-CD1 4.33Å; L744-L748 HydrophobicContact CD2-CD1 3.78Å; L744-L748 HydrophobicContact CG-CD1 4.5Å; L744-L748 WeakPolarHBondContact O-CB 3.34Å; L744-L748 PolarHBondContact O-N 3.24Å
745	S	90.7	Very high	92.6	Very high	11 Å²	11	46.1 Å²	46.1	8%	0.077	25%	0.251	C	S	.	.	H	α-helix	trans	-74.4	-23.5	-177.9	80.1	0	0	0	0	114.7	L741 R742 A768 S771 M772	L741-S745 PolarHBondContact O-N 3.3Å; R742-S745 PolarHBondContact O-N 3.46Å; R742-S745 VanDerWaalsContact O-N 3.11Å; R742-S745 PolarHBondContact O-OG 3.21Å; R742-S745 VanDerWaalsContact O-OG 3.07Å; S745-A768 WeakPolarHBondContact CB-O 3.27Å; S745-A768 PolarHBondContact OG-O 3.43Å; S745-S771 PolarHBondContact O-OG 2.77Å; S745-M772 VanDerWaalsContact CA-SD 3.56Å
746	E	90.1	Very high	92.7	Very high	125 Å²	125	40 Å²	40	58%	0.584	22%	0.222	S	C	*	.	H	α-helix	trans	-78.7	-29.8	174	-72.1	173	-163.3	0	0	112.8	R742	R742-E746 WeakPolarHBondContact CG-OE1 3.13Å; R742-E746 WeakPolarHBondContact O-CG 3.09Å; R742-E746 PolarHBondContact O-N 2.93Å
747	H	88.6	Confident	92.7	Very high	107 Å²	107	40.4 Å²	40.4	50%	0.495	23%	0.225	S	C	.	.	H	α-helix	trans	-116.9	-29.9	-169.8	-66.4	-62.2	0	0	0	115.9	I721 L743 L744 A749	I721-H747 HydrophobicContact CB-CB 3.8Å; I721-H747 HydrophobicContact CG2-CB 3.64Å; L743-H747 PolarHBondContact O-CD2 3.48Å; L743-H747 PolarHBondContact O-N 2.93Å; L744-H747 PolarHBondContact O-N 2.88Å; H747-A749 PolarHBondContact O-N 3.01Å
748	L	90.5	Very high	92.7	Very high	8 Å²	8	44.2 Å²	44.2	4%	0.042	24%	0.24	C	C	.	.			trans	-96.5	54.9	-175.9	-62	-176.2	0	0	0	112.8	L726 L744 C750 L751 M772	L726-L748 HydrophobicContact CD2-CD1 4.11Å; L744-L748 HydrophobicContact CB-CD1 4.33Å; L744-L748 HydrophobicContact CD2-CD1 3.78Å; L744-L748 HydrophobicContact CG-CD1 4.5Å; L744-L748 WeakPolarHBondContact O-CB 3.34Å; L744-L748 PolarHBondContact O-N 3.24Å; L748-C750 PolarHBondContact O-N 3.01Å; L748-L751 HydrophobicContact CB-CB 4.36Å; L748-L751 WeakPolarHBondContact O-CB 3.48Å; L748-L751 PolarHBondContact O-N 3.4Å; L748-M772 HydrophobicContact CB-CE 4.25Å; L748-M772 WeakPolarHBondContact O-CE 3.25Å
749	A	84.1	Confident	92.7	Very high	64 Å²	64	42.7 Å²	42.7	53%	0.529	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-16.9	-178.1	0	0	0	0	0	114.9	H747 S774	H747-A749 PolarHBondContact O-N 3.01Å; A749-S774 WeakPolarHBondContact O-CB 3.17Å; A749-S774 PolarHBondContact O-OG 2.84Å
750	C	88.2	Confident	92.8	Very high	72 Å²	72	42.3 Å²	42.3	49%	0.486	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-2.9	178.9	-63.6	0	0	0	0	114.6	L748 Q752	L748-C750 PolarHBondContact O-N 3.01Å; C750-Q752 PolarHBondContact O-N 2.86Å
751	L	92.9	Very high	92.9	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.223	C	C	.	.			trans	-68.5	131.8	-176.3	-160.2	75.3	0	0	0	111.1	L726 L729 L748 L754 M772 S774 L775	L726-L751 HydrophobicContact CD2-CD1 4.23Å; L726-L751 HydrophobicContact CG-CD1 4.07Å; L729-L751 HydrophobicContact CB-CD1 3.93Å; L729-L751 HydrophobicContact CB-CD2 4.29Å; L748-L751 HydrophobicContact CB-CB 4.36Å; L748-L751 WeakPolarHBondContact O-CB 3.48Å; L748-L751 PolarHBondContact O-N 3.4Å; L751-L754 HydrophobicContact CD2-CB 3.99Å; L751-L754 HydrophobicContact CD2-CD1 4.1Å; L751-L754 HydrophobicContact CD2-CD2 4.31Å; L751-L754 HydrophobicContact CD2-CG 4.35Å; L751-M772 HydrophobicContact CB-CE 3.66Å; L751-M772 HydrophobicContact CD2-CE 3.92Å; L751-M772 HydrophobicContact CG-CE 4.44Å; L751-S774 CarbonylContact O-C 3.59Å; L751-S774 VanDerWaalsContact O-C 3.25Å; L751-S774 WeakPolarHBondContact O-CB 3.49Å; L751-L775 HydrophobicContact CD2-CD2 4.39Å; L751-L775 HydrophobicContact CG-CD2 4.46Å; L751-L775 PolarHBondContact O-N 3.42Å
752	Q	94.6	Very high	92.9	Very high	84 Å²	84	44.2 Å²	44.2	39%	0.393	24%	0.235	S	C	.	.			trans	-114.4	-33.1	-174.7	-60.8	179.8	-0.6	0	0	113.1	K727 C750 S774 C776 S777	K727-Q752 WeakPolarHBondContact O-CA 3.25Å; K727-Q752 PolarHBondContact O-N 2.79Å; C750-Q752 PolarHBondContact O-N 2.86Å; Q752-S774 WeakPolarHBondContact CA-O 3.5Å; Q752-C776 PolarHBondContact O-N 3.32Å; Q752-S777 PolarHBondContact O-N 2.93Å
753	V	95.5	Very high	92.9	Very high	43 Å²	43	40 Å²	40	26%	0.261	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	122.4	-179.8	-175.7	0	0	0	0	108.8	K727 Q728 L729 S777	K727-V753 PolarHBondContact O-N 3.31Å; Q728-V753 WeakPolarHBondContact CA-O 3.3Å; Q728-V753 HydrophobicContact CB-CB 4.14Å; Q728-V753 HydrophobicContact CG-CB 3.88Å; Q728-V753 HydrophobicContact CG-CG2 3.94Å; L729-V753 PolarHBondContact N-O 3.41Å; V753-S777 WeakPolarHBondContact CA-O 3.37Å
754	L	96.1	Very high	92.8	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.005	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	124.3	176.9	179.5	58.6	0	0	0	109.9	L729 L731 L741 L751 L756 L769 L775 S777 L778 N779	L729-L754 HydrophobicContact CB-CD1 4.14Å; L729-L754 HydrophobicContact CD2-CD1 4.12Å; L729-L754 HydrophobicContact CG-CD1 4.18Å; L729-L754 WeakPolarHBondContact O-CA 3.4Å; L731-L754 HydrophobicContact CD1-CD1 4.26Å; L741-L754 HydrophobicContact CD1-CD2 4Å; L751-L754 HydrophobicContact CD2-CB 3.99Å; L751-L754 HydrophobicContact CD2-CD1 4.1Å; L751-L754 HydrophobicContact CD2-CD2 4.31Å; L751-L754 HydrophobicContact CD2-CG 4.35Å; L754-L756 HydrophobicContact CD1-CD2 3.93Å; L754-L756 HydrophobicContact CD1-CG 4.36Å; L754-L756 HydrophobicContact CD2-CD1 4.14Å; L754-L756 HydrophobicContact CD2-CD2 4.28Å; L754-L756 HydrophobicContact CD2-CG 4.22Å; L754-L756 HydrophobicContact CG-CD1 4.39Å; L754-L756 HydrophobicContact CG-CD2 4.07Å; L754-L756 HydrophobicContact CG-CG 3.96Å; L754-L769 HydrophobicContact CD2-CD1 4.22Å; L754-L769 HydrophobicContact CD2-CD2 3.88Å; L754-L775 HydrophobicContact CB-CD2 3.91Å; L754-S777 PolarHBondContact N-O 2.84Å; L754-L778 HydrophobicContact CB-CD1 3.99Å; L754-L778 HydrophobicContact CD2-CD1 4.02Å; L754-L778 HydrophobicContact CG-CD1 4.04Å; L754-L778 WeakPolarHBondContact O-CA 3.05Å; L754-N779 PolarHBondContact O-N 3.19Å
755	N	96	Very high	92.7	Very high	26 Å²	26	39.9 Å²	39.9	14%	0.139	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	113.9	174.6	-176.3	9.7	0	0	0	110.5	L729 N730 L731 C757 N779	L729-N755 PolarHBondContact O-N 3.36Å; N730-N755 HydrophobicContact CB-CB 4.43Å; N730-N755 WeakPolarHBondContact OD1-CB 3.46Å; N730-N755 PolarHBondContact OD1-ND2 3.19Å; L731-N755 WeakPolarHBondContact CA-O 3.3Å; L731-N755 WeakPolarHBondContact CB-O 3.5Å; L731-N755 PolarHBondContact N-O 2.85Å; N755-C757 WeakPolarHBondContact OD1-CB 3.27Å; N755-C757 PolarHBondContact OD1-N 3.48Å; N755-N779 HydrophobicContact CB-CB 4.36Å; N755-N779 WeakPolarHBondContact OD1-CB 3.27Å; N755-N779 PolarHBondContact OD1-ND2 3.09Å
756	L	95.7	Very high	92.8	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	23%	0.226	C	C	.	.			trans	-111.4	15.9	178.6	-58	175.4	0	0	0	112	L731 L741 L754 E758 T759 L766 L769 L778 N779 T783	L731-L756 HydrophobicContact CB-CD2 4.48Å; L731-L756 HydrophobicContact CD1-CD2 3.92Å; L741-L756 HydrophobicContact CD1-CD1 4.06Å; L741-L756 HydrophobicContact CD1-CD2 4.05Å; L741-L756 HydrophobicContact CD2-CD1 3.83Å; L754-L756 HydrophobicContact CD1-CD2 3.93Å; L754-L756 HydrophobicContact CD1-CG 4.36Å; L754-L756 HydrophobicContact CD2-CD1 4.14Å; L754-L756 HydrophobicContact CD2-CD2 4.28Å; L754-L756 HydrophobicContact CD2-CG 4.22Å; L754-L756 HydrophobicContact CG-CD1 4.39Å; L754-L756 HydrophobicContact CG-CD2 4.07Å; L754-L756 HydrophobicContact CG-CG 3.96Å; L756-E758 PolarHBondContact O-N 3.07Å; L756-T759 WeakPolarHBondContact O-CB 3.42Å; L756-T759 WeakPolarHBondContact O-CG2 3.32Å; L756-T759 PolarHBondContact O-N 3.33Å; L756-T759 PolarHBondContact O-OG1 2.84Å; L756-L766 HydrophobicContact CD1-CD2 3.77Å; L756-L769 HydrophobicContact CD1-CD1 4.26Å; L756-L778 HydrophobicContact CD1-CD1 4.21Å; L756-N779 WeakPolarHBondContact CA-O 3.38Å; L756-N779 WeakPolarHBondContact CB-O 3.44Å; L756-N779 PolarHBondContact N-O 3.14Å; L756-T783 HydrophobicContact CB-CG2 4.4Å; L756-T783 WeakPolarHBondContact O-CG2 3.23Å
757	C	95.3	Very high	92.8	Very high	9 Å²	9	36.3 Å²	36.3	6%	0.061	21%	0.213	C	C	.	.	T	Hydrogen-bonded Turn	trans	-52.2	134.4	-179.4	-173	0	0	0	0	111.4	W732 S733 N755 T759 N781	W732-C757 CarbonylContact C-O 3.25Å; W732-C757 VanDerWaalsContact CA-O 3.29Å; W732-C757 WeakPolarHBondContact CA-O 3.45Å; W732-C757 HydrophobicContact CB-CB 4.34Å; W732-C757 HydrophobicContact CG-CB 4Å; S733-C757 PolarHBondContact N-O 3.44Å; N755-C757 WeakPolarHBondContact OD1-CB 3.27Å; N755-C757 PolarHBondContact OD1-N 3.48Å; C757-T759 VanDerWaalsContact C-N 3.27Å; C757-T759 PolarHBondContact O-N 3.37Å; C757-N781 VanDerWaalsContact CA-O 3.27Å; C757-N781 WeakPolarHBondContact CA-O 3.45Å; C757-N781 HydrophobicContact CB-CB 4.4Å
758	E	94.1	Very high	92.9	Very high	91 Å²	91	32.2 Å²	32.2	43%	0.425	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.1	39.3	-178.5	-61.5	168.9	-124.3	0	0	114.2	W732 L756 N781	W732-E758 PolarHBondContact NE1-OE1 3.26Å; L756-E758 PolarHBondContact O-N 3.07Å; E758-N781 PolarHBondContact N-O 2.73Å
759	T	95.9	Very high	92.9	Very high	6 Å²	6	31.8 Å²	31.8	4%	0.037	20%	0.196	C	C	.	.			trans	-106.2	150.4	171.4	62.8	0	0	0	0	111.4	L731 L756 C757 V761	L731-T759 HydrophobicContact CB-CG2 4.45Å; L731-T759 VanDerWaalsContact O-CG2 3.24Å; L731-T759 WeakPolarHBondContact O-CG2 3.3Å; L756-T759 WeakPolarHBondContact O-CB 3.42Å; L756-T759 WeakPolarHBondContact O-CG2 3.32Å; L756-T759 PolarHBondContact O-N 3.33Å; L756-T759 PolarHBondContact O-OG1 2.84Å; C757-T759 VanDerWaalsContact C-N 3.27Å; C757-T759 PolarHBondContact O-N 3.37Å; T759-V761 PolarHBondContact O-N 3.32Å; T759-V761 WeakPolarHBondContact OG1-CG2 3Å
760	P	94.2	Very high	93.1	Very high	60 Å²	60	30.7 Å²	30.7	39%	0.39	18%	0.184	S	C	.	.			trans	-71.2	16.4	178.9	29.7	-37.7	0	0	0	115.1	T734 F736	T734-P760 WeakPolarHBondContact O-CD 3.49Å; F736-P760 WeakPolarHBondContact O-CD 3.36Å; F736-P760 WeakPolarHBondContact O-CG 3.45Å
761	V	95.4	Very high	93.1	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	18%	0.182	C	C	.	.			trans	-63.8	143	178.8	173.2	0	0	0	0	111.3	D738 L741 T759 L766 K784	D738-V761 VanDerWaalsContact OD1-CA 3.32Å; D738-V761 WeakPolarHBondContact OD1-CA 3.35Å; L741-V761 HydrophobicContact CD2-CG1 3.57Å; L741-V761 HydrophobicContact CD2-CG2 4.18Å; T759-V761 PolarHBondContact O-N 3.32Å; T759-V761 WeakPolarHBondContact OG1-CG2 3Å; V761-L766 HydrophobicContact CG1-CD1 4.47Å; V761-L766 HydrophobicContact CG1-CD2 3.51Å; V761-L766 HydrophobicContact CG1-CG 3.65Å; V761-K784 PolarHBondContact O-N 2.66Å; V761-K784 VanDerWaalsContact O-N 3.11Å
762	T	93.9	Very high	92.9	Very high	40 Å²	40	30.4 Å²	30.4	25%	0.245	18%	0.183	C	C	.	.	B	Isolated β-bridge	trans	-119	170.1	177.5	82.6	0	0	0	0	112	D738 A764 G765 L766 K784	D738-T762 PolarHBondContact OD1-N 2.88Å; D738-T762 PolarHBondContact OD2-OG1 3.33Å; T762-A764 PolarHBondContact O-N 3.43Å; T762-A764 PolarHBondContact OG1-N 3.29Å; T762-G765 WeakPolarHBondContact O-CA 3.47Å; T762-G765 PolarHBondContact O-N 3Å; T762-L766 WeakPolarHBondContact O-CG 3.33Å; T762-L766 PolarHBondContact O-N 3.46Å; T762-K784 HydrophobicContact CG2-CB 4.3Å; T762-K784 HydrophobicContact CG2-CD 4.06Å
763	D	92.6	Very high	92.6	Very high	34 Å²	34	33.3 Å²	33.3	18%	0.182	19%	0.194	C	C	.	.	H	α-helix	trans	-42	-40.7	169.6	-66.8	-26.2	0	0	0	114.5	G765 L766 L767 K784 L785 T786 T789	D763-G765 VanDerWaalsContact C-N 3.27Å; D763-G765 PolarHBondContact O-N 3.41Å; D763-L766 PolarHBondContact O-N 2.84Å; D763-L767 WeakPolarHBondContact O-CB 2.83Å; D763-L767 VanDerWaalsContact O-CG 3.28Å; D763-L767 WeakPolarHBondContact O-CG 3.37Å; D763-L767 PolarHBondContact O-N 2.88Å; D763-K784 PolarHBondContact N-O 3.14Å; D763-L785 WeakPolarHBondContact OD1-CA 3.34Å; D763-T786 PolarHBondContact OD1-N 3.46Å; D763-T786 PolarHBondContact OD1-OG1 3.36Å; D763-T786 WeakPolarHBondContact OD2-CB 3.43Å; D763-T786 WeakPolarHBondContact OD2-CG2 3.38Å; D763-T786 PolarHBondContact OD2-OG1 2.92Å; D763-T789 HydrophobicContact CB-CG2 3.94Å; D763-T789 WeakPolarHBondContact CB-OG1 3.23Å; D763-T789 VanDerWaalsContact OD1-CB 3.28Å; D763-T789 WeakPolarHBondContact OD1-CB 3.4Å; D763-T789 PolarHBondContact OD1-OG1 2.76Å; D763-T789 PolarHBondContact OD2-OG1 3.43Å
764	A	91.2	Very high	92.3	Very high	57 Å²	57	33.5 Å²	33.5	47%	0.471	20%	0.197	S	C	.	.	H	α-helix	trans	-67.2	-27.3	-179.5	0	0	0	0	0	113.2	T762	T762-A764 PolarHBondContact O-N 3.43Å; T762-A764 PolarHBondContact OG1-N 3.29Å
765	G	91.3	Very high	92.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-81.4	-43.4	169.2	0	0	0	0	0	112.1	D738 L741 T762 D763 A768	D738-G765 WeakPolarHBondContact OD1-CA 3.44Å; L741-G765 WeakPolarHBondContact CD2-O 3.47Å; T762-G765 WeakPolarHBondContact O-CA 3.47Å; T762-G765 PolarHBondContact O-N 3Å; D763-G765 VanDerWaalsContact C-N 3.27Å; D763-G765 PolarHBondContact O-N 3.41Å; G765-A768 VanDerWaalsContact O-CB 3.28Å; G765-A768 WeakPolarHBondContact O-CB 3.41Å; G765-A768 PolarHBondContact O-N 3.2Å; G765-A768 VanDerWaalsContact O-N 3.14Å
766	L	92.9	Very high	92	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-65.2	-41.9	-177.3	-62	174.3	0	0	0	111.6	L741 L756 V761 T762 D763 A768 L769 M780 L785 T789 L793	L741-L766 HydrophobicContact CD2-CD2 4.12Å; L756-L766 HydrophobicContact CD1-CD2 3.77Å; V761-L766 HydrophobicContact CG1-CD1 4.47Å; V761-L766 HydrophobicContact CG1-CD2 3.51Å; V761-L766 HydrophobicContact CG1-CG 3.65Å; T762-L766 WeakPolarHBondContact O-CG 3.33Å; T762-L766 PolarHBondContact O-N 3.46Å; D763-L766 PolarHBondContact O-N 2.84Å; L766-A768 PolarHBondContact O-N 2.84Å; L766-A768 VanDerWaalsContact O-N 3.12Å; L766-L769 HydrophobicContact CD2-CD1 4.09Å; L766-L769 WeakPolarHBondContact O-CB 3.25Å; L766-L769 WeakPolarHBondContact O-CG 3.24Å; L766-L769 PolarHBondContact O-N 2.94Å; L766-M780 HydrophobicContact CD1-SD 3.87Å; L766-M780 HydrophobicContact CD2-CG 4.01Å; L766-M780 HydrophobicContact CD2-SD 3.7Å; L766-M780 HydrophobicContact CG-SD 4.28Å; L766-L785 HydrophobicContact CD1-CB 3.79Å; L766-L785 HydrophobicContact CD1-CD1 3.71Å; L766-L785 HydrophobicContact CD1-CG 4.22Å; L766-T789 HydrophobicContact CB-CG2 4.48Å; L766-L793 HydrophobicContact CB-CD1 3.78Å; L766-L793 VanDerWaalsContact O-CD2 3.28Å; L766-L793 WeakPolarHBondContact O-CD2 3.38Å
767	L	90.8	Very high	91.9	Very high	60 Å²	60	35.8 Å²	35.8	31%	0.314	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-55.8	-28.4	174.1	-75	170.2	0	0	0	113.3	D763 L769 S770 T789 D792	D763-L767 WeakPolarHBondContact O-CB 2.83Å; D763-L767 VanDerWaalsContact O-CG 3.28Å; D763-L767 WeakPolarHBondContact O-CG 3.37Å; D763-L767 PolarHBondContact O-N 2.88Å; L767-L769 PolarHBondContact O-N 3.49Å; L767-S770 WeakPolarHBondContact O-CB 3.41Å; L767-S770 PolarHBondContact O-N 3.37Å; L767-S770 PolarHBondContact O-OG 2.95Å; L767-T789 HydrophobicContact CD2-CG2 3.98Å; L767-T789 HydrophobicContact CG-CG2 3.83Å; L767-D792 HydrophobicContact CD2-CB 4.43Å; L767-D792 WeakPolarHBondContact CD2-OD2 3.44Å
768	A	90.9	Very high	91.9	Very high	21 Å²	21	35.4 Å²	35.4	17%	0.174	21%	0.212	C	C	.	.	G	3₁₀ helix	trans	-66.5	-23.7	174.9	0	0	0	0	0	112.9	R742 S745 G765 L766 S770 S771	R742-A768 HydrophobicContact CB-CB 4.26Å; R742-A768 HydrophobicContact CG-CB 4.29Å; S745-A768 WeakPolarHBondContact CB-O 3.27Å; S745-A768 PolarHBondContact OG-O 3.43Å; G765-A768 VanDerWaalsContact O-CB 3.28Å; G765-A768 WeakPolarHBondContact O-CB 3.41Å; G765-A768 PolarHBondContact O-N 3.2Å; G765-A768 VanDerWaalsContact O-N 3.14Å; L766-A768 PolarHBondContact O-N 2.84Å; L766-A768 VanDerWaalsContact O-N 3.12Å; A768-S770 PolarHBondContact O-N 2.92Å; A768-S771 PolarHBondContact O-OG 3.24Å
769	L	90.4	Very high	91.9	Very high	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.2	C	C	.	.	G	3₁₀ helix	trans	-68.2	-14.5	175.8	-59.8	176.8	0	0	0	113.1	L741 L754 L756 L766 L767 S771 M772 L775 L778	L741-L769 HydrophobicContact CD1-CD2 3.78Å; L741-L769 HydrophobicContact CD2-CD1 4.25Å; L741-L769 HydrophobicContact CD2-CD2 4.34Å; L741-L769 HydrophobicContact CD2-CG 4.22Å; L741-L769 HydrophobicContact CG-CD2 3.89Å; L741-L769 HydrophobicContact CG-CG 4.27Å; L754-L769 HydrophobicContact CD2-CD1 4.22Å; L754-L769 HydrophobicContact CD2-CD2 3.88Å; L756-L769 HydrophobicContact CD1-CD1 4.26Å; L766-L769 HydrophobicContact CD2-CD1 4.09Å; L766-L769 WeakPolarHBondContact O-CB 3.25Å; L766-L769 WeakPolarHBondContact O-CG 3.24Å; L766-L769 PolarHBondContact O-N 2.94Å; L767-L769 PolarHBondContact O-N 3.49Å; L769-S771 PolarHBondContact O-N 2.98Å; L769-M772 HydrophobicContact CD2-SD 3.43Å; L769-M772 WeakPolarHBondContact CD2-SD 3.35Å; L769-M772 WeakPolarHBondContact O-CB 3.31Å; L769-M772 PolarHBondContact O-N 3.31Å; L769-L775 HydrophobicContact CB-CD1 4.37Å; L769-L775 HydrophobicContact CD2-CD1 4.47Å; L769-L778 HydrophobicContact CD1-CD1 3.96Å; L769-L778 HydrophobicContact CD1-CD2 3.84Å
770	S	87.9	Confident	91.8	Very high	40 Å²	40	32.4 Å²	32.4	28%	0.28	20%	0.199	S	C	.	.	G	3₁₀ helix	trans	-59.3	-17.6	179.8	61	0	0	0	0	114.8	L767 A768	L767-S770 WeakPolarHBondContact O-CB 3.41Å; L767-S770 PolarHBondContact O-N 3.37Å; L767-S770 PolarHBondContact O-OG 2.95Å; A768-S770 PolarHBondContact O-N 2.92Å
771	S	86.9	Confident	91.7	Very high	65 Å²	65	30.3 Å²	30.3	46%	0.455	18%	0.184	S	C	.	.	G	3₁₀ helix	trans	-75	-24.8	170.6	60.6	0	0	0	0	113.7	S745 A768 L769 K773	S745-S771 PolarHBondContact O-OG 2.77Å; A768-S771 PolarHBondContact O-OG 3.24Å; L769-S771 PolarHBondContact O-N 2.98Å; S771-K773 VanDerWaalsContact C-N 3.33Å; S771-K773 PolarHBondContact O-N 2.82Å
772	M	90.4	Very high	91.5	Very high	2 Å²	2	32.6 Å²	32.6	1%	0.01	20%	0.201	C	C	.	.			trans	-85.1	65.6	-167.5	-57.4	-173.3	80.1	0	0	112.6	S745 L748 L751 L769 S774 L775	S745-M772 VanDerWaalsContact CA-SD 3.56Å; L748-M772 HydrophobicContact CB-CE 4.25Å; L748-M772 WeakPolarHBondContact O-CE 3.25Å; L751-M772 HydrophobicContact CB-CE 3.66Å; L751-M772 HydrophobicContact CD2-CE 3.92Å; L751-M772 HydrophobicContact CG-CE 4.44Å; L769-M772 HydrophobicContact CD2-SD 3.43Å; L769-M772 WeakPolarHBondContact CD2-SD 3.35Å; L769-M772 WeakPolarHBondContact O-CB 3.31Å; L769-M772 PolarHBondContact O-N 3.31Å; M772-S774 PolarHBondContact O-N 3.43Å; M772-L775 HydrophobicContact CB-CD1 3.73Å; M772-L775 HydrophobicContact CB-CG 3.95Å; M772-L775 HydrophobicContact CG-CD1 4.49Å; M772-L775 WeakPolarHBondContact O-CB 3.35Å; M772-L775 PolarHBondContact O-N 3.36Å; M772-L775 HydrophobicContact SD-CD1 4.08Å
773	K	86.4	Confident	91.4	Very high	145 Å²	145	31.2 Å²	31.2	63%	0.63	19%	0.192	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.8	-12.7	-176.5	-63.4	178.5	-177.8	179.2	0	115.5	S771 N799	S771-K773 VanDerWaalsContact C-N 3.33Å; S771-K773 PolarHBondContact O-N 2.82Å; K773-N799 PolarHBondContact O-ND2 2.85Å
774	S	89.4	Confident	91.3	Very high	47 Å²	47	36.5 Å²	36.5	33%	0.329	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.4	-10.7	176.8	-56.4	0	0	0	0	114.2	A749 L751 Q752 M772 C776	A749-S774 WeakPolarHBondContact O-CB 3.17Å; A749-S774 PolarHBondContact O-OG 2.84Å; L751-S774 CarbonylContact O-C 3.59Å; L751-S774 VanDerWaalsContact O-C 3.25Å; L751-S774 WeakPolarHBondContact O-CB 3.49Å; Q752-S774 WeakPolarHBondContact CA-O 3.5Å; M772-S774 PolarHBondContact O-N 3.43Å; S774-C776 PolarHBondContact O-N 2.87Å
775	L	92.3	Very high	91.4	Very high	1 Å²	1	33.9 Å²	33.9	1%	0.005	19%	0.191	C	C	.	.			trans	-65.3	121.5	179.1	-77	173.7	0	0	0	111.1	L751 L754 L769 M772 L797 N799 L800	L751-L775 HydrophobicContact CD2-CD2 4.39Å; L751-L775 HydrophobicContact CG-CD2 4.46Å; L751-L775 PolarHBondContact O-N 3.42Å; L754-L775 HydrophobicContact CB-CD2 3.91Å; L769-L775 HydrophobicContact CB-CD1 4.37Å; L769-L775 HydrophobicContact CD2-CD1 4.47Å; M772-L775 HydrophobicContact CB-CD1 3.73Å; M772-L775 HydrophobicContact CB-CG 3.95Å; M772-L775 HydrophobicContact CG-CD1 4.49Å; M772-L775 WeakPolarHBondContact O-CB 3.35Å; M772-L775 PolarHBondContact O-N 3.36Å; M772-L775 HydrophobicContact SD-CD1 4.08Å; L775-L797 HydrophobicContact CD1-CD1 4.49Å; L775-N799 CarbonylContact O-C 3.28Å; L775-L800 HydrophobicContact CB-CD1 4.3Å
776	C	93.6	Very high	91.4	Very high	44 Å²	44	35.6 Å²	35.6	30%	0.297	20%	0.202	S	C	.	.			trans	-107.5	-29	176.5	-67.4	0	0	0	0	111.8	Q752 S774 K801 D802	Q752-C776 PolarHBondContact O-N 3.32Å; S774-C776 PolarHBondContact O-N 2.87Å; C776-K801 PolarHBondContact O-N 2.8Å; C776-D802 PolarHBondContact O-N 2.98Å
777	S	94	Very high	91.2	Very high	30 Å²	30	37.8 Å²	37.8	21%	0.21	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	132.2	177.2	179.8	0	0	0	0	111.4	Q752 V753 L754 D802	Q752-S777 PolarHBondContact O-N 2.93Å; V753-S777 WeakPolarHBondContact CA-O 3.37Å; L754-S777 PolarHBondContact N-O 2.84Å; S777-D802 CarbonylContact C-O 3.58Å; S777-D802 VanDerWaalsContact CA-O 3.25Å; S777-D802 WeakPolarHBondContact CA-O 3.32Å; S777-D802 PolarHBondContact OG-O 2.94Å
778	L	94.8	Very high	91.2	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	113.4	-178.3	-179.6	58.3	0	0	0	110	L754 L756 L769 M780 L800 D802 V803 D804	L754-L778 HydrophobicContact CB-CD1 3.99Å; L754-L778 HydrophobicContact CD2-CD1 4.02Å; L754-L778 HydrophobicContact CG-CD1 4.04Å; L754-L778 WeakPolarHBondContact O-CA 3.05Å; L756-L778 HydrophobicContact CD1-CD1 4.21Å; L769-L778 HydrophobicContact CD1-CD1 3.96Å; L769-L778 HydrophobicContact CD1-CD2 3.84Å; L778-M780 HydrophobicContact CD1-CG 4.18Å; L778-M780 HydrophobicContact CD2-CE 3.82Å; L778-M780 HydrophobicContact CD2-CG 4.22Å; L778-M780 HydrophobicContact CD2-SD 3.63Å; L778-M780 HydrophobicContact CG-CE 4.05Å; L778-M780 HydrophobicContact CG-CG 3.85Å; L778-M780 HydrophobicContact CG-SD 3.93Å; L778-L800 HydrophobicContact CB-CD1 3.73Å; L778-L800 HydrophobicContact CB-CD2 4.47Å; L778-D802 PolarHBondContact N-O 2.89Å; L778-V803 WeakPolarHBondContact O-CA 3.34Å; L778-V803 WeakPolarHBondContact O-CG1 3.46Å; L778-D804 PolarHBondContact O-N 3.41Å
779	N	94.3	Very high	91.2	Very high	34 Å²	34	41.1 Å²	41.1	18%	0.182	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	118.1	173.5	-178.6	-8.1	0	0	0	109.4	L754 N755 L756 N781 D804	L754-N779 PolarHBondContact O-N 3.19Å; N755-N779 HydrophobicContact CB-CB 4.36Å; N755-N779 WeakPolarHBondContact OD1-CB 3.27Å; N755-N779 PolarHBondContact OD1-ND2 3.09Å; L756-N779 WeakPolarHBondContact CA-O 3.38Å; L756-N779 WeakPolarHBondContact CB-O 3.44Å; L756-N779 PolarHBondContact N-O 3.14Å; N779-N781 WeakPolarHBondContact OD1-CB 3.33Å; N779-N781 PolarHBondContact OD1-N 2.75Å; N779-D804 HydrophobicContact CB-CB 4.32Å
780	M	93.5	Very high	91.2	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.005	25%	0.246	C	C	.	.			trans	-119.2	17.8	179.6	-65.5	175.1	-67.3	0	0	111.5	L766 L778 S782 T783 L785 L793 V803 D804 V805 T808	L766-M780 HydrophobicContact CD1-SD 3.87Å; L766-M780 HydrophobicContact CD2-CG 4.01Å; L766-M780 HydrophobicContact CD2-SD 3.7Å; L766-M780 HydrophobicContact CG-SD 4.28Å; L778-M780 HydrophobicContact CD1-CG 4.18Å; L778-M780 HydrophobicContact CD2-CE 3.82Å; L778-M780 HydrophobicContact CD2-CG 4.22Å; L778-M780 HydrophobicContact CD2-SD 3.63Å; L778-M780 HydrophobicContact CG-CE 4.05Å; L778-M780 HydrophobicContact CG-CG 3.85Å; L778-M780 HydrophobicContact CG-SD 3.93Å; M780-S782 PolarHBondContact O-N 2.83Å; M780-T783 WeakPolarHBondContact O-CB 3.34Å; M780-T783 WeakPolarHBondContact O-CG2 3.22Å; M780-T783 PolarHBondContact O-N 3.28Å; M780-T783 PolarHBondContact O-OG1 2.83Å; M780-L785 HydrophobicContact CB-CD2 4.26Å; M780-L785 HydrophobicContact CE-CD2 3.9Å; M780-L785 HydrophobicContact SD-CD2 4.1Å; M780-L793 HydrophobicContact SD-CD1 4.5Å; M780-V803 HydrophobicContact CE-CG1 3.61Å; M780-D804 CarbonylContact C-O 3.5Å; M780-D804 WeakPolarHBondContact CA-O 3.34Å; M780-D804 PolarHBondContact N-O 2.99Å; M780-V805 HydrophobicContact CE-CG1 3.98Å; M780-T808 VanDerWaalsContact O-CG2 3.26Å; M780-T808 WeakPolarHBondContact O-CG2 3.3Å
781	N	92.4	Very high	91.3	Very high	15 Å²	15	46.6 Å²	46.6	8%	0.08	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	133.9	-178.9	-178.2	-37.8	0	0	0	111.5	C757 E758 N779 T783 D804 R806 Y807	C757-N781 VanDerWaalsContact CA-O 3.27Å; C757-N781 WeakPolarHBondContact CA-O 3.45Å; C757-N781 HydrophobicContact CB-CB 4.4Å; E758-N781 PolarHBondContact N-O 2.73Å; N779-N781 WeakPolarHBondContact OD1-CB 3.33Å; N779-N781 PolarHBondContact OD1-N 2.75Å; N781-T783 PolarHBondContact O-N 3.13Å; N781-D804 PolarHBondContact N-O 3.04Å; N781-D804 PolarHBondContact ND2-OD2 3.46Å; N781-R806 VanDerWaalsContact CA-O 3.28Å; N781-R806 WeakPolarHBondContact CA-O 3.48Å; N781-R806 PolarHBondContact OD1-O 3.04Å; N781-Y807 WeakPolarHBondContact OD1-CD2 3.05Å
782	S	90.9	Very high	91.5	Very high	49 Å²	49	46.6 Å²	46.6	34%	0.343	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.3	32	-179	-52.1	0	0	0	0	114.5	M780 R806	M780-S782 PolarHBondContact O-N 2.83Å; S782-R806 PolarHBondContact N-O 2.7Å; S782-R806 VanDerWaalsContact N-O 3.07Å
783	T	92.9	Very high	91.4	Very high	11 Å²	11	46.7 Å²	46.7	7%	0.067	25%	0.25	C	S	.	.	S	Bend	trans	-101.7	173.3	169.2	66.2	0	0	0	0	111.4	L756 M780 N781 L785 T808	L756-T783 HydrophobicContact CB-CG2 4.4Å; L756-T783 WeakPolarHBondContact O-CG2 3.23Å; M780-T783 WeakPolarHBondContact O-CB 3.34Å; M780-T783 WeakPolarHBondContact O-CG2 3.22Å; M780-T783 PolarHBondContact O-N 3.28Å; M780-T783 PolarHBondContact O-OG1 2.83Å; N781-T783 PolarHBondContact O-N 3.13Å; T783-L785 VanDerWaalsContact C-N 3.27Å; T783-L785 PolarHBondContact O-N 3.37Å; T783-L785 VanDerWaalsContact O-N 3.15Å; T783-T808 WeakPolarHBondContact O-CG2 3.25Å
784	K	90.5	Very high	91.4	Very high	145 Å²	145	44.7 Å²	44.7	63%	0.63	24%	0.242	S	C	*	.	B	Isolated β-bridge	trans	-89.3	61.3	177.4	-63.5	173.4	178.2	174.9	0	111.2	V761 T762 D763	V761-K784 PolarHBondContact O-N 2.66Å; V761-K784 VanDerWaalsContact O-N 3.11Å; T762-K784 HydrophobicContact CG2-CB 4.3Å; T762-K784 HydrophobicContact CG2-CD 4.06Å; D763-K784 PolarHBondContact N-O 3.14Å
785	L	93.1	Very high	91.3	Very high	2 Å²	2	46.4 Å²	46.4	1%	0.01	26%	0.259	C	S	.	.			trans	-96	128.5	178.1	171.6	64.3	0	0	0	111.2	D763 L766 M780 T783 T789 Y790 V805 T808 E809 A810	D763-L785 WeakPolarHBondContact OD1-CA 3.34Å; L766-L785 HydrophobicContact CD1-CB 3.79Å; L766-L785 HydrophobicContact CD1-CD1 3.71Å; L766-L785 HydrophobicContact CD1-CG 4.22Å; M780-L785 HydrophobicContact CB-CD2 4.26Å; M780-L785 HydrophobicContact CE-CD2 3.9Å; M780-L785 HydrophobicContact SD-CD2 4.1Å; T783-L785 VanDerWaalsContact C-N 3.27Å; T783-L785 PolarHBondContact O-N 3.37Å; T783-L785 VanDerWaalsContact O-N 3.15Å; L785-T789 HydrophobicContact CD1-CG2 3.9Å; L785-Y790 HydrophobicContact CD2-CD2 4.37Å; L785-V805 HydrophobicContact CD2-CB 4.21Å; L785-V805 HydrophobicContact CD2-CG1 3.66Å; L785-T808 HydrophobicContact CB-CG2 4.11Å; L785-E809 WeakPolarHBondContact O-CB 3.41Å; L785-E809 PolarHBondContact O-N 3.41Å; L785-A810 HydrophobicContact CD2-CB 4.17Å; L785-A810 HydrophobicContact CG-CB 4.19Å
786	T	91.4	Very high	91.1	Very high	35 Å²	35	50.4 Å²	50.4	22%	0.215	28%	0.276	C	S	.	.			trans	-91.7	158	170.3	56.2	0	0	0	0	113	D763 D788 T789 Y790	D763-T786 PolarHBondContact OD1-N 3.46Å; D763-T786 PolarHBondContact OD1-OG1 3.36Å; D763-T786 WeakPolarHBondContact OD2-CB 3.43Å; D763-T786 WeakPolarHBondContact OD2-CG2 3.38Å; D763-T786 PolarHBondContact OD2-OG1 2.92Å; T786-D788 PolarHBondContact O-N 2.9Å; T786-T789 PolarHBondContact O-N 3.06Å; T786-T789 WeakPolarHBondContact OG1-CB 3.5Å; T786-T789 PolarHBondContact OG1-OG1 3.16Å; T786-Y790 PolarHBondContact O-N 3.35Å
787	A	89	Confident	90.9	Very high	46 Å²	46	48.5 Å²	48.5	38%	0.38	26%	0.263	S	S	.	.	H	α-helix	trans	-61.4	-41.2	177.6	0	0	0	0	0	113.1	T789 Y790 E791	A787-T789 PolarHBondContact O-N 3.38Å; A787-Y790 PolarHBondContact O-N 3.19Å; A787-E791 PolarHBondContact O-N 3.41Å
788	D	90.1	Very high	90.3	Very high	139 Å²	139	52 Å²	52	74%	0.743	29%	0.285	S	S	*	.	H	α-helix	trans	-59.5	-47.9	177.2	-70.8	-21.2	0	0	0	110.9	T786 Y790 E791 D792	T786-D788 PolarHBondContact O-N 2.9Å; D788-Y790 VanDerWaalsContact C-N 3.3Å; D788-Y790 PolarHBondContact O-N 3.19Å; D788-E791 PolarHBondContact O-N 3.29Å; D788-D792 WeakPolarHBondContact O-CB 3.29Å; D788-D792 PolarHBondContact O-N 3.43Å; D788-D792 VanDerWaalsContact O-N 3.09Å
789	T	91.1	Very high	89.9	Confident	13 Å²	13	56.1 Å²	56.1	8%	0.08	31%	0.307	C	S	.	.	H	α-helix	trans	-65.3	-33.5	179.3	-61.1	0	0	0	0	112.3	D763 L766 L767 L785 T786 A787 D792 L793	D763-T789 HydrophobicContact CB-CG2 3.94Å; D763-T789 WeakPolarHBondContact CB-OG1 3.23Å; D763-T789 VanDerWaalsContact OD1-CB 3.28Å; D763-T789 WeakPolarHBondContact OD1-CB 3.4Å; D763-T789 PolarHBondContact OD1-OG1 2.76Å; D763-T789 PolarHBondContact OD2-OG1 3.43Å; L766-T789 HydrophobicContact CB-CG2 4.48Å; L767-T789 HydrophobicContact CD2-CG2 3.98Å; L767-T789 HydrophobicContact CG-CG2 3.83Å; L785-T789 HydrophobicContact CD1-CG2 3.9Å; T786-T789 PolarHBondContact O-N 3.06Å; T786-T789 WeakPolarHBondContact OG1-CB 3.5Å; T786-T789 PolarHBondContact OG1-OG1 3.16Å; A787-T789 PolarHBondContact O-N 3.38Å; T789-D792 PolarHBondContact O-N 2.87Å; T789-L793 HydrophobicContact CG2-CD1 3.89Å; T789-L793 HydrophobicContact CG2-CG 4.42Å; T789-L793 WeakPolarHBondContact O-CB 3.49Å; T789-L793 WeakPolarHBondContact O-CD1 3.32Å; T789-L793 VanDerWaalsContact O-CG 3.29Å; T789-L793 WeakPolarHBondContact O-CG 3.45Å; T789-L793 PolarHBondContact O-N 3.06Å
790	Y	90.9	Very high	89.6	Confident	54 Å²	54	56.1 Å²	56.1	21%	0.212	31%	0.307	C	S	.	.	H	α-helix	trans	-64.8	-48.9	176.7	172.4	-109.4	0	0	0	112.7	L785 T786 A787 D788 D792 L793 K794 V803 V805 A810	L785-Y790 HydrophobicContact CD2-CD2 4.37Å; T786-Y790 PolarHBondContact O-N 3.35Å; A787-Y790 PolarHBondContact O-N 3.19Å; D788-Y790 VanDerWaalsContact C-N 3.3Å; D788-Y790 PolarHBondContact O-N 3.19Å; Y790-D792 VanDerWaalsContact C-N 3.28Å; Y790-D792 PolarHBondContact O-N 2.81Å; Y790-L793 PolarHBondContact O-N 3.22Å; Y790-K794 HydrophobicContact CE1-CD 4.07Å; Y790-K794 VanDerWaalsContact O-CB 3.3Å; Y790-K794 WeakPolarHBondContact O-CB 3.17Å; Y790-K794 PolarHBondContact O-N 3.29Å; Y790-V803 HydrophobicContact CE2-CG1 4.09Å; Y790-V805 HydrophobicContact CD2-CG1 3.71Å; Y790-V805 HydrophobicContact CE2-CG1 3.69Å; Y790-A810 HydrophobicContact CD1-CB 4.36Å; Y790-A810 HydrophobicContact CG-CB 4.06Å
791	E	89.6	Confident	89.4	Confident	100 Å²	100	64.1 Å²	64.1	47%	0.467	34%	0.341	S	S	.	.	H	α-helix	trans	-64.1	-36.9	176.4	-72.2	-61.1	149.3	0	0	111.4	A787 D788 L793 K794 A795	A787-E791 PolarHBondContact O-N 3.41Å; D788-E791 PolarHBondContact O-N 3.29Å; E791-L793 PolarHBondContact O-N 3.44Å; E791-K794 PolarHBondContact O-N 2.72Å; E791-K794 IonicContact OE1-NZ 2.77Å; E791-K794 PolarHBondContact OE1-NZ 2.88Å; E791-K794 IonicContact OE2-NZ 3.92Å; E791-K794 PolarHBondContact OE2-NZ 3.39Å; E791-A795 WeakPolarHBondContact O-CB 3.35Å; E791-A795 PolarHBondContact O-N 3.11Å
792	D	89.9	Confident	89.2	Confident	66 Å²	66	68.6 Å²	68.6	35%	0.353	37%	0.365	S	S	.	.	H	α-helix	trans	-64.5	-36.9	177.3	-150.6	37.2	0	0	0	112.2	L767 D788 T789 Y790 K796	L767-D792 HydrophobicContact CD2-CB 4.43Å; L767-D792 WeakPolarHBondContact CD2-OD2 3.44Å; D788-D792 WeakPolarHBondContact O-CB 3.29Å; D788-D792 PolarHBondContact O-N 3.43Å; D788-D792 VanDerWaalsContact O-N 3.09Å; T789-D792 PolarHBondContact O-N 2.87Å; Y790-D792 VanDerWaalsContact C-N 3.28Å; Y790-D792 PolarHBondContact O-N 2.81Å; D792-K796 WeakPolarHBondContact O-CB 3.44Å; D792-K796 VanDerWaalsContact O-CD 3.24Å; D792-K796 WeakPolarHBondContact O-CD 3.44Å; D792-K796 WeakPolarHBondContact O-CG 3.4Å; D792-K796 PolarHBondContact O-N 3.21Å; D792-K796 WeakPolarHBondContact OD1-CE 3.49Å; D792-K796 IonicContact OD1-NZ 2.88Å; D792-K796 PolarHBondContact OD1-NZ 2.95Å; D792-K796 VanDerWaalsContact OD1-NZ 3.12Å; D792-K796 IonicContact OD2-NZ 3.85Å; D792-K796 PolarHBondContact OD2-NZ 3.17Å
793	L	88.7	Confident	89.1	Confident	3 Å²	3	68.7 Å²	68.7	2%	0.016	36%	0.364	C	S	.	.	H	α-helix	trans	-72	-43.6	173.5	-76.5	165	0	0	0	112.9	L766 M780 T789 Y790 E791 A795 K796 L797	L766-L793 HydrophobicContact CB-CD1 3.78Å; L766-L793 VanDerWaalsContact O-CD2 3.28Å; L766-L793 WeakPolarHBondContact O-CD2 3.38Å; M780-L793 HydrophobicContact SD-CD1 4.5Å; T789-L793 HydrophobicContact CG2-CD1 3.89Å; T789-L793 HydrophobicContact CG2-CG 4.42Å; T789-L793 WeakPolarHBondContact O-CB 3.49Å; T789-L793 WeakPolarHBondContact O-CD1 3.32Å; T789-L793 VanDerWaalsContact O-CG 3.29Å; T789-L793 WeakPolarHBondContact O-CG 3.45Å; T789-L793 PolarHBondContact O-N 3.06Å; Y790-L793 PolarHBondContact O-N 3.22Å; E791-L793 PolarHBondContact O-N 3.44Å; L793-A795 VanDerWaalsContact C-N 3.27Å; L793-A795 PolarHBondContact O-N 3.47Å; L793-K796 PolarHBondContact O-N 3.13Å; L793-L797 HydrophobicContact CD2-CD1 4.4Å; L793-L797 WeakPolarHBondContact O-CB 3.23Å; L793-L797 PolarHBondContact O-N 2.88Å
794	K	86.2	Confident	89	Confident	104 Å²	104	69.5 Å²	69.5	45%	0.452	37%	0.368	S	S	.	.	H	α-helix	trans	-61.1	-35.7	177.1	179.4	174.9	159	-140.5	0	112	Y790 E791	Y790-K794 HydrophobicContact CE1-CD 4.07Å; Y790-K794 VanDerWaalsContact O-CB 3.3Å; Y790-K794 WeakPolarHBondContact O-CB 3.17Å; Y790-K794 PolarHBondContact O-N 3.29Å; E791-K794 PolarHBondContact O-N 2.72Å; E791-K794 IonicContact OE1-NZ 2.77Å; E791-K794 PolarHBondContact OE1-NZ 2.88Å; E791-K794 IonicContact OE2-NZ 3.92Å; E791-K794 PolarHBondContact OE2-NZ 3.39Å
795	A	87.8	Confident	89	Confident	83 Å²	83	63.4 Å²	63.4	69%	0.686	34%	0.342	S	S	*	.	H	α-helix	trans	-69.5	-33.5	171.9	0	0	0	0	0	113.4	E791 L793	E791-A795 WeakPolarHBondContact O-CB 3.35Å; E791-A795 PolarHBondContact O-N 3.11Å; L793-A795 VanDerWaalsContact C-N 3.27Å; L793-A795 PolarHBondContact O-N 3.47Å
796	K	88.9	Confident	88.8	Confident	85 Å²	85	69.3 Å²	69.3	37%	0.37	37%	0.365	S	S	.	.	H	α-helix	trans	-89.7	-20.3	-175.2	-68.4	166.6	-165.7	171.9	0	114.1	D792 L793 P798	D792-K796 WeakPolarHBondContact O-CB 3.44Å; D792-K796 VanDerWaalsContact O-CD 3.24Å; D792-K796 WeakPolarHBondContact O-CD 3.44Å; D792-K796 WeakPolarHBondContact O-CG 3.4Å; D792-K796 PolarHBondContact O-N 3.21Å; D792-K796 WeakPolarHBondContact OD1-CE 3.49Å; D792-K796 IonicContact OD1-NZ 2.88Å; D792-K796 PolarHBondContact OD1-NZ 2.95Å; D792-K796 VanDerWaalsContact OD1-NZ 3.12Å; D792-K796 IonicContact OD2-NZ 3.85Å; D792-K796 PolarHBondContact OD2-NZ 3.17Å; L793-K796 PolarHBondContact O-N 3.13Å; K796-P798 WeakPolarHBondContact O-CD 3.22Å
797	L	89.1	Confident	88.6	Confident	4 Å²	4	75.5 Å²	75.5	2%	0.021	39%	0.385	C	S	.	.			trans	-113	76.3	-177.7	-66	177.5	0	0	0	112.4	L775 L793 N799 L800	L775-L797 HydrophobicContact CD1-CD1 4.49Å; L793-L797 HydrophobicContact CD2-CD1 4.4Å; L793-L797 WeakPolarHBondContact O-CB 3.23Å; L793-L797 PolarHBondContact O-N 2.88Å; L797-N799 PolarHBondContact O-N 3.02Å; L797-N799 VanDerWaalsContact O-N 3.11Å; L797-L800 HydrophobicContact CB-CB 4.06Å; L797-L800 HydrophobicContact CB-CD2 4.32Å; L797-L800 HydrophobicContact CD1-CD2 4.25Å; L797-L800 VanDerWaalsContact O-CB 3.28Å; L797-L800 WeakPolarHBondContact O-CB 3Å; L797-L800 PolarHBondContact O-N 2.87Å
798	P	80.9	Confident	88.6	Confident	103 Å²	103	74.1 Å²	74.1	67%	0.669	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69	-12.3	-172	29.2	-38	0	0	0	115.2	K796	K796-P798 WeakPolarHBondContact O-CD 3.22Å
799	N	87.6	Confident	88.4	Confident	87 Å²	87	74.5 Å²	74.5	47%	0.465	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-2.8	179.4	-69.3	-39.8	0	0	0	113.4	K773 L775 L797 K801	K773-N799 PolarHBondContact O-ND2 2.85Å; L775-N799 CarbonylContact O-C 3.28Å; L797-N799 PolarHBondContact O-N 3.02Å; L797-N799 VanDerWaalsContact O-N 3.11Å; N799-K801 PolarHBondContact O-N 3.03Å
800	L	87.6	Confident	87.9	Confident	34 Å²	34	74.9 Å²	74.9	18%	0.178	37%	0.374	C	S	.	.			trans	-77.3	116.2	-173	-167.3	67.9	0	0	0	110.4	L775 L778 L797 V803	L775-L800 HydrophobicContact CB-CD1 4.3Å; L778-L800 HydrophobicContact CB-CD1 3.73Å; L778-L800 HydrophobicContact CB-CD2 4.47Å; L797-L800 HydrophobicContact CB-CB 4.06Å; L797-L800 HydrophobicContact CB-CD2 4.32Å; L797-L800 HydrophobicContact CD1-CD2 4.25Å; L797-L800 VanDerWaalsContact O-CB 3.28Å; L797-L800 WeakPolarHBondContact O-CB 3Å; L797-L800 PolarHBondContact O-N 2.87Å; L800-V803 HydrophobicContact CD1-CG2 4.31Å; L800-V803 HydrophobicContact CD2-CG2 3.42Å; L800-V803 VanDerWaalsContact CD2-CG2 3.42Å; L800-V803 HydrophobicContact CG-CG2 3.5Å; L800-V803 VanDerWaalsContact CG-CG2 3.5Å
801	K	88.6	Confident	87.2	Confident	168 Å²	168	82.6 Å²	82.6	73%	0.73	40%	0.403	S	S	*	.			trans	-106	-47.3	-174.7	-64.9	176.9	-176.3	177.4	0	112.5	C776 N799	C776-K801 PolarHBondContact O-N 2.8Å; N799-K801 PolarHBondContact O-N 3.03Å
802	D	87.9	Confident	87.1	Confident	109 Å²	109	81.7 Å²	81.7	58%	0.583	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.9	102.1	-172.9	-60.5	-59.4	0	0	0	109.6	C776 S777 L778	C776-D802 PolarHBondContact O-N 2.98Å; S777-D802 CarbonylContact C-O 3.58Å; S777-D802 VanDerWaalsContact CA-O 3.25Å; S777-D802 WeakPolarHBondContact CA-O 3.32Å; S777-D802 PolarHBondContact OG-O 2.94Å; L778-D802 PolarHBondContact N-O 2.89Å
803	V	89.9	Confident	86.9	Confident	52 Å²	52	82.5 Å²	82.5	32%	0.315	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	129.5	178.5	-159.5	0	0	0	0	110.6	L778 M780 Y790 L800 V805	L778-V803 WeakPolarHBondContact O-CA 3.34Å; L778-V803 WeakPolarHBondContact O-CG1 3.46Å; M780-V803 HydrophobicContact CE-CG1 3.61Å; Y790-V803 HydrophobicContact CE2-CG1 4.09Å; L800-V803 HydrophobicContact CD1-CG2 4.31Å; L800-V803 HydrophobicContact CD2-CG2 3.42Å; L800-V803 VanDerWaalsContact CD2-CG2 3.42Å; L800-V803 HydrophobicContact CG-CG2 3.5Å; L800-V803 VanDerWaalsContact CG-CG2 3.5Å; V803-V805 HydrophobicContact CG1-CG1 3.99Å
804	D	90.6	Very high	86.8	Confident	28 Å²	28	86.9 Å²	86.9	15%	0.15	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	115	171.9	-173.8	8.3	0	0	0	109.6	L778 N779 M780 N781 R806	L778-D804 PolarHBondContact O-N 3.41Å; N779-D804 HydrophobicContact CB-CB 4.32Å; M780-D804 CarbonylContact C-O 3.5Å; M780-D804 WeakPolarHBondContact CA-O 3.34Å; M780-D804 PolarHBondContact N-O 2.99Å; N781-D804 PolarHBondContact N-O 3.04Å; N781-D804 PolarHBondContact ND2-OD2 3.46Å; D804-R806 WeakPolarHBondContact OD1-CB 3.43Å; D804-R806 VanDerWaalsContact OD1-CG 3.26Å; D804-R806 WeakPolarHBondContact OD1-CG 3.41Å; D804-R806 IonicContact OD1-CZ 3.37Å; D804-R806 PolarHBondContact OD1-N 3.28Å; D804-R806 VanDerWaalsContact OD1-N 3.11Å; D804-R806 IonicContact OD1-NE 3.25Å; D804-R806 PolarHBondContact OD1-NE 2.77Å; D804-R806 IonicContact OD1-NH2 2.69Å; D804-R806 IonicContact OD2-CZ 2.81Å; D804-R806 IonicContact OD2-NE 3.77Å; D804-R806 PolarHBondContact OD2-NE 3.14Å; D804-R806 IonicContact OD2-NH2 3.71Å; D804-R806 PolarHBondContact OD2-NH2 3.21Å
805	V	90.6	Very high	86.8	Confident	16 Å²	16	85.9 Å²	85.9	10%	0.097	42%	0.422	C	S	.	.			trans	-116.7	11.3	178.6	-61.9	0	0	0	0	112.5	M780 L785 Y790 V803 T808 W811	M780-V805 HydrophobicContact CE-CG1 3.98Å; L785-V805 HydrophobicContact CD2-CB 4.21Å; L785-V805 HydrophobicContact CD2-CG1 3.66Å; Y790-V805 HydrophobicContact CD2-CG1 3.71Å; Y790-V805 HydrophobicContact CE2-CG1 3.69Å; V803-V805 HydrophobicContact CG1-CG1 3.99Å; V805-T808 WeakPolarHBondContact O-CB 3.26Å; V805-T808 WeakPolarHBondContact O-CG2 3.26Å; V805-T808 PolarHBondContact O-N 3.06Å; V805-T808 PolarHBondContact O-OG1 3.14Å; V805-W811 HydrophobicContact CG2-CB 4.45Å
806	R	88.6	Confident	86.8	Confident	126 Å²	126	86.1 Å²	86.1	48%	0.475	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	143.7	-177.1	-69.4	174.7	-67.1	169.7	0.6	111.3	N781 S782 D804 T808	N781-R806 VanDerWaalsContact CA-O 3.28Å; N781-R806 WeakPolarHBondContact CA-O 3.48Å; N781-R806 PolarHBondContact OD1-O 3.04Å; S782-R806 PolarHBondContact N-O 2.7Å; S782-R806 VanDerWaalsContact N-O 3.07Å; D804-R806 WeakPolarHBondContact OD1-CB 3.43Å; D804-R806 VanDerWaalsContact OD1-CG 3.26Å; D804-R806 WeakPolarHBondContact OD1-CG 3.41Å; D804-R806 IonicContact OD1-CZ 3.37Å; D804-R806 PolarHBondContact OD1-N 3.28Å; D804-R806 VanDerWaalsContact OD1-N 3.11Å; D804-R806 IonicContact OD1-NE 3.25Å; D804-R806 PolarHBondContact OD1-NE 2.77Å; D804-R806 IonicContact OD1-NH2 2.69Å; D804-R806 IonicContact OD2-CZ 2.81Å; D804-R806 IonicContact OD2-NE 3.77Å; D804-R806 PolarHBondContact OD2-NE 3.14Å; D804-R806 IonicContact OD2-NH2 3.71Å; D804-R806 PolarHBondContact OD2-NH2 3.21Å; R806-T808 VanDerWaalsContact C-N 3.26Å; R806-T808 PolarHBondContact O-N 3.44Å
807	Y	87.6	Confident	86.6	Confident	165 Å²	165	86.2 Å²	86.2	65%	0.647	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	33.4	-176.5	-46.2	-76.7	0	0	0	114	N781	N781-Y807 WeakPolarHBondContact OD1-CD2 3.05Å
808	T	88.9	Confident	86.5	Confident	18 Å²	18	92.1 Å²	92.1	11%	0.11	44%	0.435	C	S	.	.	S	Bend	trans	-118.7	177.4	165.6	72.9	0	0	0	0	109.5	M780 T783 L785 V805 R806 A810	M780-T808 VanDerWaalsContact O-CG2 3.26Å; M780-T808 WeakPolarHBondContact O-CG2 3.3Å; T783-T808 WeakPolarHBondContact O-CG2 3.25Å; L785-T808 HydrophobicContact CB-CG2 4.11Å; V805-T808 WeakPolarHBondContact O-CB 3.26Å; V805-T808 WeakPolarHBondContact O-CG2 3.26Å; V805-T808 PolarHBondContact O-N 3.06Å; V805-T808 PolarHBondContact O-OG1 3.14Å; R806-T808 VanDerWaalsContact C-N 3.26Å; R806-T808 PolarHBondContact O-N 3.44Å; T808-A810 PolarHBondContact O-N 3.25Å; T808-A810 PolarHBondContact OG1-N 3.32Å
809	E	85.7	Confident	86.9	Confident	147 Å²	147	91.2 Å²	91.2	69%	0.687	42%	0.417	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	-14.1	175.9	-171.2	178.4	158.1	0	0	112.5	L785 W811	L785-E809 WeakPolarHBondContact O-CB 3.41Å; L785-E809 PolarHBondContact O-N 3.41Å; E809-W811 VanDerWaalsContact C-N 3.35Å
810	A	81.1	Confident	86.8	Confident	21 Å²	21	91.6 Å²	91.6	17%	0.174	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.5	9.6	177.8	0	0	0	0	0	114.5	L785 Y790 T808	L785-A810 HydrophobicContact CD2-CB 4.17Å; L785-A810 HydrophobicContact CG-CB 4.19Å; Y790-A810 HydrophobicContact CD1-CB 4.36Å; Y790-A810 HydrophobicContact CG-CB 4.06Å; T808-A810 PolarHBondContact O-N 3.25Å; T808-A810 PolarHBondContact OG1-N 3.32Å
811	W	74.9	Confident	86.8	Confident	215 Å²	215	96.8 Å²	96.8	81%	0.814	44%	0.435	S	S	*	.			trans	-109.9	0	-179.8	-179.8	66.9	0	0	0	112.9	V805 E809	V805-W811 HydrophobicContact CG2-CB 4.45Å; E809-W811 VanDerWaalsContact C-N 3.35Å

Retrieved 811 of 811 residues in 1679.3 ms (Link to these results)

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