A0A3Q0KQD7_SCHMA Loading...

Frizzled, putative

AlphaFold DB , UniProt , Accession A0A3Q0KQD7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,173 aa.

						>A0A3Q0KQD7_SCHMA|A0A3Q0KQD7
MTSSKYTMKRKQYKLLITFLLYFYSINSPNCYAYYNLNSMTKNNQLSSELISKMNTMNQYDHSLNNFHEYTDYTKNDPLIDSHLMMSSLNDVLSSSLLPSSSSASSSSSSSSSISAPVSSSSSSHNEIETHRCEPITLILCKGMYYEYTRLPNMFHHETQEEAGLEAHQFYPLVQINCSKDLRFLLCSIYTPICIKGYPHFLPPCRSICQRVKAGCSPIMEHYEFPWPERMNCEQFPEYNNPQGILCMERNLTHEEQLELQSINIKNYQSIQSINQSSINQLNELSNSIQGISDPLGTSNSLGTEKYDQIKTLSIEDIELKNQFNDDASYILFKEAIKNDNISQLKTTFPNLHLKCTCDCRPPLINIKNLGMNSHEKITVADIKDCSMPCYTPYYPINSSYHFTTFWLGIWSIFCAISTLITIFTFIIDSYRFQYPELPLIYLSLCYFMISMGYLIRVFMGHQAIACDSLPNQYENLQNDLTQTTMNNNHNHDWFGYNPTNIHENLKSVTIYPDTITTTTTVAKATMTTNELSMITSKTTSNLLKSPNQLIRSKILRYALNGRASCAVVFLLIYFFNMAASIWWVILALTWLLAAGLKWGSEAISKYSQVFHFIAWSLPASQTALALLLSIVEGDPISGLCTIQSNKSIPFLLFTFIPLLIYLIIGILFMMIGFIALFHIRGTIKLQRPRIIEIHKLDKLIIRIGIYGMLYTIPNLIVLFIIGYELRNTYIWQLGIACHCHYDIGQYNEEVEPILPVALPIWNPSKPEYSIYMLKHFMTLMIGIISGFWIWSNKTIDTWRRFCFNGNKCLFQFNKHNNSSSCNGLLVNPNCIEQDIYHKRRMKHWIQIPSNVSMATVTKLTDTRIKSKLNSMNKYPIFIENNEHCNTTVITTTTTTTTTTMKTTMTATSKEHNTTSYDFINNGTLSNINPLLALNPLSTPFSTHSYDVPNHDIQYKSSFGAYYSIDGSTISQQYGDVNSYHTNNSFSNNNNNHSTTVDNQFMITNTRSYVTQLSGHSMNPSFSTLSSSLNSPHKSSMLHLNNNNNNNSSLNITNNHSSISTGISSSGISSGQINDGLTRTGSIFTGSELNSNSISPKNMDYYLNGEQRSFKLNGSQATTTTTTPATTLLPVINYDRHIDESNLRRNNHSICVNNQFISNMINENRKNNLSLVQ
					

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.4	Very low	41.2	Very low	219 Å²	219	141.8 Å²	141.8	100%	1.079	69%	0.688	S	S	*	*				0	-42.4	0	-92.8	-174.5	172.1	0	0	114.7	S3 S4	M1-S3 PolarHBondContact O-N 2.98Å; M1-S4 PolarHBondContact O-N 3.42Å
2	T	37	Very low	41.6	Very low	113 Å²	113	140.8 Å²	140.8	69%	0.693	68%	0.682	S	S	*	*	H	α-helix	trans	-51.6	-46.5	-178.6	40	0	0	0	0	114.3	S4 K5 Y6	T2-S4 VanDerWaalsContact C-N 3.3Å; T2-S4 PolarHBondContact O-N 3.14Å; T2-K5 PolarHBondContact O-N 2.88Å; T2-Y6 PolarHBondContact O-N 3.01Å
3	S	35.7	Very low	42.8	Very low	84 Å²	84	140.9 Å²	140.9	59%	0.587	67%	0.672	S	S	*	*	H	α-helix	trans	-53.1	-40.5	179.7	-177.1	0	0	0	0	113.9	M1 K5 Y6 T7	M1-S3 PolarHBondContact O-N 2.98Å; S3-K5 VanDerWaalsContact C-N 3.32Å; S3-K5 PolarHBondContact O-N 2.99Å; S3-Y6 WeakPolarHBondContact O-CA 3.32Å; S3-Y6 WeakPolarHBondContact O-CB 3.45Å; S3-Y6 PolarHBondContact O-N 3.14Å; S3-T7 PolarHBondContact O-N 2.93Å
4	S	39.9	Very low	43.9	Very low	80 Å²	80	141.4 Å²	141.4	56%	0.559	67%	0.67	S	S	*	*	H	α-helix	trans	-63.4	-33.4	178.1	170.2	0	0	0	0	113.3	M1 T2 Y6 T7 M8	M1-S4 PolarHBondContact O-N 3.42Å; T2-S4 VanDerWaalsContact C-N 3.3Å; T2-S4 PolarHBondContact O-N 3.14Å; S4-Y6 VanDerWaalsContact C-N 3.33Å; S4-T7 PolarHBondContact O-OG1 3.42Å; S4-T7 VanDerWaalsContact O-OG1 3.12Å; S4-M8 PolarHBondContact O-N 3.21Å
5	K	40.5	Very low	45	Very low	166 Å²	166	140.7 Å²	140.7	72%	0.722	67%	0.671	S	S	*	*	H	α-helix	trans	-72.2	-26.9	173.5	-72.3	-176.8	175.3	176.6	0	112.5	T2 S3 K9	T2-K5 PolarHBondContact O-N 2.88Å; S3-K5 VanDerWaalsContact C-N 3.32Å; S3-K5 PolarHBondContact O-N 2.99Å; K5-K9 PolarHBondContact O-N 2.81Å
6	Y	38.6	Very low	46	Very low	181 Å²	181	137.9 Å²	137.9	71%	0.71	66%	0.661	S	S	*	*	H	α-helix	trans	-75.8	-41.7	172.7	-87.3	-93.7	0	0	0	112.3	T2 S3 S4 K9 R10	T2-Y6 PolarHBondContact O-N 3.01Å; S3-Y6 WeakPolarHBondContact O-CA 3.32Å; S3-Y6 WeakPolarHBondContact O-CB 3.45Å; S3-Y6 PolarHBondContact O-N 3.14Å; S4-Y6 VanDerWaalsContact C-N 3.33Å; Y6-K9 PolarHBondContact O-N 3.42Å; Y6-R10 WeakPolarHBondContact O-CB 3.44Å; Y6-R10 PolarHBondContact O-N 3.27Å
7	T	48.3	Very low	47.3	Very low	80 Å²	80	135 Å²	135	49%	0.491	65%	0.648	S	S	.	*	H	α-helix	trans	-66.8	-38.4	178.6	53.7	0	0	0	0	112.7	S3 S4 R10 K11	S3-T7 PolarHBondContact O-N 2.93Å; S4-T7 PolarHBondContact O-OG1 3.42Å; S4-T7 VanDerWaalsContact O-OG1 3.12Å; T7-R10 PolarHBondContact O-N 2.91Å; T7-K11 PolarHBondContact O-N 3.46Å
8	M	35.7	Very low	48.4	Very low	134 Å²	134	132.5 Å²	132.5	66%	0.66	64%	0.643	S	S	*	*	H	α-helix	trans	-66.5	-41.6	175.4	-160.8	179.9	-168.2	0	0	112.1	S4 R10 K11 Q12	S4-M8 PolarHBondContact O-N 3.21Å; M8-R10 VanDerWaalsContact C-N 3.34Å; M8-R10 PolarHBondContact O-N 3.24Å; M8-K11 PolarHBondContact O-N 3.49Å; M8-Q12 PolarHBondContact O-N 3.06Å; M8-Q12 VanDerWaalsContact O-N 3.11Å
9	K	46.1	Very low	49	Very low	129 Å²	129	129.8 Å²	129.8	56%	0.561	63%	0.628	S	S	*	*	H	α-helix	trans	-58.6	-44.6	169.1	-84.4	-167.4	172.2	-167.6	0	111.5	K5 Y6 K11 Q12 Y13	K5-K9 PolarHBondContact O-N 2.81Å; Y6-K9 PolarHBondContact O-N 3.42Å; K9-K11 VanDerWaalsContact C-N 3.32Å; K9-K11 PolarHBondContact O-N 2.78Å; K9-Q12 PolarHBondContact O-N 3.29Å; K9-Y13 WeakPolarHBondContact O-CD2 3.23Å; K9-Y13 PolarHBondContact O-N 2.9Å
10	R	44.5	Very low	49.9	Very low	202 Å²	202	128.4 Å²	128.4	76%	0.762	62%	0.623	S	S	*	*	H	α-helix	trans	-63.9	-33.7	-178.6	-157.4	176.2	-169.6	-170.9	3.2	112.5	Y6 T7 M8 K14	Y6-R10 WeakPolarHBondContact O-CB 3.44Å; Y6-R10 PolarHBondContact O-N 3.27Å; T7-R10 PolarHBondContact O-N 2.91Å; M8-R10 VanDerWaalsContact C-N 3.34Å; M8-R10 PolarHBondContact O-N 3.24Å; R10-K14 WeakPolarHBondContact O-CB 3.28Å; R10-K14 PolarHBondContact O-N 3.35Å
11	K	47.2	Very low	50.6	Low	172 Å²	172	127.6 Å²	127.6	75%	0.748	62%	0.621	S	S	*	*	H	α-helix	trans	-67.7	-45.6	170.3	-80.7	-164.1	172.5	-169.1	0	112.5	T7 M8 K9 K14 L15	T7-K11 PolarHBondContact O-N 3.46Å; M8-K11 PolarHBondContact O-N 3.49Å; K9-K11 VanDerWaalsContact C-N 3.32Å; K9-K11 PolarHBondContact O-N 2.78Å; K11-K14 PolarHBondContact O-N 3.37Å; K11-L15 PolarHBondContact O-N 2.79Å
12	Q	46.4	Very low	51.7	Low	130 Å²	130	123 Å²	123	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-63.5	-42.3	176.2	-75.4	-174.2	-38	0	0	112.7	M8 K9 L15 L16	M8-Q12 PolarHBondContact O-N 3.06Å; M8-Q12 VanDerWaalsContact O-N 3.11Å; K9-Q12 PolarHBondContact O-N 3.29Å; Q12-L15 PolarHBondContact O-N 3.36Å; Q12-L16 WeakPolarHBondContact O-CB 3.34Å; Q12-L16 PolarHBondContact O-N 3.09Å
13	Y	57.1	Low	52.5	Low	142 Å²	142	119.6 Å²	119.6	56%	0.557	57%	0.568	S	S	*	*	H	α-helix	trans	-65.3	-39.9	174.2	-89.8	-83.9	0	0	0	112.1	K9 L16 I17	K9-Y13 WeakPolarHBondContact O-CD2 3.23Å; K9-Y13 PolarHBondContact O-N 2.9Å; Y13-L16 PolarHBondContact O-N 3.31Å; Y13-I17 VanDerWaalsContact O-CB 3.26Å; Y13-I17 WeakPolarHBondContact O-CB 3.49Å; Y13-I17 WeakPolarHBondContact O-CD1 3.47Å; Y13-I17 WeakPolarHBondContact O-CG1 3.5Å; Y13-I17 PolarHBondContact O-N 2.84Å
14	K	58.7	Low	53.4	Low	147 Å²	147	124.2 Å²	124.2	64%	0.639	57%	0.574	S	S	*	*	H	α-helix	trans	-59.2	-49.1	172	-101.1	-158.1	169.4	-162.1	0	111.3	R10 K11 L16 I17 T18	R10-K14 WeakPolarHBondContact O-CB 3.28Å; R10-K14 PolarHBondContact O-N 3.35Å; K11-K14 PolarHBondContact O-N 3.37Å; K14-L16 PolarHBondContact O-N 3.47Å; K14-I17 PolarHBondContact O-N 3.26Å; K14-T18 WeakPolarHBondContact O-CB 3.25Å; K14-T18 PolarHBondContact O-N 3.07Å; K14-T18 PolarHBondContact O-OG1 3.09Å; K14-T18 VanDerWaalsContact O-OG1 3.12Å
15	L	60.7	Low	54.1	Low	131 Å²	131	124.8 Å²	124.8	69%	0.686	58%	0.578	S	S	*	*	H	α-helix	trans	-62.1	-42.9	-179.4	-162.4	75.3	0	0	0	111.9	K11 Q12 T18 F19	K11-L15 PolarHBondContact O-N 2.79Å; Q12-L15 PolarHBondContact O-N 3.36Å; L15-T18 PolarHBondContact O-N 2.9Å; L15-F19 WeakPolarHBondContact O-CB 3.26Å; L15-F19 PolarHBondContact O-N 3.2Å
16	L	60.3	Low	54.7	Low	97 Å²	97	119.6 Å²	119.6	51%	0.508	56%	0.558	S	S	.	*	H	α-helix	trans	-65.1	-41.3	176.2	-171.8	70.9	0	0	0	112	Q12 Y13 K14 F19 L20	Q12-L16 WeakPolarHBondContact O-CB 3.34Å; Q12-L16 PolarHBondContact O-N 3.09Å; Y13-L16 PolarHBondContact O-N 3.31Å; K14-L16 PolarHBondContact O-N 3.47Å; L16-F19 PolarHBondContact O-N 2.97Å; L16-L20 HydrophobicContact CG-CD1 4.02Å; L16-L20 VanDerWaalsContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CB 3.26Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.08Å; L16-L20 PolarHBondContact O-N 3.49Å
17	I	68.3	Low	55.1	Low	88 Å²	88	114.2 Å²	114.2	45%	0.451	54%	0.541	S	S	.	.	H	α-helix	trans	-67.4	-42.2	177	-71.5	165.4	0	0	0	110.6	Y13 K14 F19 L20 L21	Y13-I17 VanDerWaalsContact O-CB 3.26Å; Y13-I17 WeakPolarHBondContact O-CB 3.49Å; Y13-I17 WeakPolarHBondContact O-CD1 3.47Å; Y13-I17 WeakPolarHBondContact O-CG1 3.5Å; Y13-I17 PolarHBondContact O-N 2.84Å; K14-I17 PolarHBondContact O-N 3.26Å; I17-F19 PolarHBondContact O-N 3.33Å; I17-L20 PolarHBondContact O-N 2.87Å; I17-L21 HydrophobicContact CG2-CD1 3.71Å; I17-L21 HydrophobicContact CG2-CG 4.16Å; I17-L21 VanDerWaalsContact O-CB 3.3Å; I17-L21 WeakPolarHBondContact O-CB 3.46Å; I17-L21 VanDerWaalsContact O-CG 3.25Å; I17-L21 WeakPolarHBondContact O-CG 3.27Å; I17-L21 PolarHBondContact O-N 3.41Å
18	T	67	Low	54.8	Low	90 Å²	90	112 Å²	112	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-61.6	-43.7	173.1	-60.8	0	0	0	0	111.1	K14 L15 L20 L21 Y22	K14-T18 WeakPolarHBondContact O-CB 3.25Å; K14-T18 PolarHBondContact O-N 3.07Å; K14-T18 PolarHBondContact O-OG1 3.09Å; K14-T18 VanDerWaalsContact O-OG1 3.12Å; L15-T18 PolarHBondContact O-N 2.9Å; T18-L20 PolarHBondContact O-N 3.31Å; T18-L21 PolarHBondContact O-N 2.97Å; T18-Y22 VanDerWaalsContact O-CB 3.24Å; T18-Y22 WeakPolarHBondContact O-CB 3.22Å; T18-Y22 PolarHBondContact O-N 3.33Å
19	F	60.2	Low	55.1	Low	82 Å²	82	110.2 Å²	110.2	36%	0.36	53%	0.528	S	S	.	.	H	α-helix	trans	-64.8	-39.8	177.5	-158.8	-93.2	0	0	0	112.1	L15 L16 I17 F23	L15-F19 WeakPolarHBondContact O-CB 3.26Å; L15-F19 PolarHBondContact O-N 3.2Å; L16-F19 PolarHBondContact O-N 2.97Å; I17-F19 PolarHBondContact O-N 3.33Å; F19-F23 AromaticContact CD1-CD2 3.95Å; F19-F23 HydrophobicContact CD1-CD2 3.95Å; F19-F23 HydrophobicContact CD1-CE2 4.24Å; F19-F23 AromaticContact CE1-CD2 3.66Å; F19-F23 HydrophobicContact CE1-CD2 3.66Å; F19-F23 AromaticContact CE1-CE2 3.47Å; F19-F23 HydrophobicContact CE1-CE2 3.47Å; F19-F23 VanDerWaalsContact CE1-CE2 3.47Å; F19-F23 HydrophobicContact CZ-CD2 4.35Å; F19-F23 AromaticContact CZ-CE2 3.95Å; F19-F23 HydrophobicContact CZ-CE2 3.95Å; F19-F23 WeakPolarHBondContact O-CB 3.48Å; F19-F23 PolarHBondContact O-N 3.18Å
20	L	65.7	Low	54.9	Low	101 Å²	101	109.9 Å²	109.9	53%	0.529	53%	0.532	S	S	.	.	H	α-helix	trans	-70.3	-41.3	175.9	-74.8	170.5	0	0	0	112.8	L16 I17 T18 Y22 F23 Y24	L16-L20 HydrophobicContact CG-CD1 4.02Å; L16-L20 VanDerWaalsContact O-CB 3.31Å; L16-L20 WeakPolarHBondContact O-CB 3.26Å; L16-L20 VanDerWaalsContact O-CG 3.24Å; L16-L20 WeakPolarHBondContact O-CG 3.08Å; L16-L20 PolarHBondContact O-N 3.49Å; I17-L20 PolarHBondContact O-N 2.87Å; T18-L20 PolarHBondContact O-N 3.31Å; L20-Y22 VanDerWaalsContact C-N 3.33Å; L20-F23 CarbonylContact O-C 3.38Å; L20-F23 PolarHBondContact O-N 2.96Å; L20-Y24 WeakPolarHBondContact O-CB 3.31Å; L20-Y24 PolarHBondContact O-N 3.13Å
21	L	66	Low	54.5	Low	111 Å²	111	104.5 Å²	104.5	58%	0.581	52%	0.524	S	S	*	.	H	α-helix	trans	-65.5	-37.9	174.5	-74	171.7	0	0	0	111.2	I17 T18 Y24 S25	I17-L21 HydrophobicContact CG2-CD1 3.71Å; I17-L21 HydrophobicContact CG2-CG 4.16Å; I17-L21 VanDerWaalsContact O-CB 3.3Å; I17-L21 WeakPolarHBondContact O-CB 3.46Å; I17-L21 VanDerWaalsContact O-CG 3.25Å; I17-L21 WeakPolarHBondContact O-CG 3.27Å; I17-L21 PolarHBondContact O-N 3.41Å; T18-L21 PolarHBondContact O-N 2.97Å; L21-Y24 PolarHBondContact O-N 3.45Å; L21-S25 VanDerWaalsContact O-CB 3.31Å; L21-S25 WeakPolarHBondContact O-CB 3.45Å; L21-S25 PolarHBondContact O-N 3.47Å
22	Y	62	Low	54	Low	123 Å²	123	103.1 Å²	103.1	48%	0.482	52%	0.515	S	S	.	.	H	α-helix	trans	-67.1	-43.6	173.2	-162.8	-125.3	0	0	0	111	T18 L20 Y24 S25 I26 F720	T18-Y22 VanDerWaalsContact O-CB 3.24Å; T18-Y22 WeakPolarHBondContact O-CB 3.22Å; T18-Y22 PolarHBondContact O-N 3.33Å; L20-Y22 VanDerWaalsContact C-N 3.33Å; Y22-Y24 VanDerWaalsContact C-N 3.3Å; Y22-Y24 PolarHBondContact O-N 3.21Å; Y22-S25 PolarHBondContact O-N 3.47Å; Y22-I26 HydrophobicContact CD1-CD1 3.7Å; Y22-I26 HydrophobicContact CD2-CD1 4.31Å; Y22-I26 HydrophobicContact CE1-CD1 3.63Å; Y22-I26 HydrophobicContact CE2-CD1 4.24Å; Y22-I26 HydrophobicContact CG-CD1 4.05Å; Y22-I26 WeakPolarHBondContact O-CB 3.17Å; Y22-I26 WeakPolarHBondContact O-CD1 3.37Å; Y22-I26 VanDerWaalsContact O-CG1 3.23Å; Y22-I26 WeakPolarHBondContact O-CG1 3.47Å; Y22-I26 PolarHBondContact O-N 3.04Å; Y22-F720 HydrophobicContact CD1-CE2 4.16Å; Y22-F720 AromaticContact CE1-CE2 3.54Å; Y22-F720 HydrophobicContact CE1-CE2 3.54Å; Y22-F720 AromaticContact CE1-CZ 3.86Å; Y22-F720 HydrophobicContact CE1-CZ 3.86Å
23	F	54.4	Low	53.6	Low	41 Å²	41	98.7 Å²	98.7	18%	0.18	50%	0.501	C	S	.	.	H	α-helix	trans	-58.5	-38.6	170.2	-111.4	-103.5	0	0	0	112.5	F19 L20 I26 N27 L716	F19-F23 AromaticContact CD1-CD2 3.95Å; F19-F23 HydrophobicContact CD1-CD2 3.95Å; F19-F23 HydrophobicContact CD1-CE2 4.24Å; F19-F23 AromaticContact CE1-CD2 3.66Å; F19-F23 HydrophobicContact CE1-CD2 3.66Å; F19-F23 AromaticContact CE1-CE2 3.47Å; F19-F23 HydrophobicContact CE1-CE2 3.47Å; F19-F23 VanDerWaalsContact CE1-CE2 3.47Å; F19-F23 HydrophobicContact CZ-CD2 4.35Å; F19-F23 AromaticContact CZ-CE2 3.95Å; F19-F23 HydrophobicContact CZ-CE2 3.95Å; F19-F23 WeakPolarHBondContact O-CB 3.48Å; F19-F23 PolarHBondContact O-N 3.18Å; L20-F23 CarbonylContact O-C 3.38Å; L20-F23 PolarHBondContact O-N 2.96Å; F23-I26 PolarHBondContact O-N 2.73Å; F23-N27 VanDerWaalsContact CD1-ND2 3.3Å; F23-N27 WeakPolarHBondContact CD1-ND2 3.35Å; F23-N27 VanDerWaalsContact O-CB 3.3Å; F23-N27 WeakPolarHBondContact O-CB 3.4Å; F23-N27 PolarHBondContact O-N 2.95Å; F23-N27 PolarHBondContact O-ND2 2.9Å; F23-L716 HydrophobicContact CZ-CD2 4.18Å
24	Y	54.6	Low	52.5	Low	181 Å²	181	100.8 Å²	100.8	71%	0.71	51%	0.509	S	S	*	.	H	α-helix	trans	-72.9	-39	178.9	-158.7	-92.9	0	0	0	111.8	L20 L21 Y22 I26 S28	L20-Y24 WeakPolarHBondContact O-CB 3.31Å; L20-Y24 PolarHBondContact O-N 3.13Å; L21-Y24 PolarHBondContact O-N 3.45Å; Y22-Y24 VanDerWaalsContact C-N 3.3Å; Y22-Y24 PolarHBondContact O-N 3.21Å; Y24-I26 VanDerWaalsContact C-N 3.26Å; Y24-I26 PolarHBondContact O-N 3.07Å; Y24-S28 WeakPolarHBondContact O-CB 3.41Å; Y24-S28 PolarHBondContact O-N 3.23Å
25	S	54.4	Low	51.4	Low	92 Å²	92	101.5 Å²	101.5	64%	0.643	51%	0.509	S	S	*	.	H	α-helix	trans	-68.9	-22.4	173.6	-170.8	0	0	0	0	113.3	L21 Y22	L21-S25 VanDerWaalsContact O-CB 3.31Å; L21-S25 WeakPolarHBondContact O-CB 3.45Å; L21-S25 PolarHBondContact O-N 3.47Å; Y22-S25 PolarHBondContact O-N 3.47Å
26	I	53.1	Low	50.2	Low	58 Å²	58	100.3 Å²	100.3	30%	0.297	50%	0.503	S	S	.	.	H	α-helix	trans	-90.8	-39.2	176.5	-72.2	167.7	0	0	0	111.7	Y22 F23 Y24 F720	Y22-I26 HydrophobicContact CD1-CD1 3.7Å; Y22-I26 HydrophobicContact CD2-CD1 4.31Å; Y22-I26 HydrophobicContact CE1-CD1 3.63Å; Y22-I26 HydrophobicContact CE2-CD1 4.24Å; Y22-I26 HydrophobicContact CG-CD1 4.05Å; Y22-I26 WeakPolarHBondContact O-CB 3.17Å; Y22-I26 WeakPolarHBondContact O-CD1 3.37Å; Y22-I26 VanDerWaalsContact O-CG1 3.23Å; Y22-I26 WeakPolarHBondContact O-CG1 3.47Å; Y22-I26 PolarHBondContact O-N 3.04Å; F23-I26 PolarHBondContact O-N 2.73Å; Y24-I26 VanDerWaalsContact C-N 3.26Å; Y24-I26 PolarHBondContact O-N 3.07Å; I26-F720 HydrophobicContact CD1-CD2 4.32Å; I26-F720 HydrophobicContact CD1-CE2 3.75Å
27	N	46.5	Very low	49	Very low	67 Å²	67	100.1 Å²	100.1	36%	0.358	50%	0.502	S	S	.	.	S	Bend	trans	-98.6	14.1	-176.9	-61.5	-76.3	0	0	0	113.7	F23 P29	F23-N27 VanDerWaalsContact CD1-ND2 3.3Å; F23-N27 WeakPolarHBondContact CD1-ND2 3.35Å; F23-N27 VanDerWaalsContact O-CB 3.3Å; F23-N27 WeakPolarHBondContact O-CB 3.4Å; F23-N27 PolarHBondContact O-N 2.95Å; F23-N27 PolarHBondContact O-ND2 2.9Å; N27-P29 WeakPolarHBondContact O-CD 3.4Å
28	S	41.2	Very low	47.3	Very low	35 Å²	35	102.9 Å²	102.9	25%	0.245	52%	0.518	C	S	.	.			trans	-63.1	114.1	172.6	-178.7	0	0	0	0	109.6	Y24 N30 C31	Y24-S28 WeakPolarHBondContact O-CB 3.41Å; Y24-S28 PolarHBondContact O-N 3.23Å; S28-N30 PolarHBondContact O-N 2.89Å; S28-C31 PolarHBondContact O-N 3.23Å
29	P	43.7	Very low	45.7	Very low	96 Å²	96	103.3 Å²	103.3	62%	0.623	53%	0.525	S	S	*	.	H	α-helix	trans	-60.7	-23.8	-175	-24.3	35.6	0	0	0	113	N27 C31 Y32 A33	N27-P29 WeakPolarHBondContact O-CD 3.4Å; P29-C31 VanDerWaalsContact C-N 3.25Å; P29-C31 PolarHBondContact O-N 3.02Å; P29-Y32 PolarHBondContact O-N 3.16Å; P29-Y32 VanDerWaalsContact O-N 3.15Å; P29-A33 PolarHBondContact O-N 2.96Å
30	N	40.5	Very low	44.6	Very low	122 Å²	122	107 Å²	107	65%	0.652	55%	0.545	S	S	*	.	H	α-helix	trans	-67.8	-20.8	-173.9	-61.1	-4	0	0	0	113.1	S28 Y34	S28-N30 PolarHBondContact O-N 2.89Å; N30-Y34 PolarHBondContact O-N 2.89Å
31	C	37.1	Very low	43.1	Very low	89 Å²	89	106.8 Å²	106.8	60%	0.601	55%	0.548	S	S	*	.	H	α-helix	trans	-80.4	-36.5	171.8	-73.8	0	0	0	0	112.9	S28 P29 Y34	S28-C31 PolarHBondContact O-N 3.23Å; P29-C31 VanDerWaalsContact C-N 3.25Å; P29-C31 PolarHBondContact O-N 3.02Å; C31-Y34 PolarHBondContact O-N 2.89Å
32	Y	37.2	Very low	41.5	Very low	142 Å²	142	110.9 Å²	110.9	56%	0.557	56%	0.561	S	S	*	*	H	α-helix	trans	-72.6	-32.7	175.5	-104.2	-82.6	0	0	0	112.1	P29 Y34	P29-Y32 PolarHBondContact O-N 3.16Å; P29-Y32 VanDerWaalsContact O-N 3.15Å; Y32-Y34 VanDerWaalsContact C-N 3.34Å
33	A	36.7	Very low	40.2	Very low	38 Å²	38	112.6 Å²	112.6	31%	0.314	58%	0.579	S	S	.	*	H	α-helix	trans	-59.6	-44.1	168.9	0	0	0	0	0	111.6	P29 Y35 N36 L37	P29-A33 PolarHBondContact O-N 2.96Å; A33-Y35 VanDerWaalsContact C-N 3.3Å; A33-Y35 PolarHBondContact O-N 2.96Å; A33-N36 PolarHBondContact O-N 3.17Å; A33-N36 VanDerWaalsContact O-N 3.11Å; A33-L37 HydrophobicContact CB-CD1 4.22Å; A33-L37 WeakPolarHBondContact O-CB 3.28Å; A33-L37 PolarHBondContact O-N 3.39Å
34	Y	33.9	Very low	39.1	Very low	185 Å²	185	118.3 Å²	118.3	73%	0.725	61%	0.611	S	S	*	*	H	α-helix	trans	-63.1	-29.2	-172.5	-154	-94.5	0	0	0	114.6	N30 C31 Y32	N30-Y34 PolarHBondContact O-N 2.89Å; C31-Y34 PolarHBondContact O-N 2.89Å; Y32-Y34 VanDerWaalsContact C-N 3.34Å
35	Y	35.8	Very low	38.2	Very low	162 Å²	162	118.8 Å²	118.8	64%	0.635	62%	0.62	S	S	*	*	H	α-helix	trans	-91.2	-9.5	177.2	-93.6	-88.2	0	0	0	114.5	A33 K334	A33-Y35 VanDerWaalsContact C-N 3.3Å; A33-Y35 PolarHBondContact O-N 2.96Å; Y35-K334 PolarHBondContact OH-NZ 3.16Å
36	N	35.4	Very low	37.2	Very low	106 Å²	106	122.5 Å²	122.5	57%	0.567	63%	0.632	S	S	*	*	H	α-helix	trans	-117.9	-16.6	-177.2	-143.1	-6.2	0	0	0	113.6	A33 N38 S39	A33-N36 PolarHBondContact O-N 3.17Å; A33-N36 VanDerWaalsContact O-N 3.11Å; N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 PolarHBondContact O-N 3.35Å; N36-S39 WeakPolarHBondContact O-CB 3.45Å; N36-S39 PolarHBondContact O-N 3.37Å; N36-S39 VanDerWaalsContact O-N 3.08Å
37	L	35.9	Very low	36.5	Very low	93 Å²	93	123.4 Å²	123.4	49%	0.487	64%	0.643	S	S	.	*	G	3₁₀ helix	trans	-62.4	-31.7	175.3	-113.3	64.6	0	0	0	113.2	A33 S39 M40 T41	A33-L37 HydrophobicContact CB-CD1 4.22Å; A33-L37 WeakPolarHBondContact O-CB 3.28Å; A33-L37 PolarHBondContact O-N 3.39Å; L37-S39 PolarHBondContact O-N 3.14Å; L37-S39 VanDerWaalsContact O-N 3.1Å; L37-M40 PolarHBondContact O-N 3.22Å; L37-T41 HydrophobicContact CG-CG2 4.35Å; L37-T41 PolarHBondContact O-N 3Å; L37-T41 PolarHBondContact O-OG1 3.39Å
38	N	32.5	Very low	36.2	Very low	146 Å²	146	125.3 Å²	125.3	78%	0.781	66%	0.662	S	S	*	*	G	3₁₀ helix	trans	-61.8	-17.3	175	-72.3	4.5	0	0	0	113	N36	N36-N38 VanDerWaalsContact C-N 3.28Å; N36-N38 PolarHBondContact O-N 3.35Å
39	S	33.4	Very low	36.2	Very low	99 Å²	99	129.9 Å²	129.9	69%	0.692	68%	0.679	S	S	*	*	G	3₁₀ helix	trans	-88.6	-5.3	171.4	-171.2	0	0	0	0	114	N36 L37	N36-S39 WeakPolarHBondContact O-CB 3.45Å; N36-S39 PolarHBondContact O-N 3.37Å; N36-S39 VanDerWaalsContact O-N 3.08Å; L37-S39 PolarHBondContact O-N 3.14Å; L37-S39 VanDerWaalsContact O-N 3.1Å
40	M	36.1	Very low	36	Very low	160 Å²	160	131 Å²	131	79%	0.788	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.3	-17	-174.2	-73.7	-168.2	166.2	0	0	114.9	L37 K42	L37-M40 PolarHBondContact O-N 3.22Å; M40-K42 PolarHBondContact O-N 3.3Å
41	T	35.8	Very low	36.3	Very low	97 Å²	97	130 Å²	130	60%	0.595	67%	0.673	S	S	*	*			trans	-83	46.3	178.2	55.7	0	0	0	0	113.7	L37	L37-T41 HydrophobicContact CG-CG2 4.35Å; L37-T41 PolarHBondContact O-N 3Å; L37-T41 PolarHBondContact O-OG1 3.39Å
42	K	31.4	Very low	36.4	Very low	196 Å²	196	129.7 Å²	129.7	85%	0.852	67%	0.672	S	S	*	*			trans	-102.8	59.7	166.1	-99.8	-168.3	175.8	-176.8	0	110.7	M40	M40-K42 PolarHBondContact O-N 3.3Å
43	N	34.8	Very low	36.8	Very low	160 Å²	160	129.5 Å²	129.5	86%	0.856	67%	0.674	S	S	*	*			trans	-158.4	139.9	162.1	-98.3	-42.4	0	0	0	110
44	N	31.4	Very low	36.9	Very low	160 Å²	160	133.9 Å²	133.9	86%	0.856	69%	0.69	S	S	*	*			trans	-83.8	175.5	-173	-79.8	-39.5	0	0	0	113.3
45	Q	36	Very low	37.1	Very low	192 Å²	192	131 Å²	131	90%	0.897	69%	0.687	S	S	*	*	S	Bend	trans	86.1	17	150.5	-147.5	169.6	4.1	0	0	119.2
46	L	33.9	Very low	37.4	Very low	170 Å²	170	128.8 Å²	128.8	89%	0.89	69%	0.69	S	S	*	*			trans	-145.5	46.7	173.4	-154.1	77.8	0	0	0	116
47	S	37.6	Very low	37.4	Very low	77 Å²	77	131.4 Å²	131.4	54%	0.538	70%	0.701	S	S	.	*			trans	-123.1	-22.2	-174.3	55.4	0	0	0	0	116.9	E49 I51	S47-E49 PolarHBondContact O-N 2.87Å; S47-I51 WeakPolarHBondContact O-CD1 3.19Å; S47-I51 WeakPolarHBondContact O-CG1 3.44Å
48	S	40.5	Very low	37.4	Very low	107 Å²	107	134.1 Å²	134.1	75%	0.748	72%	0.716	S	S	*	*	H	α-helix	trans	-64.6	-35.4	-171.2	49.9	0	0	0	0	114.6
49	E	41	Very low	37.5	Very low	130 Å²	130	135.7 Å²	135.7	61%	0.607	72%	0.719	S	S	*	*	H	α-helix	trans	-85.3	-25.2	-173.4	-139.6	-159.5	128.3	0	0	114.3	S47 K53	S47-E49 PolarHBondContact O-N 2.87Å; E49-K53 IonicContact OE1-NZ 2.64Å; E49-K53 PolarHBondContact OE1-NZ 3.15Å
50	L	39.9	Very low	37.3	Very low	120 Å²	120	141.7 Å²	141.7	63%	0.628	73%	0.728	S	S	*	*	H	α-helix	trans	-75.8	-40.5	176.7	-97.9	74.8	0	0	0	112	S52 K53 M54	L50-S52 PolarHBondContact O-N 3.1Å; L50-K53 PolarHBondContact O-N 3.18Å; L50-M54 PolarHBondContact O-N 2.95Å
51	I	46.3	Very low	37.1	Very low	100 Å²	100	140.3 Å²	140.3	51%	0.513	72%	0.724	S	S	.	*	H	α-helix	trans	-60.4	-37.5	-178.2	-65.7	169.2	0	0	0	110.8	S47 K53 M54	S47-I51 WeakPolarHBondContact O-CD1 3.19Å; S47-I51 WeakPolarHBondContact O-CG1 3.44Å; I51-K53 VanDerWaalsContact C-N 3.28Å; I51-K53 PolarHBondContact O-N 3.11Å; I51-M54 PolarHBondContact O-N 3.2Å
52	S	40	Very low	36.7	Very low	84 Å²	84	145.1 Å²	145.1	59%	0.587	74%	0.739	S	S	*	*	H	α-helix	trans	-58.7	-35.4	173.9	-173.3	0	0	0	0	113.4	L50	L50-S52 PolarHBondContact O-N 3.1Å
53	K	45	Very low	36.7	Very low	137 Å²	137	140 Å²	140	60%	0.596	73%	0.727	S	S	*	*	H	α-helix	trans	-90.5	-11.8	-175.6	-72.7	168.5	179.1	156.3	0	114.4	E49 L50 I51 T56	E49-K53 IonicContact OE1-NZ 2.64Å; E49-K53 PolarHBondContact OE1-NZ 3.15Å; L50-K53 PolarHBondContact O-N 3.18Å; I51-K53 VanDerWaalsContact C-N 3.28Å; I51-K53 PolarHBondContact O-N 3.11Å; K53-T56 PolarHBondContact O-OG1 3.09Å
54	M	38.1	Very low	36.6	Very low	131 Å²	131	140.2 Å²	140.2	65%	0.645	73%	0.728	S	S	*	*	H	α-helix	trans	-87.8	-30.2	176.5	-68.1	-177.1	70.7	0	0	113	L50 I51 T56 M57	L50-M54 PolarHBondContact O-N 2.95Å; I51-M54 PolarHBondContact O-N 3.2Å; M54-T56 PolarHBondContact O-N 3.37Å; M54-M57 PolarHBondContact O-N 2.71Å
55	N	38.1	Very low	36.5	Very low	124 Å²	124	140.3 Å²	140.3	66%	0.663	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.7	-12.6	-175.5	-71	-15	0	0	0	114.4
56	T	43.2	Very low	36.2	Very low	115 Å²	115	138.4 Å²	138.4	71%	0.706	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	-1	178.5	49.3	0	0	0	0	114.3	K53 M54	K53-T56 PolarHBondContact O-OG1 3.09Å; M54-T56 PolarHBondContact O-N 3.37Å
57	M	35	Very low	36	Very low	162 Å²	162	140.1 Å²	140.1	80%	0.798	73%	0.725	S	S	*	*	S	Bend	trans	-106.4	-5.6	-171.6	-137.2	175.7	74	0	0	115.4	M54	M54-M57 PolarHBondContact O-N 2.71Å
58	N	34.7	Very low	35.6	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	74%	0.74	S	S	*	*			trans	-96.5	18.9	-174.6	-79.3	-8.4	0	0	0	115	Y60	N58-Y60 PolarHBondContact O-N 3.21Å
59	Q	34.6	Very low	35.1	Very low	180 Å²	180	148.4 Å²	148.4	84%	0.841	74%	0.743	S	S	*	*			trans	-94.3	21	-175.7	-152.9	172.3	-4.5	0	0	114.3
60	Y	30.1	Very low	34.5	Very low	224 Å²	224	152.8 Å²	152.8	88%	0.878	76%	0.756	S	S	*	*			trans	-140.2	96.7	178.2	-97.5	-94.9	0	0	0	111.6	N58	N58-Y60 PolarHBondContact O-N 3.21Å
61	D	31.5	Very low	33.8	Very low	132 Å²	132	153.5 Å²	153.5	71%	0.706	77%	0.765	S	S	*	*				161.5	122.3	104.6	-163.8	-19.2	0	0	0	109.4	S63	D61-S63 WeakPolarHBondContact OD1-CB 3.43Å; D61-S63 PolarHBondContact OD1-N 3.19Å; D61-S63 PolarHBondContact OD1-OG 3.41Å
62	H	28.1	Very low	32.9	Very low	198 Å²	198	155.7 Å²	155.7	92%	0.917	78%	0.778	S	S	*	*			trans	-129.8	43.1	-170.7	-158	-62.2	0	0	0	111.5
63	S	30.7	Very low	32.3	Very low	87 Å²	87	162.7 Å²	162.7	61%	0.608	79%	0.793	S	S	*	*			trans	-136.1	30.8	-158.1	75.6	0	0	0	0	119.3	D61	D61-S63 WeakPolarHBondContact OD1-CB 3.43Å; D61-S63 PolarHBondContact OD1-N 3.19Å; D61-S63 PolarHBondContact OD1-OG 3.41Å
64	L	33.7	Very low	31.5	Very low	166 Å²	166	162.9 Å²	162.9	87%	0.869	81%	0.806	S	S	*	*			trans	-138.5	36.3	179.4	-144.6	76.7	0	0	0	119.5	N66	L64-N66 PolarHBondContact O-N 2.96Å
65	N	28.6	Very low	31.1	Very low	161 Å²	161	164.8 Å²	164.8	86%	0.861	81%	0.81	S	S	*	*			trans	-87.9	87.8	161.9	-85.9	-3.5	0	0	0	111.1
66	N	30.4	Very low	30.9	Very low	152 Å²	152	163.5 Å²	163.5	81%	0.813	80%	0.804	S	S	*	*			trans	177.1	98.3	154.7	-98.8	-36.7	0	0	0	111.7	L64	L64-N66 PolarHBondContact O-N 2.96Å
67	F	29.7	Very low	30.3	Very low	207 Å²	207	161.2 Å²	161.2	91%	0.908	79%	0.787	S	S	*	*			trans	-159.3	118.5	146.5	-119.3	-75.3	0	0	0	110.3
68	H	28.5	Very low	30.3	Very low	182 Å²	182	156.5 Å²	156.5	84%	0.843	77%	0.769	S	S	*	*			trans	-84.2	179.1	179.1	-120.9	-109.8	0	0	0	111.6
69	E	29.5	Very low	30.2	Very low	176 Å²	176	155.6 Å²	155.6	82%	0.822	76%	0.763	S	S	*	*			trans	79.3	88.2	150.4	-163.5	172.3	-125.3	0	0	118.2
70	Y	28.1	Very low	30.3	Very low	222 Å²	222	153.9 Å²	153.9	87%	0.871	76%	0.758	S	S	*	*				-156.9	98.2	129.3	-137	-93.7	0	0	0	111.7
71	T	26	Very low	30.4	Very low	135 Å²	135	149.4 Å²	149.4	83%	0.828	75%	0.75	S	S	*	*			trans	-141.1	98.2	176.2	48.6	0	0	0	0	109.7
72	D	28.1	Very low	30.4	Very low	145 Å²	145	148.8 Å²	148.8	78%	0.775	76%	0.755	S	S	*	*			trans	-165.7	113.7	168.3	-128.1	-18.3	0	0	0	109.6
73	Y	26.1	Very low	30.7	Very low	231 Å²	231	147.6 Å²	147.6	91%	0.906	75%	0.75	S	S	*	*			trans	174.9	46.3	153.6	-106	-65.3	0	0	0	114.2
74	T	28	Very low	30.7	Very low	142 Å²	142	151 Å²	151	87%	0.871	76%	0.76	S	S	*	*			trans	-144.3	104	168.8	32.1	0	0	0	0	114.2
75	K	31	Very low	30.7	Very low	170 Å²	170	151.2 Å²	151.2	74%	0.739	76%	0.759	S	S	*	*			trans	-157.5	154.7	153.1	-119.8	171.2	173.7	177.1	0	107.9
76	N	33.9	Very low	30.9	Very low	97 Å²	97	150.5 Å²	150.5	52%	0.519	75%	0.752	S	S	.	*			trans	77.1	144.1	-160.2	-62.3	90.9	0	0	0	116.7	S964 D966 G967	N76-S964 PolarHBondContact ND2-OG 3.48Å; N76-D966 WeakPolarHBondContact CA-O 3.44Å; N76-D966 PolarHBondContact N-O 3.18Å; N76-D966 PolarHBondContact ND2-N 3.05Å; N76-G967 VanDerWaalsContact CA-CA 3.46Å
77	D	29.2	Very low	31	Very low	68 Å²	68	147.5 Å²	147.5	36%	0.364	74%	0.743	S	S	.	*			cis	-76.7	163.4	-35	51.3	-140.7	0	0	0	114.6	S964 I965 G967 S968	D77-S964 WeakPolarHBondContact OD1-CA 3.48Å; D77-S964 PolarHBondContact OD1-OG 3.39Å; D77-I965 WeakPolarHBondContact CB-O 3.37Å; D77-I965 VanDerWaalsContact OD1-C 3.32Å; D77-I965 WeakPolarHBondContact OD1-CA 3.35Å; D77-I965 PolarHBondContact OD1-N 3.5Å; D77-G967 VanDerWaalsContact C-N 3.31Å; D77-G967 CarbonylContact O-C 3.59Å; D77-G967 WeakPolarHBondContact O-CA 3.48Å; D77-S968 PolarHBondContact O-N 3.49Å
78	P	35.4	Very low	31.2	Very low	63 Å²	63	141.4 Å²	141.4	41%	0.409	73%	0.726	S	S	.	*				-169.4	-137.9	77.5	46.7	-19.5	0	0	0	115	G967 S968	P78-G967 VanDerWaalsContact CD-N 3.26Å; P78-S968 WeakPolarHBondContact CG-OG 3.43Å
79	L	33.5	Very low	31.5	Very low	129 Å²	129	138.6 Å²	138.6	68%	0.675	72%	0.717	S	S	*	*			trans	139.7	160.5	136.3	-150	137.5	0	0	0	114.7
80	I	36.5	Very low	31.9	Very low	144 Å²	144	135.2 Å²	135.2	74%	0.738	70%	0.704	S	S	*	*			trans	81.5	131.2	178.3	-52.1	177.5	0	0	0	113.9
81	D	33.1	Very low	32.2	Very low	131 Å²	131	130.5 Å²	130.5	70%	0.701	69%	0.694	S	S	*	*			cis	-133.7	154.8	5.3	-142.9	-34.8	0	0	0	112.5	H83	D81-H83 IonicContact OD1-CD2 2.98Å
82	S	31.5	Very low	32.7	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	69%	0.687	S	S	*	*			trans	-148.1	55.3	-178.4	58.5	0	0	0	0	114.8
83	H	33.2	Very low	33	Very low	174 Å²	174	129.8 Å²	129.8	81%	0.806	69%	0.689	S	S	*	*			trans	-111.1	78.7	176.6	-95.6	-84.8	0	0	0	113.3	D81	D81-H83 IonicContact OD1-CD2 2.98Å
84	L	31.8	Very low	33.5	Very low	157 Å²	157	123.3 Å²	123.3	82%	0.822	68%	0.677	S	S	*	*	S	Bend	trans	-166.3	8.2	162.1	-115.1	165	0	0	0	118.2
85	M	31.8	Very low	33.9	Very low	172 Å²	172	121.2 Å²	121.2	85%	0.847	67%	0.668	S	S	*	*	S	Bend	trans	-135.4	17.8	-177.7	-76.9	-170.1	166.1	0	0	116.2
86	M	33.2	Very low	34.1	Very low	145 Å²	145	118.5 Å²	118.5	71%	0.714	67%	0.67	S	S	*	*	S	Bend	trans	-121.3	20.9	174.9	-80.9	-67.9	-74.4	0	0	113.8
87	S	32.3	Very low	34.1	Very low	89 Å²	89	121.4 Å²	121.4	62%	0.622	69%	0.685	S	S	*	*	S	Bend	trans	-115.5	26.8	179	64.7	0	0	0	0	113.4
88	S	34.8	Very low	34.5	Very low	79 Å²	79	125.6 Å²	125.6	55%	0.552	71%	0.707	S	S	*	*	S	Bend	trans	-133.6	-7.8	179.8	55.3	0	0	0	0	114.6
89	L	34.8	Very low	34.7	Very low	124 Å²	124	127.8 Å²	127.8	65%	0.649	72%	0.721	S	S	*	*	S	Bend	trans	-106.7	-15.3	178.8	-74.5	170.1	0	0	0	114.1
90	N	37.3	Very low	34.8	Very low	104 Å²	104	126.3 Å²	126.3	56%	0.556	72%	0.721	S	S	*	*	S	Bend	trans	-87.6	-25.3	179.6	-72	-31.7	0	0	0	113.4	V92 S94	N90-V92 VanDerWaalsContact C-N 3.27Å; N90-V92 PolarHBondContact O-N 3Å; N90-S94 PolarHBondContact O-OG 3.45Å; N90-S94 VanDerWaalsContact O-OG 3.14Å
91	D	35.4	Very low	34.9	Very low	123 Å²	123	124.3 Å²	124.3	66%	0.658	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.6	-10.1	178.8	-62.5	-38.9	0	0	0	113.3
92	V	36.5	Very low	35.1	Very low	111 Å²	111	123.3 Å²	123.3	67%	0.673	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	-16.3	177.8	-176.8	0	0	0	0	112.2	N90	N90-V92 VanDerWaalsContact C-N 3.27Å; N90-V92 PolarHBondContact O-N 3Å
93	L	34.2	Very low	35.5	Very low	155 Å²	155	122.8 Å²	122.8	81%	0.812	72%	0.72	S	S	*	*	S	Bend	trans	-110.8	5.5	-170.5	-130.3	79	0	0	0	115.3
94	S	36.1	Very low	35.6	Very low	95 Å²	95	119.2 Å²	119.2	66%	0.664	72%	0.72	S	S	*	*	S	Bend	trans	-115.8	5.1	-168.2	50	0	0	0	0	115.5	N90	N90-S94 PolarHBondContact O-OG 3.45Å; N90-S94 VanDerWaalsContact O-OG 3.14Å
95	S	36.8	Very low	35.9	Very low	97 Å²	97	116.4 Å²	116.4	68%	0.678	71%	0.714	S	S	*	*	S	Bend	trans	-130.3	51.3	-167.9	67.6	0	0	0	0	116.4
96	S	35	Very low	36.2	Very low	113 Å²	113	112.9 Å²	112.9	79%	0.79	71%	0.706	S	S	*	*			trans	-165.3	43.7	169.2	53.8	0	0	0	0	118.1
97	L	33.4	Very low	36.4	Very low	158 Å²	158	111.2 Å²	111.2	83%	0.827	71%	0.709	S	S	*	*			trans	-133.7	99.7	168.7	-79.7	179.7	0	0	0	115.8
98	L	38.6	Very low	36.7	Very low	157 Å²	157	111.7 Å²	111.7	82%	0.822	71%	0.712	S	S	*	*			trans	70	163.4	146.9	-63.8	166.7	0	0	0	118.1
99	P	38.2	Very low	36.9	Very low	108 Å²	108	112.4 Å²	112.4	70%	0.701	72%	0.717	S	S	*	*			cis	-129.1	171.1	-1	30	-8.8	0	0	0	117.3
100	S	36.6	Very low	37	Very low	98 Å²	98	111.8 Å²	111.8	69%	0.685	72%	0.723	S	S	*	*			trans	74.8	115.3	142.4	53.9	0	0	0	0	123.9
101	S	37.6	Very low	37.1	Very low	102 Å²	102	111.6 Å²	111.6	71%	0.713	73%	0.73	S	S	*	*				93.9	124	124.8	68	0	0	0	0	123
102	S	38.6	Very low	37.2	Very low	111 Å²	111	110.1 Å²	110.1	78%	0.776	73%	0.729	S	S	*	*			trans	62	147.3	151.7	45.3	0	0	0	0	120.8
103	S	38.3	Very low	37.2	Very low	107 Å²	107	109.7 Å²	109.7	75%	0.748	73%	0.731	S	S	*	*			cis	-177.1	144	-21	50.9	0	0	0	0	110.4
104	A	37	Very low	37.4	Very low	98 Å²	98	109.8 Å²	109.8	81%	0.81	73%	0.731	S	S	*	*			trans	64.8	155.9	167.4	0	0	0	0	0	116.8
105	S	37.2	Very low	37.6	Very low	99 Å²	99	110.1 Å²	110.1	69%	0.692	73%	0.733	S	S	*	*			cis	-164.6	156.2	-14.9	44.4	0	0	0	0	112.5
106	S	38.1	Very low	37.4	Very low	97 Å²	97	110.1 Å²	110.1	68%	0.678	74%	0.739	S	S	*	*			trans	61.6	129.7	144.9	60.8	0	0	0	0	123.3
107	S	38.5	Very low	37.7	Very low	111 Å²	111	110.2 Å²	110.2	78%	0.776	74%	0.737	S	S	*	*			trans	64.2	149.6	143.1	51.6	0	0	0	0	121
108	S	38.3	Very low	37.8	Very low	99 Å²	99	109.1 Å²	109.1	69%	0.692	74%	0.736	S	S	*	*			cis	-170.9	162.2	-18.7	53.4	0	0	0	0	112.1
109	S	38.2	Very low	37.7	Very low	94 Å²	94	106.5 Å²	106.5	66%	0.657	73%	0.732	S	S	*	*			trans	59.8	131.8	142.5	60.4	0	0	0	0	123.3
110	S	37.8	Very low	37.5	Very low	110 Å²	110	106.2 Å²	106.2	77%	0.769	73%	0.732	S	S	*	*			trans	65.5	151.7	142.2	51.3	0	0	0	0	120.9
111	S	38.7	Very low	37.4	Very low	100 Å²	100	106.9 Å²	106.9	70%	0.699	74%	0.736	S	S	*	*			cis	-171.1	165	-19.4	55.1	0	0	0	0	112.5
112	S	37.9	Very low	37.2	Very low	93 Å²	93	106.8 Å²	106.8	65%	0.65	74%	0.736	S	S	*	*			trans	62.5	111	139.8	63.4	0	0	0	0	123.4
113	S	36.3	Very low	36.7	Very low	101 Å²	101	106.5 Å²	106.5	71%	0.706	73%	0.734	S	S	*	*				76.6	168.5	120.3	71.3	0	0	0	0	123.3
114	I	38.2	Very low	36.4	Very low	157 Å²	157	107.1 Å²	107.1	81%	0.805	74%	0.738	S	S	*	*			trans	80.4	138.8	167.1	-56.2	159.8	0	0	0	115.4
115	S	39.8	Very low	36.1	Very low	102 Å²	102	111 Å²	111	71%	0.713	74%	0.739	S	S	*	*			cis	-170.3	154.9	-29.6	61	0	0	0	0	109.5
116	A	32.8	Very low	35.6	Very low	98 Å²	98	113.8 Å²	113.8	81%	0.81	75%	0.746	S	S	*	*			trans	-95	152.9	174.5	0	0	0	0	0	113.7
117	P	42.4	Very low	35.3	Very low	114 Å²	114	117.6 Å²	117.6	74%	0.74	75%	0.754	S	S	*	*			trans	-144.4	120.5	140.3	35	-18	0	0	0	116
118	V	35.2	Very low	35.1	Very low	135 Å²	135	120 Å²	120	82%	0.818	76%	0.756	S	S	*	*				36.4	126.3	116.6	177.1	0	0	0	0	120.3
119	S	35.9	Very low	35.4	Very low	103 Å²	103	122.8 Å²	122.8	72%	0.72	76%	0.758	S	S	*	*			trans	129.5	126.3	131.8	61.2	0	0	0	0	121
120	S	35	Very low	35.9	Very low	102 Å²	102	122.7 Å²	122.7	71%	0.713	75%	0.753	S	S	*	*			trans	69.2	122.4	137.3	61	0	0	0	0	123.9
121	S	33.9	Very low	37	Very low	111 Å²	111	123 Å²	123	78%	0.776	74%	0.742	S	S	*	*			trans	63.7	145.6	137.7	57.3	0	0	0	0	120.7
122	S	32.6	Very low	38.4	Very low	100 Å²	100	127.6 Å²	127.6	70%	0.699	74%	0.744	S	S	*	*			cis	-170.7	147	-16.8	46.9	0	0	0	0	110.3
123	S	29.2	Very low	40.7	Very low	105 Å²	105	124.8 Å²	124.8	73%	0.734	72%	0.724	S	S	*	*			trans	45.8	111.9	155.6	61.5	0	0	0	0	119.7
124	S	30.7	Very low	43.2	Very low	120 Å²	120	123.3 Å²	123.3	84%	0.839	71%	0.706	S	S	*	*				-176.5	157.1	101.2	40.7	0	0	0	0	113
125	H	31.1	Very low	45.7	Very low	179 Å²	179	119.7 Å²	119.7	83%	0.829	69%	0.693	S	S	*	*			trans	-51.3	134.4	-174.5	-59.8	-102	0	0	0	115.5
126	N	28.1	Very low	48.1	Very low	158 Å²	158	115.6 Å²	115.6	85%	0.845	66%	0.663	S	S	*	*				-176.7	92.1	128.2	-94.4	-22	0	0	0	111.6
127	E	31.8	Very low	50.9	Low	178 Å²	178	113.6 Å²	113.6	83%	0.832	64%	0.641	S	S	*	*			trans	-171.4	92.2	146.4	-110.5	158.9	-163.2	0	0	109.8	E129	E127-E129 VanDerWaalsContact C-N 3.32Å; E127-E129 HydrophobicContact CG-CG 4.34Å
128	I	33.9	Very low	53.1	Low	162 Å²	162	108.6 Å²	108.6	83%	0.831	61%	0.608	S	S	*	*			trans	-98.9	68.9	159.9	-54.4	178.4	0	0	0	106	T130	I128-T130 PolarHBondContact O-N 3.15Å
129	E	44.7	Very low	55.6	Low	157 Å²	157	106.1 Å²	106.1	73%	0.734	59%	0.589	S	S	*	*			trans	-61.3	123.2	164.7	-80.3	-135.7	113.3	0	0	108.2	E127 H131	E127-E129 VanDerWaalsContact C-N 3.32Å; E127-E129 HydrophobicContact CG-CG 4.34Å; E129-H131 PolarHBondContact O-N 3.06Å
130	T	49	Very low	58.1	Low	91 Å²	91	101.5 Å²	101.5	56%	0.558	56%	0.557	S	S	*	*			trans	-71.8	98.4	-174.2	59.4	0	0	0	0	109.1	I128 R132	I128-T130 PolarHBondContact O-N 3.15Å; T130-R132 WeakPolarHBondContact O-CG 3.5Å; T130-R132 PolarHBondContact O-N 2.89Å; T130-R132 PolarHBondContact OG1-NE 3.19Å
131	H	61	Low	60.8	Low	116 Å²	116	96.7 Å²	96.7	54%	0.537	52%	0.523	S	S	.	.			trans	-54.1	101.9	167.7	-66.8	-56.8	0	0	0	109.5	E129 R150	E129-H131 PolarHBondContact O-N 3.06Å; H131-R150 PolarHBondContact CD2-NH1 3.49Å; H131-R150 PolarHBondContact CE1-NH1 3.31Å; H131-R150 VanDerWaalsContact CG-NH1 3.29Å; H131-R150 PolarHBondContact NE2-NH1 2.91Å
132	R	67.8	Low	63.3	Low	197 Å²	197	96.1 Å²	96.1	74%	0.743	51%	0.506	S	S	*	.			trans	-90.8	131.7	-179.6	-76.1	166.7	-168.1	-175.8	4.1	109	T130 E134	T130-R132 WeakPolarHBondContact O-CG 3.5Å; T130-R132 PolarHBondContact O-N 2.89Å; T130-R132 PolarHBondContact OG1-NE 3.19Å; R132-E134 PolarHBondContact O-N 2.94Å
133	C	84.8	Confident	65.6	Low	34 Å²	34	94.9 Å²	94.9	23%	0.23	51%	0.509	C	S	.	.			trans	-70.7	122.1	165.8	-59	0	0	0	0	108.8	Y148 C194	C133-Y148 HydrophobicContact CB-CD1 4.21Å; C133-Y148 HydrophobicContact CB-CG 4.42Å; C133-C194 WeakPolarHBondContact CA-SG 3.43Å; C133-C194 HydrophobicContact CB-CB 3.57Å; C133-C194 WeakPolarHBondContact CB-SG 3.24Å; C133-C194 WeakPolarHBondContact SG-CB 3.49Å; C133-C194 CovalentContact SG-SG 2.04Å; C133-C194 PolarHBondContact SG-SG 3.07Å
134	E	89.2	Confident	68.3	Low	70 Å²	70	90.9 Å²	90.9	33%	0.327	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	149.8	179.4	51.4	164.5	-133.7	0	0	111	R132 Y148 T149 L151 Q160	R132-E134 PolarHBondContact O-N 2.94Å; E134-Y148 CarbonylContact O-C 3.36Å; E134-Y148 WeakPolarHBondContact O-CA 3.37Å; E134-T149 HydrophobicContact CG-CG2 3.96Å; E134-T149 PolarHBondContact N-O 3.06Å; E134-T149 VanDerWaalsContact N-O 3.1Å; E134-T149 PolarHBondContact O-N 3.37Å; E134-L151 WeakPolarHBondContact OE1-CD1 3.39Å; E134-Q160 WeakPolarHBondContact OE1-CG 3.42Å; E134-Q160 PolarHBondContact OE1-NE2 3.43Å
135	P	90.6	Very high	70.8	Confident	82 Å²	82	94.2 Å²	94.2	53%	0.532	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	147.6	-177.1	30.6	-35.7	0	0	0	111.8	T137 E147 Q160	P135-T137 PolarHBondContact O-N 3.3Å; P135-T137 VanDerWaalsContact O-N 3.14Å; P135-E147 WeakPolarHBondContact CA-O 3.49Å; P135-Q160 PolarHBondContact O-NE2 3.23Å
136	I	91.3	Very high	73.4	Confident	16 Å²	16	86.6 Å²	86.6	8%	0.082	44%	0.439	C	S	.	.			trans	-69.3	111.2	-178.1	-62.4	172.3	0	0	0	111.5	L138 C141 K142 Y146 E147 T149 Q160	I136-L138 HydrophobicContact CG2-CB 4.4Å; I136-C141 HydrophobicContact CG2-CB 3.8Å; I136-K142 VanDerWaalsContact O-CE 3.32Å; I136-K142 WeakPolarHBondContact O-CE 3.09Å; I136-Y146 HydrophobicContact CD1-CD2 3.8Å; I136-Y146 HydrophobicContact CD1-CE2 3.7Å; I136-Y146 WeakPolarHBondContact CD1-O 3.13Å; I136-E147 PolarHBondContact N-O 2.66Å; I136-T149 HydrophobicContact CG1-CG2 4.17Å; I136-Q160 VanDerWaalsContact CA-OE1 3.27Å
137	T	90.7	Very high	76.1	Confident	56 Å²	56	86 Å²	86	34%	0.344	43%	0.431	S	S	.	.			trans	-87	-31.3	175.3	65.9	0	0	0	0	112	P135 I139 K142 Q160 E161	P135-T137 PolarHBondContact O-N 3.3Å; P135-T137 VanDerWaalsContact O-N 3.14Å; T137-I139 PolarHBondContact O-N 3.35Å; T137-K142 WeakPolarHBondContact O-CE 3.28Å; T137-K142 PolarHBondContact O-NZ 3.48Å; T137-Q160 VanDerWaalsContact OG1-CB 3.26Å; T137-Q160 WeakPolarHBondContact OG1-CB 3.42Å; T137-Q160 PolarHBondContact OG1-OE1 3Å; T137-E161 PolarHBondContact OG1-OE1 2.97Å
138	L	89	Confident	78.9	Confident	9 Å²	9	82.8 Å²	82.8	5%	0.047	41%	0.412	C	S	.	.			trans	-59.9	119.6	-176.4	177.8	53.5	0	0	0	112.6	I136 L140 C141 K142 G164 A167 T191	I136-L138 HydrophobicContact CG2-CB 4.4Å; L138-L140 VanDerWaalsContact C-N 3.32Å; L138-L140 HydrophobicContact CD1-CB 4.42Å; L138-L140 HydrophobicContact CG-CB 4.23Å; L138-L140 PolarHBondContact O-N 3.15Å; L138-C141 HydrophobicContact CB-CB 4.46Å; L138-C141 HydrophobicContact CD2-CB 4.46Å; L138-C141 HydrophobicContact CG-CB 4.4Å; L138-C141 CarbonylContact O-C 3.38Å; L138-C141 PolarHBondContact O-N 3.08Å; L138-K142 PolarHBondContact O-N 2.98Å; L138-K142 VanDerWaalsContact O-N 3.09Å; L138-G164 VanDerWaalsContact CD1-CA 3.48Å; L138-A167 HydrophobicContact CD2-CB 3.87Å; L138-T191 HydrophobicContact CB-CG2 4.11Å; L138-T191 HydrophobicContact CD2-CG2 3.84Å
139	I	87.7	Confident	81.6	Confident	82 Å²	82	75.1 Å²	75.1	42%	0.421	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-57.5	-42.7	-174.9	-64.2	172.2	0	0	0	111.9	T137 C141 K142	T137-I139 PolarHBondContact O-N 3.35Å; I139-C141 PolarHBondContact O-N 3.16Å; I139-C141 VanDerWaalsContact O-N 3.13Å; I139-K142 PolarHBondContact O-N 3.09Å
140	L	88	Confident	83.6	Confident	7 Å²	7	69.6 Å²	69.6	4%	0.037	35%	0.345	C	S	.	.	G	3₁₀ helix	trans	-55.6	-31.5	177.1	178.7	60.9	0	0	0	112.7	L138 A167 Y171 V174 R183 L186	L138-L140 VanDerWaalsContact C-N 3.32Å; L138-L140 HydrophobicContact CD1-CB 4.42Å; L138-L140 HydrophobicContact CG-CB 4.23Å; L138-L140 PolarHBondContact O-N 3.15Å; L140-A167 HydrophobicContact CD2-CB 4.21Å; L140-Y171 HydrophobicContact CD1-CD2 4.22Å; L140-V174 HydrophobicContact CD1-CB 4.33Å; L140-V174 HydrophobicContact CD1-CG1 4Å; L140-V174 HydrophobicContact CD1-CG2 4.11Å; L140-R183 HydrophobicContact CD1-CG 4.43Å; L140-R183 VanDerWaalsContact O-CZ 3.25Å; L140-R183 PolarHBondContact O-NE 3.13Å; L140-R183 PolarHBondContact O-NH2 2.89Å; L140-L186 HydrophobicContact CD2-CD1 4.19Å
141	C	91.5	Very high	85.4	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-110.6	0.4	-170	-59.4	0	0	0	0	114.7	I136 L138 I139 G143 M144 C187	I136-C141 HydrophobicContact CG2-CB 3.8Å; L138-C141 HydrophobicContact CB-CB 4.46Å; L138-C141 HydrophobicContact CD2-CB 4.46Å; L138-C141 HydrophobicContact CG-CB 4.4Å; L138-C141 CarbonylContact O-C 3.38Å; L138-C141 PolarHBondContact O-N 3.08Å; I139-C141 PolarHBondContact O-N 3.16Å; I139-C141 VanDerWaalsContact O-N 3.13Å; C141-G143 PolarHBondContact O-N 3.05Å; C141-M144 HydrophobicContact CB-CG 4.3Å; C141-M144 WeakPolarHBondContact O-CB 3.26Å; C141-M144 WeakPolarHBondContact O-CG 3.33Å; C141-M144 PolarHBondContact O-N 3.42Å; C141-C187 WeakPolarHBondContact CA-SG 3.25Å; C141-C187 HydrophobicContact CB-CB 3.76Å; C141-C187 WeakPolarHBondContact CB-SG 3.13Å; C141-C187 WeakPolarHBondContact SG-CA 3.48Å; C141-C187 WeakPolarHBondContact SG-CB 3.36Å; C141-C187 CovalentContact SG-SG 2.03Å; C141-C187 PolarHBondContact SG-SG 2.68Å
142	K	87.5	Confident	86.7	Confident	100 Å²	100	63.3 Å²	63.3	44%	0.435	31%	0.314	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	130.8	171.9	-84.4	170.7	169.3	150.6	0	111.3	I136 T137 L138 I139 R183	I136-K142 VanDerWaalsContact O-CE 3.32Å; I136-K142 WeakPolarHBondContact O-CE 3.09Å; T137-K142 WeakPolarHBondContact O-CE 3.28Å; T137-K142 PolarHBondContact O-NZ 3.48Å; L138-K142 PolarHBondContact O-N 2.98Å; L138-K142 VanDerWaalsContact O-N 3.09Å; I139-K142 PolarHBondContact O-N 3.09Å; K142-R183 PolarHBondContact O-NH2 2.97Å
143	G	80.7	Confident	87.7	Confident	73 Å²	73	54.2 Å²	54.2	75%	0.753	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.9	36.4	-172.6	0	0	0	0	0	113.5	C141	C141-G143 PolarHBondContact O-N 3.05Å
144	M	84.4	Confident	87.7	Confident	22 Å²	22	55.4 Å²	55.4	11%	0.108	28%	0.283	C	S	.	.	S	Bend	trans	-75.6	169.5	156.4	-79.4	-69.4	-68.3	0	0	110.4	C141 Y146 F184 C187	C141-M144 HydrophobicContact CB-CG 4.3Å; C141-M144 WeakPolarHBondContact O-CB 3.26Å; C141-M144 WeakPolarHBondContact O-CG 3.33Å; C141-M144 PolarHBondContact O-N 3.42Å; M144-Y146 HydrophobicContact CB-CE1 4.5Å; M144-Y146 HydrophobicContact CE-CE1 3.81Å; M144-Y146 PolarHBondContact O-N 2.99Å; M144-F184 HydrophobicContact CE-CD2 3.74Å; M144-F184 HydrophobicContact CE-CE2 4.2Å; M144-F184 HydrophobicContact CE-CG 4.22Å; M144-C187 HydrophobicContact CE-CB 3.81Å; M144-C187 HydrophobicContact CG-CB 3.89Å; M144-C187 HydrophobicContact SD-CB 3.91Å
145	Y	83.1	Confident	87.6	Confident	190 Å²	190	53.6 Å²	53.6	75%	0.745	28%	0.275	S	S	*	.	S	Bend	trans	-67.6	-1.4	179.2	-57.2	-80.3	0	0	0	114.8	F184	Y145-F184 HydrophobicContact CD2-CD2 4.03Å; Y145-F184 AromaticContact CD2-CE2 3.75Å; Y145-F184 HydrophobicContact CD2-CE2 3.75Å; Y145-F184 AromaticContact CE2-CD2 3.95Å; Y145-F184 HydrophobicContact CE2-CD2 3.95Å; Y145-F184 AromaticContact CE2-CE2 3.98Å; Y145-F184 HydrophobicContact CE2-CE2 3.98Å
146	Y	85.7	Confident	87.5	Confident	19 Å²	19	56.8 Å²	56.8	8%	0.075	28%	0.282	C	S	.	.			trans	-138.4	143.3	174.7	51.3	-92.4	0	0	0	108.9	I136 M144 C187 T191 I193 M248	I136-Y146 HydrophobicContact CD1-CD2 3.8Å; I136-Y146 HydrophobicContact CD1-CE2 3.7Å; I136-Y146 WeakPolarHBondContact CD1-O 3.13Å; M144-Y146 HydrophobicContact CB-CE1 4.5Å; M144-Y146 HydrophobicContact CE-CE1 3.81Å; M144-Y146 PolarHBondContact O-N 2.99Å; Y146-C187 PolarHBondContact OH-O 3.12Å; Y146-T191 VanDerWaalsContact CE2-O 3.3Å; Y146-T191 WeakPolarHBondContact CE2-O 3.47Å; Y146-T191 PolarHBondContact OH-O 3.44Å; Y146-I193 HydrophobicContact CD1-CB 3.93Å; Y146-I193 HydrophobicContact CD1-CD1 3.97Å; Y146-I193 HydrophobicContact CD1-CG1 4.14Å; Y146-I193 HydrophobicContact CD2-CB 3.81Å; Y146-I193 HydrophobicContact CD2-CG1 4.06Å; Y146-I193 HydrophobicContact CE1-CB 4.18Å; Y146-I193 HydrophobicContact CE2-CB 4.08Å; Y146-I193 HydrophobicContact CG-CB 3.75Å; Y146-I193 HydrophobicContact CG-CD1 3.87Å; Y146-I193 HydrophobicContact CG-CG1 3.7Å; Y146-M248 HydrophobicContact CE1-CE 3.97Å; Y146-M248 HydrophobicContact CE1-SD 4.24Å
147	E	86	Confident	87.4	Confident	145 Å²	145	57.1 Å²	57.1	68%	0.678	28%	0.283	S	S	*	.	S	Bend	trans	-95.1	-17.8	-173.9	-59.8	-179	149.8	0	0	113.5	P135 I136	P135-E147 WeakPolarHBondContact CA-O 3.49Å; I136-E147 PolarHBondContact N-O 2.66Å
148	Y	89.5	Confident	87.3	Confident	111 Å²	111	61.9 Å²	61.9	44%	0.435	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.1	-171	-60.8	-96	0	0	0	112	C133 E134 C194	C133-Y148 HydrophobicContact CB-CD1 4.21Å; C133-Y148 HydrophobicContact CB-CG 4.42Å; E134-Y148 CarbonylContact O-C 3.36Å; E134-Y148 WeakPolarHBondContact O-CA 3.37Å; Y148-C194 PolarHBondContact O-N 3.03Å
149	T	90.6	Very high	87.4	Confident	0 Å²	0	64.4 Å²	64.4	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	158	175.3	-178.4	0	0	0	0	112	E134 I136 Q160 T191 P192 C194	E134-T149 HydrophobicContact CG-CG2 3.96Å; E134-T149 PolarHBondContact N-O 3.06Å; E134-T149 VanDerWaalsContact N-O 3.1Å; E134-T149 PolarHBondContact O-N 3.37Å; I136-T149 HydrophobicContact CG1-CG2 4.17Å; T149-Q160 VanDerWaalsContact CG2-CD 3.44Å; T149-Q160 HydrophobicContact CG2-CG 3.98Å; T149-Q160 VanDerWaalsContact CG2-NE2 3.32Å; T149-T191 VanDerWaalsContact OG1-CA 3.25Å; T149-T191 WeakPolarHBondContact OG1-CA 3.28Å; T149-P192 CarbonylContact C-O 3.1Å; T149-P192 WeakPolarHBondContact CA-O 3.34Å; T149-P192 WeakPolarHBondContact OG1-CD 3.25Å; T149-P192 PolarHBondContact OG1-O 2.83Å; T149-C194 WeakPolarHBondContact O-CB 3.33Å
150	R	86.7	Confident	87.6	Confident	42 Å²	42	60.7 Å²	60.7	16%	0.158	30%	0.298	C	S	.	.			trans	-111.7	128.7	172.1	165.5	-171.2	153.4	91.8	8.8	108.1	H131 P192 C194	H131-R150 PolarHBondContact CD2-NH1 3.49Å; H131-R150 PolarHBondContact CE1-NH1 3.31Å; H131-R150 VanDerWaalsContact CG-NH1 3.29Å; H131-R150 PolarHBondContact NE2-NH1 2.91Å; R150-P192 PolarHBondContact N-O 3.41Å; R150-P192 VanDerWaalsContact O-CG 3.28Å; R150-P192 WeakPolarHBondContact O-CG 3.36Å; R150-C194 HydrophobicContact CB-CB 3.94Å
151	L	87.4	Confident	87.6	Confident	22 Å²	22	65.9 Å²	65.9	12%	0.115	32%	0.322	C	S	.	.	S	Bend	trans	-116.2	156.1	166.7	-65.2	-176.8	0	0	0	111.1	E134 N153 E158 Q160	E134-L151 WeakPolarHBondContact OE1-CD1 3.39Å; L151-N153 HydrophobicContact CD2-CB 3.81Å; L151-E158 WeakPolarHBondContact CD1-O 3.3Å; L151-Q160 HydrophobicContact CD1-CG 3.92Å
152	P	88	Confident	87.6	Confident	52 Å²	52	70 Å²	70	34%	0.338	34%	0.342	S	S	.	.	S	Bend	cis	-67.2	151.4	-5.5	28.7	-35.2	0	0	0	113.2	H157	P152-H157 VanDerWaalsContact CA-O 3.28Å; P152-H157 WeakPolarHBondContact CA-O 3.33Å
153	N	88.3	Confident	87.8	Confident	6 Å²	6	65.3 Å²	65.3	3%	0.032	32%	0.321	C	S	.	.			trans	-85.3	-173.5	178.7	65.4	31.1	0	0	0	112.4	L151 F155 H156 H157 A163 Y190 P192	L151-N153 HydrophobicContact CD2-CB 3.81Å; N153-F155 PolarHBondContact O-N 3.22Å; N153-F155 VanDerWaalsContact O-N 3.14Å; N153-F155 PolarHBondContact OD1-N 3.25Å; N153-H156 PolarHBondContact O-N 3.34Å; N153-H156 PolarHBondContact OD1-N 2.7Å; N153-H157 PolarHBondContact N-O 3.37Å; N153-H157 PolarHBondContact ND2-ND1 2.95Å; N153-H157 PolarHBondContact OD1-N 3.23Å; N153-H157 PolarHBondContact OD1-ND1 2.72Å; N153-A163 WeakPolarHBondContact ND2-CB 3.42Å; N153-Y190 PolarHBondContact ND2-O 3.39Å; N153-P192 HydrophobicContact CB-CG 4.13Å
154	M	85.4	Confident	88.2	Confident	59 Å²	59	62 Å²	62	29%	0.291	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-17.5	-177.1	-159.4	178.8	80.7	0	0	113.9	I189 F201 F236	M154-I189 HydrophobicContact CB-CG2 4.45Å; M154-I189 HydrophobicContact CE-CG2 4.13Å; M154-F201 HydrophobicContact CB-CE1 4.22Å; M154-F201 HydrophobicContact CB-CE2 3.84Å; M154-F201 HydrophobicContact CB-CZ 3.68Å; M154-F201 HydrophobicContact CG-CE1 4.32Å; M154-F201 HydrophobicContact CG-CZ 4.27Å; M154-F201 HydrophobicContact SD-CE1 3.99Å; M154-F201 HydrophobicContact SD-CZ 4.2Å; M154-F236 HydrophobicContact CE-CE1 3.92Å; M154-F236 HydrophobicContact CE-CZ 4.16Å; M154-F236 HydrophobicContact SD-CE1 4.06Å
155	F	88	Confident	88.5	Confident	32 Å²	32	67.5 Å²	67.5	14%	0.14	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103	13.3	175.9	-56	-35.5	0	0	0	112.6	N153 H157 I189 Y190 R230	N153-F155 PolarHBondContact O-N 3.22Å; N153-F155 VanDerWaalsContact O-N 3.14Å; N153-F155 PolarHBondContact OD1-N 3.25Å; F155-H157 PolarHBondContact O-N 3.46Å; F155-I189 HydrophobicContact CD2-CG2 4.15Å; F155-I189 HydrophobicContact CE1-CG2 4.17Å; F155-I189 HydrophobicContact CE2-CG2 3.44Å; F155-I189 VanDerWaalsContact CE2-CG2 3.44Å; F155-I189 HydrophobicContact CZ-CG2 3.45Å; F155-I189 VanDerWaalsContact CZ-CG2 3.45Å; F155-Y190 HydrophobicContact CD2-CD1 4.03Å; F155-Y190 AromaticContact CD2-CE1 3.59Å; F155-Y190 HydrophobicContact CD2-CE1 3.59Å; F155-Y190 HydrophobicContact CE2-CD1 4.26Å; F155-Y190 AromaticContact CE2-CE1 3.66Å; F155-Y190 HydrophobicContact CE2-CE1 3.66Å; F155-Y190 HydrophobicContact CE2-CE2 4.49Å; F155-Y190 AromaticContact CE2-CZ 3.78Å; F155-R230 HydrophobicContact CD1-CB 4.49Å; F155-R230 HydrophobicContact CE1-CB 3.75Å; F155-R230 VanDerWaalsContact CE1-O 3.27Å; F155-R230 WeakPolarHBondContact CE1-O 3.21Å; F155-R230 HydrophobicContact CZ-CB 3.98Å; F155-R230 VanDerWaalsContact CZ-O 3.25Å; F155-R230 WeakPolarHBondContact CZ-O 3.44Å
156	H	87.6	Confident	88.8	Confident	150 Å²	150	59.8 Å²	59.8	69%	0.694	29%	0.287	S	S	*	.			trans	64.4	9.9	179.8	-56.7	-75.1	0	0	0	116.4	N153 E158	N153-H156 PolarHBondContact O-N 3.34Å; N153-H156 PolarHBondContact OD1-N 2.7Å; H156-E158 PolarHBondContact O-N 3.15Å
157	H	90.4	Very high	89	Confident	22 Å²	22	58.9 Å²	58.9	10%	0.102	28%	0.284	C	S	.	.			trans	-59.7	128.6	172.6	-53.6	124.4	0	0	0	110.4	P152 N153 F155 E162 A163 E166	P152-H157 VanDerWaalsContact CA-O 3.28Å; P152-H157 WeakPolarHBondContact CA-O 3.33Å; N153-H157 PolarHBondContact N-O 3.37Å; N153-H157 PolarHBondContact ND2-ND1 2.95Å; N153-H157 PolarHBondContact OD1-N 3.23Å; N153-H157 PolarHBondContact OD1-ND1 2.72Å; F155-H157 PolarHBondContact O-N 3.46Å; H157-E162 WeakPolarHBondContact CA-OE2 3.29Å; H157-E162 HydrophobicContact CB-CB 4.43Å; H157-E162 HydrophobicContact CB-CG 4.11Å; H157-E162 WeakPolarHBondContact CB-OE2 3.2Å; H157-E162 IonicContact CD2-OE1 3.86Å; H157-A163 HydrophobicContact CB-CB 3.98Å; H157-E166 IonicContact CE1-OE2 2.77Å; H157-E166 PolarHBondContact CE1-OE2 2.93Å; H157-E166 VanDerWaalsContact CE1-OE2 3.31Å; H157-E166 IonicContact NE2-OE2 3.33Å
158	E	87.9	Confident	89	Confident	156 Å²	156	55.6 Å²	55.6	73%	0.729	27%	0.268	S	S	*	.			trans	-88.9	-19.8	-175	-65.6	-172.7	169.6	0	0	112.4	L151 H156 E162	L151-E158 WeakPolarHBondContact CD1-O 3.3Å; H156-E158 PolarHBondContact O-N 3.15Å; E158-E162 PolarHBondContact N-OE2 3.02Å
159	T	90.9	Very high	89	Confident	62 Å²	62	57.1 Å²	57.1	38%	0.38	28%	0.279	S	S	.	.	S	Bend	trans	-126.6	154.9	-179.5	65.3	0	0	0	0	112.5	E161 E162 A163	T159-E161 VanDerWaalsContact C-N 3.25Å; T159-E161 PolarHBondContact O-N 3.47Å; T159-E162 WeakPolarHBondContact OG1-CB 3.4Å; T159-E162 PolarHBondContact OG1-N 2.82Å; T159-A163 PolarHBondContact O-N 3.02Å; T159-A163 VanDerWaalsContact O-N 3.11Å
160	Q	91.1	Very high	89	Confident	4 Å²	4	58 Å²	58	2%	0.019	28%	0.283	C	S	.	.	H	α-helix	trans	-72.6	-22.9	175.1	-77.7	-174.7	72.9	0	0	112.6	E134 P135 I136 T137 T149 L151 G164 T191	E134-Q160 WeakPolarHBondContact OE1-CG 3.42Å; E134-Q160 PolarHBondContact OE1-NE2 3.43Å; P135-Q160 PolarHBondContact O-NE2 3.23Å; I136-Q160 VanDerWaalsContact CA-OE1 3.27Å; T137-Q160 VanDerWaalsContact OG1-CB 3.26Å; T137-Q160 WeakPolarHBondContact OG1-CB 3.42Å; T137-Q160 PolarHBondContact OG1-OE1 3Å; T149-Q160 VanDerWaalsContact CG2-CD 3.44Å; T149-Q160 HydrophobicContact CG2-CG 3.98Å; T149-Q160 VanDerWaalsContact CG2-NE2 3.32Å; L151-Q160 HydrophobicContact CD1-CG 3.92Å; Q160-G164 VanDerWaalsContact O-CA 3.32Å; Q160-G164 WeakPolarHBondContact O-CA 3.43Å; Q160-G164 PolarHBondContact O-N 2.99Å; Q160-T191 HydrophobicContact CG-CG2 4.42Å
161	E	89.6	Confident	89.1	Confident	116 Å²	116	60.3 Å²	60.3	54%	0.542	29%	0.293	S	S	.	.	H	α-helix	trans	-68.6	-46	176	-68.3	60.7	-136.7	0	0	109.8	T137 T159 G164 L165	T137-E161 PolarHBondContact OG1-OE1 2.97Å; T159-E161 VanDerWaalsContact C-N 3.25Å; T159-E161 PolarHBondContact O-N 3.47Å; E161-G164 PolarHBondContact O-N 3.43Å; E161-L165 WeakPolarHBondContact O-CG 3.46Å; E161-L165 PolarHBondContact O-N 2.8Å
162	E	91.5	Very high	89.1	Confident	88 Å²	88	62.8 Å²	62.8	41%	0.411	31%	0.31	S	S	.	.	H	α-helix	trans	-62.9	-53.8	173.4	-176.7	-173.3	-158.7	0	0	111.9	H157 E158 T159 G164 L165	H157-E162 WeakPolarHBondContact CA-OE2 3.29Å; H157-E162 HydrophobicContact CB-CB 4.43Å; H157-E162 HydrophobicContact CB-CG 4.11Å; H157-E162 WeakPolarHBondContact CB-OE2 3.2Å; H157-E162 IonicContact CD2-OE1 3.86Å; E158-E162 PolarHBondContact N-OE2 3.02Å; T159-E162 WeakPolarHBondContact OG1-CB 3.4Å; T159-E162 PolarHBondContact OG1-N 2.82Å; E162-G164 PolarHBondContact O-N 3.41Å; E162-L165 PolarHBondContact O-N 3.07Å
163	A	91.3	Very high	89.3	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.4	-31	175.3	0	0	0	0	0	112.3	N153 H157 T159 A167 Y190	N153-A163 WeakPolarHBondContact ND2-CB 3.42Å; H157-A163 HydrophobicContact CB-CB 3.98Å; T159-A163 PolarHBondContact O-N 3.02Å; T159-A163 VanDerWaalsContact O-N 3.11Å; A163-A167 VanDerWaalsContact O-CB 3.27Å; A163-A167 WeakPolarHBondContact O-CB 3.5Å; A163-A167 PolarHBondContact O-N 3.27Å; A163-Y190 HydrophobicContact CB-CD1 4.38Å
164	G	89.7	Confident	89.3	Confident	4 Å²	4	62.7 Å²	62.7	4%	0.041	31%	0.307	C	S	.	.	H	α-helix	trans	-70.4	-40.7	177.8	0	0	0	0	0	113.7	L138 Q160 E161 E162 E166 A167 H168	L138-G164 VanDerWaalsContact CD1-CA 3.48Å; Q160-G164 VanDerWaalsContact O-CA 3.32Å; Q160-G164 WeakPolarHBondContact O-CA 3.43Å; Q160-G164 PolarHBondContact O-N 2.99Å; E161-G164 PolarHBondContact O-N 3.43Å; E162-G164 PolarHBondContact O-N 3.41Å; G164-E166 VanDerWaalsContact C-N 3.26Å; G164-E166 PolarHBondContact O-N 2.89Å; G164-A167 PolarHBondContact O-N 2.86Å; G164-H168 VanDerWaalsContact O-CB 3.31Å; G164-H168 WeakPolarHBondContact O-CB 3.31Å; G164-H168 PolarHBondContact O-CD2 3.18Å; G164-H168 VanDerWaalsContact O-CD2 3.25Å; G164-H168 PolarHBondContact O-N 3.27Å
165	L	89.7	Confident	89.4	Confident	137 Å²	137	66.4 Å²	66.4	72%	0.717	32%	0.324	S	S	*	.	H	α-helix	trans	-58.9	-37.8	177.2	-74.4	168.3	0	0	0	112	E161 E162	E161-L165 WeakPolarHBondContact O-CG 3.46Å; E161-L165 PolarHBondContact O-N 2.8Å; E162-L165 PolarHBondContact O-N 3.07Å
166	E	89.9	Confident	89.3	Confident	28 Å²	28	69.5 Å²	69.5	13%	0.131	34%	0.341	C	S	.	.	H	α-helix	trans	-76.4	-48.5	174	-155.1	-162.2	141.1	0	0	111.8	H157 G164 H168 Q169 Y190 R230	H157-E166 IonicContact CE1-OE2 2.77Å; H157-E166 PolarHBondContact CE1-OE2 2.93Å; H157-E166 VanDerWaalsContact CE1-OE2 3.31Å; H157-E166 IonicContact NE2-OE2 3.33Å; G164-E166 VanDerWaalsContact C-N 3.26Å; G164-E166 PolarHBondContact O-N 2.89Å; E166-H168 PolarHBondContact O-N 2.88Å; E166-Q169 WeakPolarHBondContact O-CB 3.46Å; E166-Q169 WeakPolarHBondContact O-CG 3.24Å; E166-Q169 PolarHBondContact O-N 3.3Å; E166-Y190 HydrophobicContact CB-CE1 3.86Å; E166-Y190 HydrophobicContact CG-CE1 4.13Å; E166-Y190 PolarHBondContact OE1-OH 3.25Å; E166-R230 VanDerWaalsContact CD-NH1 3.31Å; E166-R230 VanDerWaalsContact CD-NH2 3.29Å; E166-R230 IonicContact OE1-CZ 3.14Å; E166-R230 VanDerWaalsContact OE1-CZ 3.28Å; E166-R230 IonicContact OE1-NH1 3.89Å; E166-R230 PolarHBondContact OE1-NH1 3.47Å; E166-R230 VanDerWaalsContact OE1-NH1 3.08Å; E166-R230 IonicContact OE1-NH2 3.96Å; E166-R230 PolarHBondContact OE1-NH2 3.3Å; E166-R230 IonicContact OE2-CZ 3.39Å; E166-R230 IonicContact OE2-NH1 2.96Å; E166-R230 PolarHBondContact OE2-NH1 3.33Å; E166-R230 IonicContact OE2-NH2 2.84Å; E166-R230 PolarHBondContact OE2-NH2 3.32Å
167	A	89.2	Confident	89.4	Confident	0 Å²	0	67.1 Å²	67.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-59.2	-31.4	-179.2	0	0	0	0	0	113.4	L138 L140 A163 G164 Q169 F170 Y190	L138-A167 HydrophobicContact CD2-CB 3.87Å; L140-A167 HydrophobicContact CD2-CB 4.21Å; A163-A167 VanDerWaalsContact O-CB 3.27Å; A163-A167 WeakPolarHBondContact O-CB 3.5Å; A163-A167 PolarHBondContact O-N 3.27Å; G164-A167 PolarHBondContact O-N 2.86Å; A167-Q169 PolarHBondContact O-N 3.23Å; A167-F170 PolarHBondContact O-N 3.34Å; A167-Y190 HydrophobicContact CB-CD1 4.33Å; A167-Y190 HydrophobicContact CB-CD2 3.67Å; A167-Y190 HydrophobicContact CB-CE2 4.04Å; A167-Y190 HydrophobicContact CB-CG 3.85Å
168	H	86.9	Confident	89.4	Confident	77 Å²	77	67.1 Å²	67.1	36%	0.356	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-65.1	-20.1	176.3	-95.8	-79.2	0	0	0	113.9	G164 E166 F170 Y171	G164-H168 VanDerWaalsContact O-CB 3.31Å; G164-H168 WeakPolarHBondContact O-CB 3.31Å; G164-H168 PolarHBondContact O-CD2 3.18Å; G164-H168 VanDerWaalsContact O-CD2 3.25Å; G164-H168 PolarHBondContact O-N 3.27Å; E166-H168 PolarHBondContact O-N 2.88Å; H168-F170 PolarHBondContact O-N 3.03Å; H168-Y171 WeakPolarHBondContact O-CB 3.47Å; H168-Y171 PolarHBondContact O-N 3.26Å
169	Q	89.1	Confident	89.6	Confident	142 Å²	142	60.4 Å²	60.4	66%	0.664	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-65.8	-29.3	175.4	-59	-178.8	15.6	0	0	112	E166 A167 Y171 P172	E166-Q169 WeakPolarHBondContact O-CB 3.46Å; E166-Q169 WeakPolarHBondContact O-CG 3.24Å; E166-Q169 PolarHBondContact O-N 3.3Å; A167-Q169 PolarHBondContact O-N 3.23Å; Q169-Y171 VanDerWaalsContact C-N 3.3Å; Q169-Y171 PolarHBondContact O-N 3.33Å; Q169-P172 WeakPolarHBondContact O-CD 3.48Å
170	F	90.3	Very high	89.4	Confident	18 Å²	18	63.3 Å²	63.3	8%	0.079	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-82.9	-2.9	177.5	-60.9	-91.2	0	0	0	113.6	A167 H168 P172 L173 V174 L186 Y190 P228 M231	A167-F170 PolarHBondContact O-N 3.34Å; H168-F170 PolarHBondContact O-N 3.03Å; F170-P172 VanDerWaalsContact C-CD 3.47Å; F170-L173 HydrophobicContact CD1-CD1 4.22Å; F170-L173 PolarHBondContact O-N 2.91Å; F170-L173 VanDerWaalsContact O-N 3.08Å; F170-V174 PolarHBondContact O-N 3.3Å; F170-V174 VanDerWaalsContact O-N 3.08Å; F170-L186 HydrophobicContact CB-CD1 3.58Å; F170-L186 HydrophobicContact CB-CD2 3.98Å; F170-L186 HydrophobicContact CB-CG 4.46Å; F170-L186 HydrophobicContact CD1-CD2 3.98Å; F170-L186 HydrophobicContact CD2-CD2 3.84Å; F170-L186 HydrophobicContact CE1-CD2 4.45Å; F170-L186 HydrophobicContact CE2-CD2 4.33Å; F170-L186 HydrophobicContact CG-CD1 4.21Å; F170-L186 HydrophobicContact CG-CD2 3.65Å; F170-Y190 HydrophobicContact CE2-CE2 4.39Å; F170-Y190 WeakPolarHBondContact CE2-OH 3.44Å; F170-P228 HydrophobicContact CE1-CG 4.34Å; F170-P228 HydrophobicContact CZ-CG 4.23Å; F170-M231 HydrophobicContact CE1-CE 4.2Å; F170-M231 HydrophobicContact CE1-SD 4.25Å; F170-M231 HydrophobicContact CE2-CE 3.84Å; F170-M231 HydrophobicContact CZ-CE 3.59Å; F170-M231 HydrophobicContact CZ-SD 4.14Å
171	Y	89.8	Confident	89.4	Confident	92 Å²	92	63.3 Å²	63.3	36%	0.361	31%	0.314	S	S	.	.	H	α-helix	trans	-55.4	-39.7	-177.4	-167.2	-95.1	0	0	0	113.9	L140 H168 Q169 L173 V174 Q175	L140-Y171 HydrophobicContact CD1-CD2 4.22Å; H168-Y171 WeakPolarHBondContact O-CB 3.47Å; H168-Y171 PolarHBondContact O-N 3.26Å; Q169-Y171 VanDerWaalsContact C-N 3.3Å; Q169-Y171 PolarHBondContact O-N 3.33Å; Y171-L173 PolarHBondContact O-N 3.14Å; Y171-V174 PolarHBondContact O-N 3.47Å; Y171-Q175 HydrophobicContact CD1-CG 4.15Å; Y171-Q175 VanDerWaalsContact CE1-CD 3.48Å; Y171-Q175 HydrophobicContact CE1-CG 3.95Å; Y171-Q175 WeakPolarHBondContact O-CG 3.39Å; Y171-Q175 PolarHBondContact O-N 3.08Å
172	P	87.5	Confident	89.6	Confident	73 Å²	73	58 Å²	58	47%	0.474	29%	0.289	S	S	.	.	H	α-helix	trans	-63.1	-39.6	174.5	-22.7	35.3	0	0	0	113.4	Q169 F170 V174 Q175 I176	Q169-P172 WeakPolarHBondContact O-CD 3.48Å; F170-P172 VanDerWaalsContact C-CD 3.47Å; P172-V174 VanDerWaalsContact C-N 3.31Å; P172-V174 PolarHBondContact O-N 2.86Å; P172-Q175 PolarHBondContact O-N 2.92Å; P172-I176 WeakPolarHBondContact O-CB 3.31Å; P172-I176 WeakPolarHBondContact O-CD1 3.43Å; P172-I176 VanDerWaalsContact O-CG1 3.27Å; P172-I176 WeakPolarHBondContact O-CG1 3.39Å; P172-I176 PolarHBondContact O-N 3.37Å
173	L	90.3	Very high	89.6	Confident	25 Å²	25	58 Å²	58	13%	0.131	29%	0.285	C	S	.	.	H	α-helix	trans	-67.1	-33.6	177.1	-67.6	169.5	0	0	0	111.7	F170 Y171 N177 L182 I219 M220	F170-L173 HydrophobicContact CD1-CD1 4.22Å; F170-L173 PolarHBondContact O-N 2.91Å; F170-L173 VanDerWaalsContact O-N 3.08Å; Y171-L173 PolarHBondContact O-N 3.14Å; L173-N177 PolarHBondContact O-N 2.88Å; L173-L182 HydrophobicContact CB-CD2 3.65Å; L173-I219 HydrophobicContact CD2-CG2 3.94Å; L173-M220 HydrophobicContact CD1-CG 3.76Å; L173-M220 HydrophobicContact CD1-SD 3.79Å; L173-M220 HydrophobicContact CD2-CG 4.24Å
174	V	89.7	Confident	89.6	Confident	31 Å²	31	58.8 Å²	58.8	19%	0.188	29%	0.288	C	S	.	.	H	α-helix	trans	-69.3	-36.9	172.6	175.8	0	0	0	0	111.5	L140 F170 Y171 P172 N177 L182 R183 L186	L140-V174 HydrophobicContact CD1-CB 4.33Å; L140-V174 HydrophobicContact CD1-CG1 4Å; L140-V174 HydrophobicContact CD1-CG2 4.11Å; F170-V174 PolarHBondContact O-N 3.3Å; F170-V174 VanDerWaalsContact O-N 3.08Å; Y171-V174 PolarHBondContact O-N 3.47Å; P172-V174 VanDerWaalsContact C-N 3.31Å; P172-V174 PolarHBondContact O-N 2.86Å; V174-N177 PolarHBondContact O-N 3.35Å; V174-L182 HydrophobicContact CB-CD2 4.46Å; V174-L182 HydrophobicContact CG2-CD2 3.65Å; V174-L182 HydrophobicContact CG2-CG 3.89Å; V174-R183 HydrophobicContact CG1-CB 4.24Å; V174-R183 HydrophobicContact CG1-CG 4.48Å; V174-L186 HydrophobicContact CG2-CD1 3.66Å
175	Q	87	Confident	89.8	Confident	138 Å²	138	58.6 Å²	58.6	65%	0.645	29%	0.287	S	S	*	.	H	α-helix	trans	-69.2	-37.9	172.9	-71.3	-172.8	-51.8	0	0	112.9	Y171 P172 N177	Y171-Q175 HydrophobicContact CD1-CG 4.15Å; Y171-Q175 VanDerWaalsContact CE1-CD 3.48Å; Y171-Q175 HydrophobicContact CE1-CG 3.95Å; Y171-Q175 WeakPolarHBondContact O-CG 3.39Å; Y171-Q175 PolarHBondContact O-N 3.08Å; P172-Q175 PolarHBondContact O-N 2.92Å; Q175-N177 PolarHBondContact O-N 2.97Å
176	I	87	Confident	89.9	Confident	97 Å²	97	52.1 Å²	52.1	50%	0.497	25%	0.253	S	S	.	.	H	α-helix	trans	-66.5	-21.9	171.7	-68.4	163	0	0	0	111.2	P172 C178 I219	P172-I176 WeakPolarHBondContact O-CB 3.31Å; P172-I176 WeakPolarHBondContact O-CD1 3.43Å; P172-I176 VanDerWaalsContact O-CG1 3.27Å; P172-I176 WeakPolarHBondContact O-CG1 3.39Å; P172-I176 PolarHBondContact O-N 3.37Å; I176-C178 VanDerWaalsContact C-N 3.29Å; I176-C178 HydrophobicContact CG2-CB 4.42Å; I176-C178 PolarHBondContact O-N 3.5Å; I176-I219 HydrophobicContact CG2-CD1 4.25Å
177	N	88.4	Confident	90.1	Very high	99 Å²	99	50.8 Å²	50.8	53%	0.529	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.2	42.8	-180	-170.8	37.3	0	0	0	112.6	L173 V174 Q175 S179	L173-N177 PolarHBondContact O-N 2.88Å; V174-N177 PolarHBondContact O-N 3.35Å; Q175-N177 PolarHBondContact O-N 2.97Å; N177-S179 PolarHBondContact O-N 3.31Å; N177-S179 VanDerWaalsContact O-N 3.09Å
178	C	90.8	Very high	90.1	Very high	23 Å²	23	50.9 Å²	50.9	16%	0.155	25%	0.247	C	C	.	.	S	Bend	trans	-58.7	-22.1	-179.3	54.7	0	0	0	0	113.7	I176 G215 C216 I219	I176-C178 VanDerWaalsContact C-N 3.29Å; I176-C178 HydrophobicContact CG2-CB 4.42Å; I176-C178 PolarHBondContact O-N 3.5Å; C178-G215 CarbonylContact O-C 3.41Å; C178-G215 WeakPolarHBondContact O-CA 3.49Å; C178-C216 VanDerWaalsContact C-SG 3.56Å; C178-C216 HydrophobicContact CB-CB 3.95Å; C178-C216 WeakPolarHBondContact CB-SG 3.49Å; C178-C216 WeakPolarHBondContact SG-CB 3.19Å; C178-C216 CovalentContact SG-SG 2.04Å; C178-C216 PolarHBondContact SG-SG 3.29Å; C178-I219 HydrophobicContact CB-CD1 3.61Å
179	S	91.9	Very high	90.4	Very high	15 Å²	15	47.2 Å²	47.2	11%	0.105	23%	0.23	C	C	.	.			trans	-149.7	135.6	162.3	-176.2	0	0	0	0	109.8	N177 D181 L182 R211	N177-S179 PolarHBondContact O-N 3.31Å; N177-S179 VanDerWaalsContact O-N 3.09Å; S179-D181 PolarHBondContact O-N 3.15Å; S179-D181 VanDerWaalsContact O-N 3.09Å; S179-D181 PolarHBondContact OG-N 2.84Å; S179-L182 VanDerWaalsContact O-CB 3.29Å; S179-L182 WeakPolarHBondContact O-CB 3.49Å; S179-L182 PolarHBondContact O-N 3.08Å; S179-R211 PolarHBondContact OG-O 3.29Å; S179-R211 VanDerWaalsContact OG-O 3.09Å
180	K	87.7	Confident	90.5	Very high	122 Å²	122	40.4 Å²	40.4	53%	0.53	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.5	-29.6	173.2	-63.8	168.9	179	166.7	0	112	E256	K180-E256 WeakPolarHBondContact CD-OE1 3.33Å; K180-E256 WeakPolarHBondContact CE-OE1 3.45Å; K180-E256 IonicContact NZ-OE1 2.66Å; K180-E256 PolarHBondContact NZ-OE1 3.46Å
181	D	90.6	Very high	90.6	Very high	5 Å²	5	39.6 Å²	39.6	3%	0.027	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-10.8	-179.2	-72.7	-67.7	0	0	0	113.5	S179 R183 F184 L185 I208 R211 V212 R250	S179-D181 PolarHBondContact O-N 3.15Å; S179-D181 VanDerWaalsContact O-N 3.09Å; S179-D181 PolarHBondContact OG-N 2.84Å; D181-R183 PolarHBondContact O-N 3.09Å; D181-F184 WeakPolarHBondContact O-CB 3.46Å; D181-F184 PolarHBondContact O-N 2.8Å; D181-L185 PolarHBondContact O-N 2.83Å; D181-I208 HydrophobicContact CB-CG2 4.01Å; D181-R211 IonicContact OD1-CZ 2.69Å; D181-R211 IonicContact OD1-NE 3.87Å; D181-R211 IonicContact OD1-NH2 2.73Å; D181-R211 PolarHBondContact OD1-NH2 3.1Å; D181-R211 IonicContact OD2-CZ 2.77Å; D181-R211 IonicContact OD2-NE 3.54Å; D181-R211 PolarHBondContact OD2-NE 3.32Å; D181-R211 IonicContact OD2-NH2 3.39Å; D181-R211 PolarHBondContact OD2-NH2 3.41Å; D181-V212 HydrophobicContact CB-CG2 3.56Å; D181-R250 IonicContact OD1-CZ 2.88Å; D181-R250 IonicContact OD1-NE 3.89Å; D181-R250 PolarHBondContact OD1-NE 3.46Å; D181-R250 IonicContact OD1-NH2 3.75Å; D181-R250 PolarHBondContact OD1-NH2 3.35Å; D181-R250 IonicContact OD2-CZ 3.46Å; D181-R250 IonicContact OD2-NE 3.72Å; D181-R250 IonicContact OD2-NH2 3.12Å; D181-R250 PolarHBondContact OD2-NH2 2.94Å; D181-R250 VanDerWaalsContact OD2-NH2 3.14Å
182	L	93.1	Very high	90.7	Very high	5 Å²	5	35.3 Å²	35.3	3%	0.026	18%	0.178	C	C	.	.	H	α-helix	trans	-60.5	-51.9	-173.7	174	63.5	0	0	0	112.2	L173 V174 S179 F184 L185 L186 V212	L173-L182 HydrophobicContact CB-CD2 3.65Å; V174-L182 HydrophobicContact CB-CD2 4.46Å; V174-L182 HydrophobicContact CG2-CD2 3.65Å; V174-L182 HydrophobicContact CG2-CG 3.89Å; S179-L182 VanDerWaalsContact O-CB 3.29Å; S179-L182 WeakPolarHBondContact O-CB 3.49Å; S179-L182 PolarHBondContact O-N 3.08Å; L182-F184 PolarHBondContact O-N 3.41Å; L182-L185 PolarHBondContact O-N 3.23Å; L182-L186 HydrophobicContact CD1-CD1 3.79Å; L182-L186 HydrophobicContact CD1-CD2 4.43Å; L182-L186 HydrophobicContact CD1-CG 3.93Å; L182-L186 HydrophobicContact CG-CD1 3.84Å; L182-L186 HydrophobicContact CG-CG 4.4Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.47Å; L182-V212 HydrophobicContact CB-CG1 3.92Å; L182-V212 HydrophobicContact CB-CG2 4.49Å; L182-V212 HydrophobicContact CD1-CG1 3.46Å; L182-V212 VanDerWaalsContact CD1-CG1 3.46Å; L182-V212 HydrophobicContact CG-CG1 4.27Å
183	R	92	Very high	90.8	Very high	86 Å²	86	33.7 Å²	33.7	33%	0.325	17%	0.165	S	C	.	.	H	α-helix	trans	-57.4	-39.9	178.7	-173.9	-175.3	-176.4	-130	-1.7	111.1	L140 K142 V174 D181 C187	L140-R183 HydrophobicContact CD1-CG 4.43Å; L140-R183 VanDerWaalsContact O-CZ 3.25Å; L140-R183 PolarHBondContact O-NE 3.13Å; L140-R183 PolarHBondContact O-NH2 2.89Å; K142-R183 PolarHBondContact O-NH2 2.97Å; V174-R183 HydrophobicContact CG1-CB 4.24Å; V174-R183 HydrophobicContact CG1-CG 4.48Å; D181-R183 PolarHBondContact O-N 3.09Å; R183-C187 WeakPolarHBondContact O-CB 3.24Å; R183-C187 PolarHBondContact O-N 3.3Å; R183-C187 VanDerWaalsContact O-N 3.14Å; R183-C187 PolarHBondContact O-SG 3.47Å
184	F	91.3	Very high	90.7	Very high	17 Å²	17	33.7 Å²	33.7	8%	0.075	17%	0.167	C	C	.	.	H	α-helix	trans	-66	-46.6	178.9	-172.6	-83.2	0	0	0	111.5	M144 Y145 D181 L182 S188 I208 M248	M144-F184 HydrophobicContact CE-CD2 3.74Å; M144-F184 HydrophobicContact CE-CE2 4.2Å; M144-F184 HydrophobicContact CE-CG 4.22Å; Y145-F184 HydrophobicContact CD2-CD2 4.03Å; Y145-F184 AromaticContact CD2-CE2 3.75Å; Y145-F184 HydrophobicContact CD2-CE2 3.75Å; Y145-F184 AromaticContact CE2-CD2 3.95Å; Y145-F184 HydrophobicContact CE2-CD2 3.95Å; Y145-F184 AromaticContact CE2-CE2 3.98Å; Y145-F184 HydrophobicContact CE2-CE2 3.98Å; D181-F184 WeakPolarHBondContact O-CB 3.46Å; D181-F184 PolarHBondContact O-N 2.8Å; L182-F184 PolarHBondContact O-N 3.41Å; F184-S188 WeakPolarHBondContact O-CB 3.05Å; F184-S188 PolarHBondContact O-N 3.12Å; F184-S188 PolarHBondContact O-OG 3.29Å; F184-I208 HydrophobicContact CD1-CD1 3.56Å; F184-I208 HydrophobicContact CD1-CG2 4.39Å; F184-I208 HydrophobicContact CE1-CD1 3.33Å; F184-I208 HydrophobicContact CZ-CD1 4.41Å; F184-M248 HydrophobicContact CE1-CE 3.82Å; F184-M248 HydrophobicContact CE1-CG 4.22Å; F184-M248 HydrophobicContact CE1-SD 4.44Å; F184-M248 HydrophobicContact CZ-CE 3.69Å; F184-M248 HydrophobicContact CZ-CG 3.8Å; F184-M248 HydrophobicContact CZ-SD 3.81Å
185	L	93.1	Very high	90.3	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.005	18%	0.177	C	C	.	.	H	α-helix	trans	-58.9	-51.9	177.6	-175.8	72	0	0	0	111.4	D181 L182 C187 S188 I189 P204 I208 C209 V212	D181-L185 PolarHBondContact O-N 2.83Å; L182-L185 PolarHBondContact O-N 3.23Å; L185-C187 PolarHBondContact O-N 3.42Å; L185-S188 PolarHBondContact O-N 3.21Å; L185-I189 HydrophobicContact CD1-CD1 4.09Å; L185-I189 HydrophobicContact CG-CD1 3.96Å; L185-I189 WeakPolarHBondContact O-CD1 3.47Å; L185-I189 WeakPolarHBondContact O-CG1 3.21Å; L185-I189 PolarHBondContact O-N 3.49Å; L185-P204 HydrophobicContact CD1-CB 3.87Å; L185-P204 HydrophobicContact CD1-CG 3.7Å; L185-I208 HydrophobicContact CB-CG2 4.07Å; L185-I208 HydrophobicContact CD1-CB 4.47Å; L185-I208 HydrophobicContact CD1-CG2 4Å; L185-C209 HydrophobicContact CD1-CB 4.06Å; L185-C209 HydrophobicContact CD2-CB 4.39Å; L185-V212 HydrophobicContact CB-CG2 4.03Å; L185-V212 HydrophobicContact CD2-CB 3.82Å; L185-V212 HydrophobicContact CD2-CG1 3.91Å; L185-V212 HydrophobicContact CD2-CG2 3.95Å
186	L	93	Very high	89.9	Confident	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-56.4	-52.6	-179.7	-67.6	168.1	0	0	0	111.3	L140 F170 V174 L182 S188 I189 Y190 M231	L140-L186 HydrophobicContact CD2-CD1 4.19Å; F170-L186 HydrophobicContact CB-CD1 3.58Å; F170-L186 HydrophobicContact CB-CD2 3.98Å; F170-L186 HydrophobicContact CB-CG 4.46Å; F170-L186 HydrophobicContact CD1-CD2 3.98Å; F170-L186 HydrophobicContact CD2-CD2 3.84Å; F170-L186 HydrophobicContact CE1-CD2 4.45Å; F170-L186 HydrophobicContact CE2-CD2 4.33Å; F170-L186 HydrophobicContact CG-CD1 4.21Å; F170-L186 HydrophobicContact CG-CD2 3.65Å; V174-L186 HydrophobicContact CG2-CD1 3.66Å; L182-L186 HydrophobicContact CD1-CD1 3.79Å; L182-L186 HydrophobicContact CD1-CD2 4.43Å; L182-L186 HydrophobicContact CD1-CG 3.93Å; L182-L186 HydrophobicContact CG-CD1 3.84Å; L182-L186 HydrophobicContact CG-CG 4.4Å; L182-L186 WeakPolarHBondContact O-CG 3.47Å; L182-L186 PolarHBondContact O-N 3.47Å; L186-S188 VanDerWaalsContact C-N 3.29Å; L186-S188 PolarHBondContact O-N 3.02Å; L186-I189 PolarHBondContact O-N 3.37Å; L186-I189 VanDerWaalsContact O-N 3.09Å; L186-Y190 HydrophobicContact CB-CD2 4.44Å; L186-Y190 HydrophobicContact CD2-CD2 4.5Å; L186-Y190 HydrophobicContact CD2-CE2 3.96Å; L186-Y190 VanDerWaalsContact O-CD2 3.31Å; L186-Y190 WeakPolarHBondContact O-CD2 3.32Å; L186-Y190 PolarHBondContact O-N 3.15Å; L186-M231 HydrophobicContact CD2-CE 3.79Å; L186-M231 HydrophobicContact CD2-SD 4.34Å
187	C	92.9	Very high	89.2	Confident	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-65.1	-33.1	-179	-63.4	0	0	0	0	112.8	C141 M144 Y146 R183 L185 I189 T191	C141-C187 WeakPolarHBondContact CA-SG 3.25Å; C141-C187 HydrophobicContact CB-CB 3.76Å; C141-C187 WeakPolarHBondContact CB-SG 3.13Å; C141-C187 WeakPolarHBondContact SG-CA 3.48Å; C141-C187 WeakPolarHBondContact SG-CB 3.36Å; C141-C187 CovalentContact SG-SG 2.03Å; C141-C187 PolarHBondContact SG-SG 2.68Å; M144-C187 HydrophobicContact CE-CB 3.81Å; M144-C187 HydrophobicContact CG-CB 3.89Å; M144-C187 HydrophobicContact SD-CB 3.91Å; Y146-C187 PolarHBondContact OH-O 3.12Å; R183-C187 WeakPolarHBondContact O-CB 3.24Å; R183-C187 PolarHBondContact O-N 3.3Å; R183-C187 VanDerWaalsContact O-N 3.14Å; R183-C187 PolarHBondContact O-SG 3.47Å; L185-C187 PolarHBondContact O-N 3.42Å; C187-I189 PolarHBondContact O-N 2.89Å; C187-T191 CarbonylContact O-C 3.53Å; C187-T191 WeakPolarHBondContact O-CA 3.36Å; C187-T191 PolarHBondContact O-N 3.25Å; C187-T191 PolarHBondContact O-OG1 3.33Å
188	S	90.8	Very high	88.6	Confident	1 Å²	1	36.6 Å²	36.6	1%	0.007	19%	0.192	C	C	.	.	H	α-helix	trans	-67.1	-18.5	175.5	-55.6	0	0	0	0	113.9	F184 L185 L186 M248	F184-S188 WeakPolarHBondContact O-CB 3.05Å; F184-S188 PolarHBondContact O-N 3.12Å; F184-S188 PolarHBondContact O-OG 3.29Å; L185-S188 PolarHBondContact O-N 3.21Å; L186-S188 VanDerWaalsContact C-N 3.29Å; L186-S188 PolarHBondContact O-N 3.02Å; S188-M248 WeakPolarHBondContact OG-CE 3.4Å
189	I	92	Very high	87.6	Confident	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-101.3	-49.2	-179.7	-59.7	161.9	0	0	0	110.9	M154 F155 L185 L186 C187 P204 F236	M154-I189 HydrophobicContact CB-CG2 4.45Å; M154-I189 HydrophobicContact CE-CG2 4.13Å; F155-I189 HydrophobicContact CD2-CG2 4.15Å; F155-I189 HydrophobicContact CE1-CG2 4.17Å; F155-I189 HydrophobicContact CE2-CG2 3.44Å; F155-I189 VanDerWaalsContact CE2-CG2 3.44Å; F155-I189 HydrophobicContact CZ-CG2 3.45Å; F155-I189 VanDerWaalsContact CZ-CG2 3.45Å; L185-I189 HydrophobicContact CD1-CD1 4.09Å; L185-I189 HydrophobicContact CG-CD1 3.96Å; L185-I189 WeakPolarHBondContact O-CD1 3.47Å; L185-I189 WeakPolarHBondContact O-CG1 3.21Å; L185-I189 PolarHBondContact O-N 3.49Å; L186-I189 PolarHBondContact O-N 3.37Å; L186-I189 VanDerWaalsContact O-N 3.09Å; C187-I189 PolarHBondContact O-N 2.89Å; I189-P204 HydrophobicContact CD1-CG 4.46Å; I189-P204 HydrophobicContact CG1-CG 4.06Å; I189-F236 HydrophobicContact CD1-CE1 4.3Å; I189-F236 HydrophobicContact CD1-CE2 4.33Å; I189-F236 HydrophobicContact CD1-CZ 3.58Å; I189-F236 HydrophobicContact CG1-CE1 4.28Å; I189-F236 HydrophobicContact CG1-CZ 4.05Å
190	Y	92.7	Very high	86.6	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-79.4	-33.6	-177.7	-68.3	-73.7	0	0	0	113.6	N153 F155 A163 E166 A167 F170 L186 M231	N153-Y190 PolarHBondContact ND2-O 3.39Å; F155-Y190 HydrophobicContact CD2-CD1 4.03Å; F155-Y190 AromaticContact CD2-CE1 3.59Å; F155-Y190 HydrophobicContact CD2-CE1 3.59Å; F155-Y190 HydrophobicContact CE2-CD1 4.26Å; F155-Y190 AromaticContact CE2-CE1 3.66Å; F155-Y190 HydrophobicContact CE2-CE1 3.66Å; F155-Y190 HydrophobicContact CE2-CE2 4.49Å; F155-Y190 AromaticContact CE2-CZ 3.78Å; A163-Y190 HydrophobicContact CB-CD1 4.38Å; E166-Y190 HydrophobicContact CB-CE1 3.86Å; E166-Y190 HydrophobicContact CG-CE1 4.13Å; E166-Y190 PolarHBondContact OE1-OH 3.25Å; A167-Y190 HydrophobicContact CB-CD1 4.33Å; A167-Y190 HydrophobicContact CB-CD2 3.67Å; A167-Y190 HydrophobicContact CB-CE2 4.04Å; A167-Y190 HydrophobicContact CB-CG 3.85Å; F170-Y190 HydrophobicContact CE2-CE2 4.39Å; F170-Y190 WeakPolarHBondContact CE2-OH 3.44Å; L186-Y190 HydrophobicContact CB-CD2 4.44Å; L186-Y190 HydrophobicContact CD2-CD2 4.5Å; L186-Y190 HydrophobicContact CD2-CE2 3.96Å; L186-Y190 VanDerWaalsContact O-CD2 3.31Å; L186-Y190 WeakPolarHBondContact O-CD2 3.32Å; L186-Y190 PolarHBondContact O-N 3.15Å; Y190-M231 HydrophobicContact CE2-CE 3.62Å; Y190-M231 WeakPolarHBondContact OH-CE 3.44Å
191	T	92.2	Very high	86.1	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-129.9	63.5	-179.2	56	0	0	0	0	110.8	L138 Y146 T149 Q160 C187	L138-T191 HydrophobicContact CB-CG2 4.11Å; L138-T191 HydrophobicContact CD2-CG2 3.84Å; Y146-T191 VanDerWaalsContact CE2-O 3.3Å; Y146-T191 WeakPolarHBondContact CE2-O 3.47Å; Y146-T191 PolarHBondContact OH-O 3.44Å; T149-T191 VanDerWaalsContact OG1-CA 3.25Å; T149-T191 WeakPolarHBondContact OG1-CA 3.28Å; Q160-T191 HydrophobicContact CG-CG2 4.42Å; C187-T191 CarbonylContact O-C 3.53Å; C187-T191 WeakPolarHBondContact O-CA 3.36Å; C187-T191 PolarHBondContact O-N 3.25Å; C187-T191 PolarHBondContact O-OG1 3.33Å
192	P	91.1	Very high	85.8	Confident	2 Å²	2	41.9 Å²	41.9	1%	0.013	22%	0.221	C	C	.	.			trans	-67.2	141.6	-169.7	31.9	-39.9	0	0	0	112.9	T149 R150 N153 C194 F201	T149-P192 CarbonylContact C-O 3.1Å; T149-P192 WeakPolarHBondContact CA-O 3.34Å; T149-P192 WeakPolarHBondContact OG1-CD 3.25Å; T149-P192 PolarHBondContact OG1-O 2.83Å; R150-P192 PolarHBondContact N-O 3.41Å; R150-P192 VanDerWaalsContact O-CG 3.28Å; R150-P192 WeakPolarHBondContact O-CG 3.36Å; N153-P192 HydrophobicContact CB-CG 4.13Å; P192-C194 PolarHBondContact O-N 2.91Å; P192-F201 HydrophobicContact CB-CD2 3.73Å; P192-F201 HydrophobicContact CB-CE2 3.33Å; P192-F201 HydrophobicContact CB-CZ 4.11Å; P192-F201 HydrophobicContact CG-CD2 3.81Å; P192-F201 HydrophobicContact CG-CE2 3.54Å
193	I	88.7	Confident	85.6	Confident	40 Å²	40	42.3 Å²	42.3	21%	0.205	22%	0.224	C	C	.	.	B	Isolated β-bridge	trans	-52.4	129.4	-178.7	-175	173.8	0	0	0	113.4	Y146 I195 L202	Y146-I193 HydrophobicContact CD1-CB 3.93Å; Y146-I193 HydrophobicContact CD1-CD1 3.97Å; Y146-I193 HydrophobicContact CD1-CG1 4.14Å; Y146-I193 HydrophobicContact CD2-CB 3.81Å; Y146-I193 HydrophobicContact CD2-CG1 4.06Å; Y146-I193 HydrophobicContact CE1-CB 4.18Å; Y146-I193 HydrophobicContact CE2-CB 4.08Å; Y146-I193 HydrophobicContact CG-CB 3.75Å; Y146-I193 HydrophobicContact CG-CD1 3.87Å; Y146-I193 HydrophobicContact CG-CG1 3.7Å; I193-I195 HydrophobicContact CD1-CD1 4.4Å; I193-I195 HydrophobicContact CD1-CG1 4.14Å; I193-I195 HydrophobicContact CG1-CG1 4.07Å; I193-L202 HydrophobicContact CG2-CB 4.18Å; I193-L202 HydrophobicContact CG2-CD2 3.9Å
194	C	88.4	Confident	85.5	Confident	24 Å²	24	38.2 Å²	38.2	16%	0.162	21%	0.209	C	C	.	.			trans	-95.8	110.2	173.3	-166.9	0	0	0	0	112	C133 Y148 T149 R150 P192	C133-C194 WeakPolarHBondContact CA-SG 3.43Å; C133-C194 HydrophobicContact CB-CB 3.57Å; C133-C194 WeakPolarHBondContact CB-SG 3.24Å; C133-C194 WeakPolarHBondContact SG-CB 3.49Å; C133-C194 CovalentContact SG-SG 2.04Å; C133-C194 PolarHBondContact SG-SG 3.07Å; Y148-C194 PolarHBondContact O-N 3.03Å; T149-C194 WeakPolarHBondContact O-CB 3.33Å; R150-C194 HydrophobicContact CB-CB 3.94Å; P192-C194 PolarHBondContact O-N 2.91Å
195	I	82.7	Confident	85.5	Confident	78 Å²	78	37.4 Å²	37.4	40%	0.4	21%	0.205	S	C	.	.			trans	-103.5	115.4	177.2	-56.9	175.7	0	0	0	108.9	I193 G197 Y198 L202	I193-I195 HydrophobicContact CD1-CD1 4.4Å; I193-I195 HydrophobicContact CD1-CG1 4.14Å; I193-I195 HydrophobicContact CG1-CG1 4.07Å; I195-G197 PolarHBondContact O-N 3.07Å; I195-Y198 PolarHBondContact O-N 3.3Å; I195-L202 HydrophobicContact CD1-CD2 4.14Å
196	K	78.1	Confident	85.4	Confident	187 Å²	187	40 Å²	40	81%	0.813	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.6	119.3	179.3	-67.7	179.6	-178.5	174.3	0	110.5
197	G	71.5	Confident	85.3	Confident	85 Å²	85	41.2 Å²	41.2	88%	0.876	22%	0.224	S	C	*	.	T	Hydrogen-bonded Turn	trans	94.3	-5.9	-178.2	0	0	0	0	0	115.2	I195	I195-G197 PolarHBondContact O-N 3.07Å
198	Y	76.8	Confident	85.2	Confident	77 Å²	77	41.2 Å²	41.2	30%	0.302	22%	0.224	S	C	.	.			trans	-98.9	114.6	170.5	-167.8	-110.3	0	0	0	109.5	I195 H200 L202	I195-Y198 PolarHBondContact O-N 3.3Å; Y198-H200 HydrophobicContact CD1-CB 4.37Å; Y198-H200 WeakPolarHBondContact CD1-O 3.4Å; Y198-H200 HydrophobicContact CE1-CB 3.76Å; Y198-H200 WeakPolarHBondContact CE1-O 3.35Å; Y198-H200 PolarHBondContact O-N 3.44Å; Y198-L202 HydrophobicContact CE1-CB 4.49Å
199	P	68.7	Low	85.3	Confident	84 Å²	84	41.2 Å²	41.2	55%	0.545	22%	0.224	S	C	.	.			trans	-83.4	-8.5	-171.9	32.4	-35.5	0	0	0	114.2
200	H	70.5	Confident	85.4	Confident	122 Å²	122	46.3 Å²	46.3	57%	0.565	25%	0.247	S	C	*	.	S	Bend	trans	-103.8	158.5	-173.1	-54	-57.3	0	0	0	112.4	Y198	Y198-H200 HydrophobicContact CD1-CB 4.37Å; Y198-H200 WeakPolarHBondContact CD1-O 3.4Å; Y198-H200 HydrophobicContact CE1-CB 3.76Å; Y198-H200 WeakPolarHBondContact CE1-O 3.35Å; Y198-H200 PolarHBondContact O-N 3.44Å
201	F	78.7	Confident	85.3	Confident	49 Å²	49	48 Å²	48	22%	0.215	25%	0.254	C	S	.	.			trans	-71.1	134.9	168.6	175	-87.1	0	0	0	109.5	M154 P192 P203	M154-F201 HydrophobicContact CB-CE1 4.22Å; M154-F201 HydrophobicContact CB-CE2 3.84Å; M154-F201 HydrophobicContact CB-CZ 3.68Å; M154-F201 HydrophobicContact CG-CE1 4.32Å; M154-F201 HydrophobicContact CG-CZ 4.27Å; M154-F201 HydrophobicContact SD-CE1 3.99Å; M154-F201 HydrophobicContact SD-CZ 4.2Å; P192-F201 HydrophobicContact CB-CD2 3.73Å; P192-F201 HydrophobicContact CB-CE2 3.33Å; P192-F201 HydrophobicContact CB-CZ 4.11Å; P192-F201 HydrophobicContact CG-CD2 3.81Å; P192-F201 HydrophobicContact CG-CE2 3.54Å; F201-P203 HydrophobicContact CD1-CB 4.25Å; F201-P203 HydrophobicContact CE1-CB 3.86Å; F201-P203 WeakPolarHBondContact O-CD 3.12Å
202	L	84.5	Confident	85.3	Confident	21 Å²	21	48 Å²	48	11%	0.11	25%	0.254	C	S	.	.			trans	-101.3	101.2	177.5	-176.5	67.9	0	0	0	109.9	I193 I195 Y198 L246 M248	I193-L202 HydrophobicContact CG2-CB 4.18Å; I193-L202 HydrophobicContact CG2-CD2 3.9Å; I195-L202 HydrophobicContact CD1-CD2 4.14Å; Y198-L202 HydrophobicContact CE1-CB 4.49Å; L202-L246 HydrophobicContact CD1-CB 3.59Å; L202-L246 WeakPolarHBondContact CD1-O 3.01Å; L202-M248 HydrophobicContact CD2-CB 4.48Å
203	P	87.6	Confident	85.5	Confident	14 Å²	14	51.4 Å²	51.4	9%	0.091	27%	0.269	C	S	.	.	P	Polyproline II helix	trans	-73.2	157.5	-176.7	30.3	-36.3	0	0	0	112.9	F201 F236 P237 C247 M248	F201-P203 HydrophobicContact CD1-CB 4.25Å; F201-P203 HydrophobicContact CE1-CB 3.86Å; F201-P203 WeakPolarHBondContact O-CD 3.12Å; P203-F236 HydrophobicContact CB-CD1 4.2Å; P203-P237 HydrophobicContact CB-CG 4.39Å; P203-P237 HydrophobicContact CG-CG 3.56Å; P203-C247 HydrophobicContact CG-CB 4.42Å; P203-C247 CarbonylContact O-C 3.57Å; P203-C247 VanDerWaalsContact O-CA 3.28Å; P203-C247 WeakPolarHBondContact O-CA 3.45Å; P203-M248 PolarHBondContact O-N 3.45Å
204	P	90	Very high	85.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	29%	0.289	C	S	.	.	B	Isolated β-bridge	trans	-63.2	149	161.2	30.2	-34.4	0	0	0	110.2	L185 I189 I208 F236	L185-P204 HydrophobicContact CD1-CB 3.87Å; L185-P204 HydrophobicContact CD1-CG 3.7Å; I189-P204 HydrophobicContact CD1-CG 4.46Å; I189-P204 HydrophobicContact CG1-CG 4.06Å; P204-I208 HydrophobicContact CB-CD1 4.41Å; P204-F236 HydrophobicContact CG-CD1 3.9Å; P204-F236 HydrophobicContact CG-CE1 3.82Å; P204-F236 HydrophobicContact CG-CG 4.37Å; P204-F236 HydrophobicContact CG-CZ 4.22Å
205	C	91.5	Very high	85.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-70.3	147.9	174.3	-60.1	0	0	0	0	111.7	S207 I208 C209 C247 M248 E249	C205-S207 WeakPolarHBondContact CB-OG 3.32Å; C205-S207 PolarHBondContact O-N 2.89Å; C205-S207 VanDerWaalsContact O-N 3.12Å; C205-I208 WeakPolarHBondContact O-CB 3.39Å; C205-I208 PolarHBondContact O-N 3.12Å; C205-C209 PolarHBondContact O-N 3.28Å; C205-C247 VanDerWaalsContact CA-SG 3.54Å; C205-C247 HydrophobicContact CB-CB 3.98Å; C205-C247 WeakPolarHBondContact CB-SG 3.48Å; C205-C247 WeakPolarHBondContact SG-CB 3.42Å; C205-C247 PolarHBondContact SG-O 2.62Å; C205-C247 CovalentContact SG-SG 2.04Å; C205-C247 PolarHBondContact SG-SG 2.94Å; C205-M248 PolarHBondContact N-O 3.36Å; C205-M248 PolarHBondContact SG-O 2.87Å; C205-E249 HydrophobicContact CB-CB 4.47Å
206	R	91.7	Very high	86.1	Confident	54 Å²	54	49.7 Å²	49.7	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-49	-39.1	177	179.1	171.4	-60.4	-164.3	-9.5	113.8	I208 C209 Q210 C233 E234 F236 P237 E238	R206-I208 VanDerWaalsContact C-N 3.33Å; R206-I208 PolarHBondContact O-N 3.38Å; R206-C209 PolarHBondContact O-N 3.11Å; R206-C209 VanDerWaalsContact O-N 3.17Å; R206-Q210 HydrophobicContact CG-CG 4.28Å; R206-Q210 WeakPolarHBondContact O-CG 3.24Å; R206-Q210 PolarHBondContact O-N 2.66Å; R206-C233 HydrophobicContact CG-CB 4.48Å; R206-C233 WeakPolarHBondContact CG-O 3.43Å; R206-C233 PolarHBondContact NE-O 3.21Å; R206-E234 PolarHBondContact NH2-O 3.39Å; R206-F236 HydrophobicContact CB-CB 4.35Å; R206-F236 PolarHBondContact NE-O 3.3Å; R206-F236 PolarHBondContact NH2-O 2.96Å; R206-P237 WeakPolarHBondContact CB-O 3.46Å; R206-P237 PolarHBondContact N-O 3.45Å; R206-E238 HydrophobicContact CB-CG 4.03Å; R206-E238 WeakPolarHBondContact CD-OE1 3.46Å; R206-E238 HydrophobicContact CG-CG 4.36Å; R206-E238 IonicContact CZ-OE1 3.47Å; R206-E238 IonicContact NE-OE1 3.61Å; R206-E238 IonicContact NH1-OE1 2.83Å; R206-E238 PolarHBondContact NH1-OE1 3.48Å
207	S	89.3	Confident	86.7	Confident	28 Å²	28	41 Å²	41	20%	0.196	24%	0.239	C	C	.	.	H	α-helix	trans	-54.5	-41.7	174.9	44	0	0	0	0	113.1	C205 Q210 R211 E249	C205-S207 WeakPolarHBondContact CB-OG 3.32Å; C205-S207 PolarHBondContact O-N 2.89Å; C205-S207 VanDerWaalsContact O-N 3.12Å; S207-Q210 PolarHBondContact O-N 2.68Å; S207-R211 WeakPolarHBondContact O-CG 3.13Å; S207-R211 PolarHBondContact O-N 3.47Å; S207-E249 VanDerWaalsContact CB-OE2 3.23Å; S207-E249 WeakPolarHBondContact CB-OE2 3.41Å; S207-E249 PolarHBondContact OG-OE2 2.92Å
208	I	91.3	Very high	87.5	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-62.1	-52.7	174.1	-56.5	-165.1	0	0	0	109.6	D181 F184 L185 P204 C205 R206 Q210 R211 V212 M248 E249	D181-I208 HydrophobicContact CB-CG2 4.01Å; F184-I208 HydrophobicContact CD1-CD1 3.56Å; F184-I208 HydrophobicContact CD1-CG2 4.39Å; F184-I208 HydrophobicContact CE1-CD1 3.33Å; F184-I208 HydrophobicContact CZ-CD1 4.41Å; L185-I208 HydrophobicContact CB-CG2 4.07Å; L185-I208 HydrophobicContact CD1-CB 4.47Å; L185-I208 HydrophobicContact CD1-CG2 4Å; P204-I208 HydrophobicContact CB-CD1 4.41Å; C205-I208 WeakPolarHBondContact O-CB 3.39Å; C205-I208 PolarHBondContact O-N 3.12Å; R206-I208 VanDerWaalsContact C-N 3.33Å; R206-I208 PolarHBondContact O-N 3.38Å; I208-Q210 VanDerWaalsContact C-N 3.26Å; I208-Q210 PolarHBondContact O-N 2.86Å; I208-R211 PolarHBondContact O-N 3.01Å; I208-R211 VanDerWaalsContact O-N 3.09Å; I208-V212 HydrophobicContact CG2-CG2 4.34Å; I208-V212 WeakPolarHBondContact O-CG2 3.37Å; I208-V212 PolarHBondContact O-N 3.25Å; I208-M248 WeakPolarHBondContact CD1-O 3.4Å; I208-E249 VanDerWaalsContact CG1-OE1 3.31Å; I208-E249 WeakPolarHBondContact CG1-OE1 3.48Å
209	C	93.9	Very high	88	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.1	-41.9	-179	-178.4	0	0	0	0	111.6	L185 C205 R206 V212 K213 M231 C233 F236	L185-C209 HydrophobicContact CD1-CB 4.06Å; L185-C209 HydrophobicContact CD2-CB 4.39Å; C205-C209 PolarHBondContact O-N 3.28Å; R206-C209 PolarHBondContact O-N 3.11Å; R206-C209 VanDerWaalsContact O-N 3.17Å; C209-V212 PolarHBondContact O-N 3.01Å; C209-K213 WeakPolarHBondContact O-CB 3.2Å; C209-K213 PolarHBondContact O-N 2.94Å; C209-M231 PolarHBondContact SG-O 3.19Å; C209-M231 VanDerWaalsContact SG-O 3.35Å; C209-C233 HydrophobicContact CB-CB 3.64Å; C209-C233 WeakPolarHBondContact CB-SG 3.08Å; C209-C233 PolarHBondContact O-SG 3.11Å; C209-C233 VanDerWaalsContact O-SG 3.42Å; C209-C233 WeakPolarHBondContact SG-CA 3.48Å; C209-C233 WeakPolarHBondContact SG-CB 3.48Å; C209-C233 CovalentContact SG-SG 2.04Å; C209-C233 PolarHBondContact SG-SG 3.41Å; C209-F236 HydrophobicContact CB-CD2 3.67Å; C209-F236 HydrophobicContact CB-CE2 4.03Å
210	Q	92.9	Very high	89	Confident	107 Å²	107	36.1 Å²	36.1	50%	0.5	20%	0.197	S	C	.	.	H	α-helix	trans	-62.7	-43.6	175.6	-72.7	170.4	-25.2	0	0	112.5	R206 S207 I208 V212 K213 A214 C233	R206-Q210 HydrophobicContact CG-CG 4.28Å; R206-Q210 WeakPolarHBondContact O-CG 3.24Å; R206-Q210 PolarHBondContact O-N 2.66Å; S207-Q210 PolarHBondContact O-N 2.68Å; I208-Q210 VanDerWaalsContact C-N 3.26Å; I208-Q210 PolarHBondContact O-N 2.86Å; Q210-V212 VanDerWaalsContact C-N 3.3Å; Q210-V212 PolarHBondContact O-N 3.13Å; Q210-K213 PolarHBondContact O-N 3.32Å; Q210-A214 VanDerWaalsContact O-CB 3.25Å; Q210-A214 WeakPolarHBondContact O-CB 3.37Å; Q210-A214 PolarHBondContact O-N 2.77Å; Q210-C233 HydrophobicContact CG-CB 4.23Å
211	R	90.3	Very high	89.9	Confident	37 Å²	37	35.6 Å²	35.6	14%	0.14	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-30.2	175.3	-68.8	-171	-45.8	-101.2	10.1	113.1	S179 D181 S207 I208 E249 L260	S179-R211 PolarHBondContact OG-O 3.29Å; S179-R211 VanDerWaalsContact OG-O 3.09Å; D181-R211 IonicContact OD1-CZ 2.69Å; D181-R211 IonicContact OD1-NE 3.87Å; D181-R211 IonicContact OD1-NH2 2.73Å; D181-R211 PolarHBondContact OD1-NH2 3.1Å; D181-R211 IonicContact OD2-CZ 2.77Å; D181-R211 IonicContact OD2-NE 3.54Å; D181-R211 PolarHBondContact OD2-NE 3.32Å; D181-R211 IonicContact OD2-NH2 3.39Å; D181-R211 PolarHBondContact OD2-NH2 3.41Å; S207-R211 WeakPolarHBondContact O-CG 3.13Å; S207-R211 PolarHBondContact O-N 3.47Å; I208-R211 PolarHBondContact O-N 3.01Å; I208-R211 VanDerWaalsContact O-N 3.09Å; R211-E249 IonicContact CZ-OE1 2.71Å; R211-E249 IonicContact NH1-OE1 3.6Å; R211-E249 PolarHBondContact NH1-OE1 3.04Å; R211-E249 IonicContact NH1-OE2 3.65Å; R211-E249 PolarHBondContact NH1-OE2 3Å; R211-E249 VanDerWaalsContact NH1-OE2 3.09Å; R211-E249 IonicContact NH2-OE1 3.89Å; R211-E249 PolarHBondContact NH2-OE1 3.13Å; R211-L260 HydrophobicContact CG-CD2 4.42Å
212	V	93.5	Very high	90.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-77.1	-49.6	174.8	179.4	0	0	0	0	111	D181 L182 L185 I208 C209 Q210 A214 G215 C216 W227	D181-V212 HydrophobicContact CB-CG2 3.56Å; L182-V212 HydrophobicContact CB-CG1 3.92Å; L182-V212 HydrophobicContact CB-CG2 4.49Å; L182-V212 HydrophobicContact CD1-CG1 3.46Å; L182-V212 VanDerWaalsContact CD1-CG1 3.46Å; L182-V212 HydrophobicContact CG-CG1 4.27Å; L185-V212 HydrophobicContact CB-CG2 4.03Å; L185-V212 HydrophobicContact CD2-CB 3.82Å; L185-V212 HydrophobicContact CD2-CG1 3.91Å; L185-V212 HydrophobicContact CD2-CG2 3.95Å; I208-V212 HydrophobicContact CG2-CG2 4.34Å; I208-V212 WeakPolarHBondContact O-CG2 3.37Å; I208-V212 PolarHBondContact O-N 3.25Å; C209-V212 PolarHBondContact O-N 3.01Å; Q210-V212 VanDerWaalsContact C-N 3.3Å; Q210-V212 PolarHBondContact O-N 3.13Å; V212-A214 VanDerWaalsContact C-N 3.32Å; V212-A214 PolarHBondContact O-N 3.48Å; V212-G215 PolarHBondContact O-N 2.95Å; V212-G215 VanDerWaalsContact O-N 3.14Å; V212-C216 HydrophobicContact CG1-CB 4.49Å; V212-C216 WeakPolarHBondContact O-CB 3.23Å; V212-C216 PolarHBondContact O-N 3.37Å; V212-W227 HydrophobicContact CG1-CH2 3.84Å; V212-W227 HydrophobicContact CG1-CZ3 4.44Å
213	K	94.1	Very high	90.4	Very high	73 Å²	73	45 Å²	45	32%	0.317	23%	0.233	S	C	.	.	H	α-helix	trans	-58.2	-44	178.3	-170.8	172.4	-177	174.2	0	111.1	C209 Q210 G215 C216 S217 W227	C209-K213 WeakPolarHBondContact O-CB 3.2Å; C209-K213 PolarHBondContact O-N 2.94Å; Q210-K213 PolarHBondContact O-N 3.32Å; K213-G215 VanDerWaalsContact C-N 3.28Å; K213-G215 PolarHBondContact O-N 2.91Å; K213-C216 PolarHBondContact O-N 3.24Å; K213-S217 WeakPolarHBondContact O-CB 3.23Å; K213-S217 PolarHBondContact O-N 2.93Å; K213-W227 HydrophobicContact CB-CD2 4.23Å; K213-W227 HydrophobicContact CB-CE3 4.33Å; K213-W227 HydrophobicContact CB-CH2 4.27Å; K213-W227 HydrophobicContact CB-CZ2 4.14Å; K213-W227 HydrophobicContact CB-CZ3 4.36Å; K213-W227 HydrophobicContact CD-CD2 3.94Å; K213-W227 HydrophobicContact CD-CG 3.82Å; K213-W227 HydrophobicContact CG-CD2 3.73Å; K213-W227 HydrophobicContact CG-CE3 3.98Å; K213-W227 HydrophobicContact CG-CG 4.07Å; K213-W227 HydrophobicContact CG-CZ3 4.5Å
214	A	91	Very high	90.4	Very high	77 Å²	77	51.7 Å²	51.7	64%	0.636	26%	0.263	S	S	*	.	H	α-helix	trans	-59.6	-34.2	177.7	0	0	0	0	0	114	Q210 V212	Q210-A214 VanDerWaalsContact O-CB 3.25Å; Q210-A214 WeakPolarHBondContact O-CB 3.37Å; Q210-A214 PolarHBondContact O-N 2.77Å; V212-A214 VanDerWaalsContact C-N 3.32Å; V212-A214 PolarHBondContact O-N 3.48Å
215	G	88.8	Confident	90.3	Very high	28 Å²	28	58.1 Å²	58.1	29%	0.289	29%	0.291	S	S	.	.	H	α-helix	trans	-87.5	-32.8	178.2	0	0	0	0	0	114.5	C178 V212 K213	C178-G215 CarbonylContact O-C 3.41Å; C178-G215 WeakPolarHBondContact O-CA 3.49Å; V212-G215 PolarHBondContact O-N 2.95Å; V212-G215 VanDerWaalsContact O-N 3.14Å; K213-G215 VanDerWaalsContact C-N 3.28Å; K213-G215 PolarHBondContact O-N 2.91Å
216	C	93.1	Very high	90.2	Very high	1 Å²	1	63 Å²	63	1%	0.007	32%	0.323	C	S	.	.	H	α-helix	trans	-106.4	-30.4	-169.1	-60.1	0	0	0	0	114.6	C178 V212 K213 I219 M220 W227	C178-C216 VanDerWaalsContact C-SG 3.56Å; C178-C216 HydrophobicContact CB-CB 3.95Å; C178-C216 WeakPolarHBondContact CB-SG 3.49Å; C178-C216 WeakPolarHBondContact SG-CB 3.19Å; C178-C216 CovalentContact SG-SG 2.04Å; C178-C216 PolarHBondContact SG-SG 3.29Å; V212-C216 HydrophobicContact CG1-CB 4.49Å; V212-C216 WeakPolarHBondContact O-CB 3.23Å; V212-C216 PolarHBondContact O-N 3.37Å; K213-C216 PolarHBondContact O-N 3.24Å; C216-I219 PolarHBondContact O-N 3.24Å; C216-I219 VanDerWaalsContact O-N 3.07Å; C216-M220 WeakPolarHBondContact O-CG 3.27Å; C216-M220 PolarHBondContact O-N 3.45Å; C216-W227 HydrophobicContact CB-CZ3 4.26Å
217	S	91.9	Very high	90.2	Very high	4 Å²	4	61.6 Å²	61.6	3%	0.028	32%	0.317	C	S	.	.	H	α-helix	trans	-57.2	-44.5	179.1	-147.1	0	0	0	0	112.4	K213 I219 M220 E221	K213-S217 WeakPolarHBondContact O-CB 3.23Å; K213-S217 PolarHBondContact O-N 2.93Å; S217-I219 PolarHBondContact O-N 3.16Å; S217-I219 VanDerWaalsContact O-N 3.14Å; S217-M220 PolarHBondContact O-N 2.94Å; S217-M220 VanDerWaalsContact O-N 3.11Å; S217-E221 VanDerWaalsContact CB-OE1 3.26Å; S217-E221 WeakPolarHBondContact CB-OE1 3.48Å; S217-E221 WeakPolarHBondContact O-CB 3.38Å; S217-E221 VanDerWaalsContact O-CG 3.27Å; S217-E221 WeakPolarHBondContact O-CG 3.43Å; S217-E221 PolarHBondContact O-N 3.4Å; S217-E221 PolarHBondContact OG-OE1 2.97Å
218	P	88.3	Confident	90.2	Very high	75 Å²	75	61.8 Å²	61.8	49%	0.487	32%	0.318	S	S	.	.	H	α-helix	trans	-62.5	-23.8	177.1	-23.4	35.1	0	0	0	114.4	H222	P218-H222 VanDerWaalsContact O-CB 3.32Å; P218-H222 WeakPolarHBondContact O-CB 3.44Å; P218-H222 PolarHBondContact O-N 3.24Å
219	I	86.9	Confident	90.1	Very high	50 Å²	50	69.8 Å²	69.8	26%	0.256	36%	0.356	S	S	.	.	H	α-helix	trans	-84.1	-38.5	176.5	-66.7	166.6	0	0	0	110.3	L173 I176 C178 C216 S217 H222 Y223	L173-I219 HydrophobicContact CD2-CG2 3.94Å; I176-I219 HydrophobicContact CG2-CD1 4.25Å; C178-I219 HydrophobicContact CB-CD1 3.61Å; C216-I219 PolarHBondContact O-N 3.24Å; C216-I219 VanDerWaalsContact O-N 3.07Å; S217-I219 PolarHBondContact O-N 3.16Å; S217-I219 VanDerWaalsContact O-N 3.14Å; I219-H222 PolarHBondContact O-N 2.91Å; I219-Y223 HydrophobicContact CG2-CD2 4.49Å; I219-Y223 HydrophobicContact CG2-CE2 4.39Å; I219-Y223 VanDerWaalsContact O-CD2 3.26Å; I219-Y223 WeakPolarHBondContact O-CD2 3.33Å
220	M	89.5	Confident	89.8	Confident	19 Å²	19	75.5 Å²	75.5	9%	0.094	38%	0.377	C	S	.	.	H	α-helix	trans	-65.9	-46.8	174.8	-64.6	-176.5	62.9	0	0	111.2	L173 C216 S217 H222 Y223 E224 F225 W227 P228	L173-M220 HydrophobicContact CD1-CG 3.76Å; L173-M220 HydrophobicContact CD1-SD 3.79Å; L173-M220 HydrophobicContact CD2-CG 4.24Å; C216-M220 WeakPolarHBondContact O-CG 3.27Å; C216-M220 PolarHBondContact O-N 3.45Å; S217-M220 PolarHBondContact O-N 2.94Å; S217-M220 VanDerWaalsContact O-N 3.11Å; M220-H222 VanDerWaalsContact C-N 3.29Å; M220-H222 PolarHBondContact O-N 3.41Å; M220-Y223 CarbonylContact O-C 3.54Å; M220-Y223 WeakPolarHBondContact O-CA 3.4Å; M220-Y223 PolarHBondContact O-N 3.49Å; M220-E224 PolarHBondContact O-N 3.03Å; M220-F225 CarbonylContact C-O 3.58Å; M220-F225 HydrophobicContact CB-CB 4.27Å; M220-F225 VanDerWaalsContact CB-O 3.23Å; M220-F225 WeakPolarHBondContact CB-O 3.38Å; M220-F225 HydrophobicContact CE-CB 4.29Å; M220-F225 PolarHBondContact O-N 3.4Å; M220-W227 HydrophobicContact SD-CE3 3.94Å; M220-W227 HydrophobicContact SD-CZ3 4.11Å; M220-P228 HydrophobicContact CE-CG 4.3Å
221	E	90	Very high	89.5	Confident	111 Å²	111	70.5 Å²	70.5	52%	0.519	35%	0.354	S	S	.	.	H	α-helix	trans	-61.1	-35.1	176.9	-70.9	158.2	-145	0	0	112.1	S217 Y223 E224 F225	S217-E221 VanDerWaalsContact CB-OE1 3.26Å; S217-E221 WeakPolarHBondContact CB-OE1 3.48Å; S217-E221 WeakPolarHBondContact O-CB 3.38Å; S217-E221 VanDerWaalsContact O-CG 3.27Å; S217-E221 WeakPolarHBondContact O-CG 3.43Å; S217-E221 PolarHBondContact O-N 3.4Å; S217-E221 PolarHBondContact OG-OE1 2.97Å; E221-Y223 PolarHBondContact O-N 3.33Å; E221-E224 PolarHBondContact O-N 3.17Å; E221-F225 PolarHBondContact N-O 2.99Å
222	H	86.6	Confident	89.6	Confident	116 Å²	116	71 Å²	71	54%	0.537	36%	0.359	S	S	.	.	H	α-helix	trans	-65.6	-21.5	174.6	-177.4	37.5	0	0	0	113.7	P218 I219 M220	P218-H222 VanDerWaalsContact O-CB 3.32Å; P218-H222 WeakPolarHBondContact O-CB 3.44Å; P218-H222 PolarHBondContact O-N 3.24Å; I219-H222 PolarHBondContact O-N 2.91Å; M220-H222 VanDerWaalsContact C-N 3.29Å; M220-H222 PolarHBondContact O-N 3.41Å
223	Y	87	Confident	89.5	Confident	151 Å²	151	71.5 Å²	71.5	59%	0.592	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108	25.3	172	-65.9	-70.9	0	0	0	112.2	I219 M220 E221 F225	I219-Y223 HydrophobicContact CG2-CD2 4.49Å; I219-Y223 HydrophobicContact CG2-CE2 4.39Å; I219-Y223 VanDerWaalsContact O-CD2 3.26Å; I219-Y223 WeakPolarHBondContact O-CD2 3.33Å; M220-Y223 CarbonylContact O-C 3.54Å; M220-Y223 WeakPolarHBondContact O-CA 3.4Å; M220-Y223 PolarHBondContact O-N 3.49Å; E221-Y223 PolarHBondContact O-N 3.33Å; Y223-F225 WeakPolarHBondContact O-CD2 3.38Å; Y223-F225 WeakPolarHBondContact O-CE2 3.31Å; Y223-F225 PolarHBondContact O-N 3.24Å; Y223-F225 VanDerWaalsContact O-N 3.09Å
224	E	86.7	Confident	89.3	Confident	155 Å²	155	74.8 Å²	74.8	72%	0.724	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.9	11.2	176.4	-58.5	176.9	175	0	0	115.5	M220 E221 P226	M220-E224 PolarHBondContact O-N 3.03Å; E221-E224 PolarHBondContact O-N 3.17Å; E224-P226 WeakPolarHBondContact O-CD 3.5Å
225	F	87.7	Confident	89.1	Confident	135 Å²	135	76.2 Å²	76.2	59%	0.592	37%	0.373	S	S	*	.			trans	-91.4	112.3	174.8	-66.5	-73.6	0	0	0	110.7	M220 E221 Y223	M220-F225 CarbonylContact C-O 3.58Å; M220-F225 HydrophobicContact CB-CB 4.27Å; M220-F225 VanDerWaalsContact CB-O 3.23Å; M220-F225 WeakPolarHBondContact CB-O 3.38Å; M220-F225 HydrophobicContact CE-CB 4.29Å; M220-F225 PolarHBondContact O-N 3.4Å; E221-F225 PolarHBondContact N-O 2.99Å; Y223-F225 WeakPolarHBondContact O-CD2 3.38Å; Y223-F225 WeakPolarHBondContact O-CE2 3.31Å; Y223-F225 PolarHBondContact O-N 3.24Å; Y223-F225 VanDerWaalsContact O-N 3.09Å
226	P	90.4	Very high	89.2	Confident	101 Å²	101	75 Å²	75	66%	0.656	36%	0.359	S	S	*	.	P	Polyproline II helix	trans	-68.3	153.6	174.8	29	-34.8	0	0	0	111.3	E224	E224-P226 WeakPolarHBondContact O-CD 3.5Å
227	W	90.2	Very high	89	Confident	25 Å²	25	75.9 Å²	75.9	10%	0.095	37%	0.365	C	S	.	.	P	Polyproline II helix	trans	-59.5	123.9	172.9	-176.9	-91	0	0	0	111	V212 K213 C216 M220 E229 M231	V212-W227 HydrophobicContact CG1-CH2 3.84Å; V212-W227 HydrophobicContact CG1-CZ3 4.44Å; K213-W227 HydrophobicContact CB-CD2 4.23Å; K213-W227 HydrophobicContact CB-CE3 4.33Å; K213-W227 HydrophobicContact CB-CH2 4.27Å; K213-W227 HydrophobicContact CB-CZ2 4.14Å; K213-W227 HydrophobicContact CB-CZ3 4.36Å; K213-W227 HydrophobicContact CD-CD2 3.94Å; K213-W227 HydrophobicContact CD-CG 3.82Å; K213-W227 HydrophobicContact CG-CD2 3.73Å; K213-W227 HydrophobicContact CG-CE3 3.98Å; K213-W227 HydrophobicContact CG-CG 4.07Å; K213-W227 HydrophobicContact CG-CZ3 4.5Å; C216-W227 HydrophobicContact CB-CZ3 4.26Å; M220-W227 HydrophobicContact SD-CE3 3.94Å; M220-W227 HydrophobicContact SD-CZ3 4.11Å; W227-E229 PolarHBondContact O-N 3.42Å; W227-M231 HydrophobicContact CZ2-CB 4.04Å; W227-M231 PolarHBondContact NE1-O 3.37Å
228	P	89.9	Confident	88.7	Confident	32 Å²	32	80.6 Å²	80.6	21%	0.208	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-59.7	132.6	-170.8	-26.5	34.6	0	0	0	113.6	F170 M220 R230 M231 N232	F170-P228 HydrophobicContact CE1-CG 4.34Å; F170-P228 HydrophobicContact CZ-CG 4.23Å; M220-P228 HydrophobicContact CE-CG 4.3Å; P228-R230 PolarHBondContact O-N 2.85Å; P228-M231 HydrophobicContact CB-CB 4.45Å; P228-M231 HydrophobicContact CB-CG 4.46Å; P228-M231 CarbonylContact O-C 3.58Å; P228-M231 WeakPolarHBondContact O-CA 3.41Å; P228-M231 PolarHBondContact O-N 3.4Å; P228-N232 PolarHBondContact O-N 3.32Å
229	E	89.6	Confident	88.2	Confident	169 Å²	169	83.9 Å²	83.9	79%	0.79	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-59.2	-35.1	177.5	-62.7	-171.4	157.4	0	0	112.5	W227 M231 N232 Q235	W227-E229 PolarHBondContact O-N 3.42Å; E229-M231 PolarHBondContact O-N 3.02Å; E229-M231 VanDerWaalsContact O-N 3.13Å; E229-N232 WeakPolarHBondContact O-CB 3.4Å; E229-N232 PolarHBondContact O-N 3.12Å; E229-Q235 PolarHBondContact O-NE2 2.96Å
230	R	86.7	Confident	87.4	Confident	119 Å²	119	88 Å²	88	45%	0.449	41%	0.413	S	S	.	.	G	3₁₀ helix	trans	-66.7	-5	173.4	-67.8	-170.6	-69.7	127.5	7.2	113.9	F155 E166 P228	F155-R230 HydrophobicContact CD1-CB 4.49Å; F155-R230 HydrophobicContact CE1-CB 3.75Å; F155-R230 VanDerWaalsContact CE1-O 3.27Å; F155-R230 WeakPolarHBondContact CE1-O 3.21Å; F155-R230 HydrophobicContact CZ-CB 3.98Å; F155-R230 VanDerWaalsContact CZ-O 3.25Å; F155-R230 WeakPolarHBondContact CZ-O 3.44Å; E166-R230 VanDerWaalsContact CD-NH1 3.31Å; E166-R230 VanDerWaalsContact CD-NH2 3.29Å; E166-R230 IonicContact OE1-CZ 3.14Å; E166-R230 VanDerWaalsContact OE1-CZ 3.28Å; E166-R230 IonicContact OE1-NH1 3.89Å; E166-R230 PolarHBondContact OE1-NH1 3.47Å; E166-R230 VanDerWaalsContact OE1-NH1 3.08Å; E166-R230 IonicContact OE1-NH2 3.96Å; E166-R230 PolarHBondContact OE1-NH2 3.3Å; E166-R230 IonicContact OE2-CZ 3.39Å; E166-R230 IonicContact OE2-NH1 2.96Å; E166-R230 PolarHBondContact OE2-NH1 3.33Å; E166-R230 IonicContact OE2-NH2 2.84Å; E166-R230 PolarHBondContact OE2-NH2 3.32Å; P228-R230 PolarHBondContact O-N 2.85Å
231	M	88.4	Confident	86.9	Confident	3 Å²	3	88.3 Å²	88.3	2%	0.015	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-123.8	19.8	171.7	-61.5	-173.1	-175.6	0	0	111.8	F170 L186 Y190 C209 W227 P228 E229 C233	F170-M231 HydrophobicContact CE1-CE 4.2Å; F170-M231 HydrophobicContact CE1-SD 4.25Å; F170-M231 HydrophobicContact CE2-CE 3.84Å; F170-M231 HydrophobicContact CZ-CE 3.59Å; F170-M231 HydrophobicContact CZ-SD 4.14Å; L186-M231 HydrophobicContact CD2-CE 3.79Å; L186-M231 HydrophobicContact CD2-SD 4.34Å; Y190-M231 HydrophobicContact CE2-CE 3.62Å; Y190-M231 WeakPolarHBondContact OH-CE 3.44Å; C209-M231 PolarHBondContact SG-O 3.19Å; C209-M231 VanDerWaalsContact SG-O 3.35Å; W227-M231 HydrophobicContact CZ2-CB 4.04Å; W227-M231 PolarHBondContact NE1-O 3.37Å; P228-M231 HydrophobicContact CB-CB 4.45Å; P228-M231 HydrophobicContact CB-CG 4.46Å; P228-M231 CarbonylContact O-C 3.58Å; P228-M231 WeakPolarHBondContact O-CA 3.41Å; P228-M231 PolarHBondContact O-N 3.4Å; E229-M231 PolarHBondContact O-N 3.02Å; E229-M231 VanDerWaalsContact O-N 3.13Å; M231-C233 PolarHBondContact O-N 2.99Å
232	N	91.1	Very high	85.7	Confident	47 Å²	47	89.7 Å²	89.7	25%	0.251	43%	0.433	S	S	.	.			trans	-61.7	122.6	175.3	-178.6	14.6	0	0	0	109.9	P228 E229 E234 Q235	P228-N232 PolarHBondContact O-N 3.32Å; E229-N232 WeakPolarHBondContact O-CB 3.4Å; E229-N232 PolarHBondContact O-N 3.12Å; N232-E234 PolarHBondContact ND2-OE2 3.33Å; N232-E234 PolarHBondContact O-N 3.11Å; N232-Q235 WeakPolarHBondContact O-CB 3.32Å; N232-Q235 PolarHBondContact O-N 3.48Å
233	C	92.4	Very high	84.8	Confident	10 Å²	10	91.3 Å²	91.3	7%	0.068	44%	0.441	C	S	.	.	G	3₁₀ helix	trans	-62.5	-16.5	-172.3	-53.5	0	0	0	0	114.4	R206 C209 Q210 M231 Q235 F236	R206-C233 HydrophobicContact CG-CB 4.48Å; R206-C233 WeakPolarHBondContact CG-O 3.43Å; R206-C233 PolarHBondContact NE-O 3.21Å; C209-C233 HydrophobicContact CB-CB 3.64Å; C209-C233 WeakPolarHBondContact CB-SG 3.08Å; C209-C233 PolarHBondContact O-SG 3.11Å; C209-C233 VanDerWaalsContact O-SG 3.42Å; C209-C233 WeakPolarHBondContact SG-CA 3.48Å; C209-C233 WeakPolarHBondContact SG-CB 3.48Å; C209-C233 CovalentContact SG-SG 2.04Å; C209-C233 PolarHBondContact SG-SG 3.41Å; Q210-C233 HydrophobicContact CG-CB 4.23Å; M231-C233 PolarHBondContact O-N 2.99Å; C233-Q235 PolarHBondContact O-N 2.72Å; C233-F236 PolarHBondContact O-N 3.34Å
234	E	89.3	Confident	84	Confident	142 Å²	142	87 Å²	87	66%	0.664	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-66.9	-19.1	172.8	-62	177.3	135.7	0	0	113.5	R206 N232 F236	R206-E234 PolarHBondContact NH2-O 3.39Å; N232-E234 PolarHBondContact ND2-OE2 3.33Å; N232-E234 PolarHBondContact O-N 3.11Å; E234-F236 VanDerWaalsContact C-N 3.34Å
235	Q	87.9	Confident	83.4	Confident	108 Å²	108	83.2 Å²	83.2	51%	0.505	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-76.6	-21.7	174.6	-65.6	163.3	10	0	0	112.5	E229 N232 C233	E229-Q235 PolarHBondContact O-NE2 2.96Å; N232-Q235 WeakPolarHBondContact O-CB 3.32Å; N232-Q235 PolarHBondContact O-N 3.48Å; C233-Q235 PolarHBondContact O-N 2.72Å
236	F	89.9	Confident	83.1	Confident	3 Å²	3	81.8 Å²	81.8	1%	0.013	42%	0.424	C	S	.	.	S	Bend	trans	-89.9	141.9	-179.3	-60.1	-57.1	0	0	0	111.8	M154 I189 P203 P204 R206 C209 C233 E234	M154-F236 HydrophobicContact CE-CE1 3.92Å; M154-F236 HydrophobicContact CE-CZ 4.16Å; M154-F236 HydrophobicContact SD-CE1 4.06Å; I189-F236 HydrophobicContact CD1-CE1 4.3Å; I189-F236 HydrophobicContact CD1-CE2 4.33Å; I189-F236 HydrophobicContact CD1-CZ 3.58Å; I189-F236 HydrophobicContact CG1-CE1 4.28Å; I189-F236 HydrophobicContact CG1-CZ 4.05Å; P203-F236 HydrophobicContact CB-CD1 4.2Å; P204-F236 HydrophobicContact CG-CD1 3.9Å; P204-F236 HydrophobicContact CG-CE1 3.82Å; P204-F236 HydrophobicContact CG-CG 4.37Å; P204-F236 HydrophobicContact CG-CZ 4.22Å; R206-F236 HydrophobicContact CB-CB 4.35Å; R206-F236 PolarHBondContact NE-O 3.3Å; R206-F236 PolarHBondContact NH2-O 2.96Å; C209-F236 HydrophobicContact CB-CD2 3.67Å; C209-F236 HydrophobicContact CB-CE2 4.03Å; C233-F236 PolarHBondContact O-N 3.34Å; E234-F236 VanDerWaalsContact C-N 3.34Å
237	P	89.1	Confident	83	Confident	19 Å²	19	78 Å²	78	12%	0.123	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-69.6	154.5	175.4	30.9	-37.1	0	0	0	111.9	P203 R206 I245 C247	P203-P237 HydrophobicContact CB-CG 4.39Å; P203-P237 HydrophobicContact CG-CG 3.56Å; R206-P237 WeakPolarHBondContact CB-O 3.46Å; R206-P237 PolarHBondContact N-O 3.45Å; P237-I245 HydrophobicContact CB-CB 4.47Å; P237-I245 HydrophobicContact CB-CG2 4.31Å; P237-I245 HydrophobicContact CG-CG2 4.19Å; P237-C247 HydrophobicContact CG-CB 3.75Å
238	E	84.8	Confident	82.8	Confident	103 Å²	103	78.2 Å²	78.2	48%	0.481	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-83.1	150.4	173.1	-72.5	171	-170.5	0	0	111.1	R206 N240 N241	R206-E238 HydrophobicContact CB-CG 4.03Å; R206-E238 WeakPolarHBondContact CD-OE1 3.46Å; R206-E238 HydrophobicContact CG-CG 4.36Å; R206-E238 IonicContact CZ-OE1 3.47Å; R206-E238 IonicContact NE-OE1 3.61Å; R206-E238 IonicContact NH1-OE1 2.83Å; R206-E238 PolarHBondContact NH1-OE1 3.48Å; E238-N240 PolarHBondContact O-N 3.33Å; E238-N241 WeakPolarHBondContact O-CB 3.26Å; E238-N241 PolarHBondContact O-N 2.97Å
239	Y	78	Confident	82.4	Confident	143 Å²	143	79.2 Å²	79.2	56%	0.561	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	131.2	175.1	-171.2	-99.9	0	0	0	109.6	E249	Y239-E249 HydrophobicContact CD2-CB 4.14Å; Y239-E249 HydrophobicContact CE2-CB 4.33Å
240	N	71.2	Confident	81.9	Confident	138 Å²	138	73.1 Å²	73.1	74%	0.738	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.7	39.7	-170.5	-58.1	-25.5	0	0	0	114.9	E238	E238-N240 PolarHBondContact O-N 3.33Å
241	N	77.5	Confident	81	Confident	24 Å²	24	74.9 Å²	74.9	13%	0.128	39%	0.392	C	S	.	.			trans	-61.2	150.1	175.8	86.6	-2.5	0	0	0	112.7	E238 Q243 G244 I245	E238-N241 WeakPolarHBondContact O-CB 3.26Å; E238-N241 PolarHBondContact O-N 2.97Å; N241-Q243 PolarHBondContact ND2-OE1 2.91Å; N241-Q243 PolarHBondContact O-N 3.33Å; N241-Q243 PolarHBondContact OD1-N 3.46Å; N241-G244 PolarHBondContact O-N 3.39Å; N241-G244 PolarHBondContact OD1-N 2.81Å; N241-I245 PolarHBondContact OD1-N 3.23Å
242	P	65.3	Low	79.8	Confident	140 Å²	140	76.6 Å²	76.6	91%	0.909	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-1.5	-178.4	29	-36.4	0	0	0	114
243	Q	67.5	Low	78.4	Confident	151 Å²	151	77.7 Å²	77.7	71%	0.706	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-7.7	176.6	-64.9	170.9	-22.8	0	0	112.4	N241 I245	N241-Q243 PolarHBondContact ND2-OE1 2.91Å; N241-Q243 PolarHBondContact O-N 3.33Å; N241-Q243 PolarHBondContact OD1-N 3.46Å; Q243-I245 VanDerWaalsContact C-N 3.27Å; Q243-I245 HydrophobicContact CB-CD1 4.11Å; Q243-I245 HydrophobicContact CB-CG1 3.96Å; Q243-I245 PolarHBondContact O-N 2.94Å
244	G	69.9	Low	76.5	Confident	59 Å²	59	84 Å²	84	61%	0.608	44%	0.438	S	S	*	.			trans	69.8	21.2	-178.4	0	0	0	0	0	114.1	N241 L246	N241-G244 PolarHBondContact O-N 3.39Å; N241-G244 PolarHBondContact OD1-N 2.81Å; G244-L246 PolarHBondContact O-N 3.4Å
245	I	75.1	Confident	74.9	Confident	76 Å²	76	84.5 Å²	84.5	39%	0.39	44%	0.44	S	S	.	.			trans	-79.5	114.3	177.3	-55.6	176.6	0	0	0	107.8	P237 N241 Q243	P237-I245 HydrophobicContact CB-CB 4.47Å; P237-I245 HydrophobicContact CB-CG2 4.31Å; P237-I245 HydrophobicContact CG-CG2 4.19Å; N241-I245 PolarHBondContact OD1-N 3.23Å; Q243-I245 VanDerWaalsContact C-N 3.27Å; Q243-I245 HydrophobicContact CB-CD1 4.11Å; Q243-I245 HydrophobicContact CB-CG1 3.96Å; Q243-I245 PolarHBondContact O-N 2.94Å
246	L	81.9	Confident	73.5	Confident	105 Å²	105	80.2 Å²	80.2	55%	0.55	42%	0.421	S	S	.	.			trans	-64.5	143.1	174.9	-72.9	77.7	0	0	0	109.8	L202 G244	L202-L246 HydrophobicContact CD1-CB 3.59Å; L202-L246 WeakPolarHBondContact CD1-O 3.01Å; G244-L246 PolarHBondContact O-N 3.4Å
247	C	87.8	Confident	71.9	Confident	21 Å²	21	84.4 Å²	84.4	14%	0.142	44%	0.44	C	S	.	.			trans	-140	156.1	171.9	70.8	0	0	0	0	110	P203 C205 P237	P203-C247 HydrophobicContact CG-CB 4.42Å; P203-C247 CarbonylContact O-C 3.57Å; P203-C247 VanDerWaalsContact O-CA 3.28Å; P203-C247 WeakPolarHBondContact O-CA 3.45Å; C205-C247 VanDerWaalsContact CA-SG 3.54Å; C205-C247 HydrophobicContact CB-CB 3.98Å; C205-C247 WeakPolarHBondContact CB-SG 3.48Å; C205-C247 WeakPolarHBondContact SG-CB 3.42Å; C205-C247 PolarHBondContact SG-O 2.62Å; C205-C247 CovalentContact SG-SG 2.04Å; C205-C247 PolarHBondContact SG-SG 2.94Å; P237-C247 HydrophobicContact CG-CB 3.75Å
248	M	85.3	Confident	70.2	Confident	30 Å²	30	88.1 Å²	88.1	15%	0.148	46%	0.458	C	S	.	.	B	Isolated β-bridge	trans	-94.9	119.4	-177.7	-163.7	171.9	46.9	0	0	110.6	Y146 F184 S188 L202 P203 C205 I208	Y146-M248 HydrophobicContact CE1-CE 3.97Å; Y146-M248 HydrophobicContact CE1-SD 4.24Å; F184-M248 HydrophobicContact CE1-CE 3.82Å; F184-M248 HydrophobicContact CE1-CG 4.22Å; F184-M248 HydrophobicContact CE1-SD 4.44Å; F184-M248 HydrophobicContact CZ-CE 3.69Å; F184-M248 HydrophobicContact CZ-CG 3.8Å; F184-M248 HydrophobicContact CZ-SD 3.81Å; S188-M248 WeakPolarHBondContact OG-CE 3.4Å; L202-M248 HydrophobicContact CD2-CB 4.48Å; P203-M248 PolarHBondContact O-N 3.45Å; C205-M248 PolarHBondContact N-O 3.36Å; C205-M248 PolarHBondContact SG-O 2.87Å; I208-M248 WeakPolarHBondContact CD1-O 3.4Å
249	E	81.5	Confident	68.7	Low	54 Å²	54	88.6 Å²	88.6	25%	0.252	46%	0.461	S	S	.	.			trans	-111.1	154.3	174.9	179.6	57.4	-81	0	0	109.8	C205 S207 I208 R211 Y239	C205-E249 HydrophobicContact CB-CB 4.47Å; S207-E249 VanDerWaalsContact CB-OE2 3.23Å; S207-E249 WeakPolarHBondContact CB-OE2 3.41Å; S207-E249 PolarHBondContact OG-OE2 2.92Å; I208-E249 VanDerWaalsContact CG1-OE1 3.31Å; I208-E249 WeakPolarHBondContact CG1-OE1 3.48Å; R211-E249 IonicContact CZ-OE1 2.71Å; R211-E249 IonicContact NH1-OE1 3.6Å; R211-E249 PolarHBondContact NH1-OE1 3.04Å; R211-E249 IonicContact NH1-OE2 3.65Å; R211-E249 PolarHBondContact NH1-OE2 3Å; R211-E249 VanDerWaalsContact NH1-OE2 3.09Å; R211-E249 IonicContact NH2-OE1 3.89Å; R211-E249 PolarHBondContact NH2-OE1 3.13Å; Y239-E249 HydrophobicContact CD2-CB 4.14Å; Y239-E249 HydrophobicContact CE2-CB 4.33Å
250	R	79.2	Confident	67.6	Low	40 Å²	40	84.5 Å²	84.5	15%	0.151	45%	0.448	C	S	.	.			trans	-95.8	131.1	169.4	-176.3	-179.7	62.5	84.2	-6.2	110.1	D181 L252 E256	D181-R250 IonicContact OD1-CZ 2.88Å; D181-R250 IonicContact OD1-NE 3.89Å; D181-R250 PolarHBondContact OD1-NE 3.46Å; D181-R250 IonicContact OD1-NH2 3.75Å; D181-R250 PolarHBondContact OD1-NH2 3.35Å; D181-R250 IonicContact OD2-CZ 3.46Å; D181-R250 IonicContact OD2-NE 3.72Å; D181-R250 IonicContact OD2-NH2 3.12Å; D181-R250 PolarHBondContact OD2-NH2 2.94Å; D181-R250 VanDerWaalsContact OD2-NH2 3.14Å; R250-L252 PolarHBondContact O-N 3.32Å; R250-E256 IonicContact CZ-OE2 2.72Å; R250-E256 IonicContact NH1-OE1 2.69Å; R250-E256 IonicContact NH1-OE2 2.89Å; R250-E256 PolarHBondContact NH1-OE2 2.94Å; R250-E256 IonicContact NH2-OE1 3.7Å; R250-E256 IonicContact NH2-OE2 2.79Å; R250-E256 PolarHBondContact NH2-OE2 3.31Å; R250-E256 VanDerWaalsContact NH2-OE2 3.12Å
251	N	67.9	Low	66.7	Low	156 Å²	156	83.4 Å²	83.4	83%	0.834	44%	0.439	S	S	*	.			trans	-60.3	109.5	167.1	-79.1	-15	0	0	0	110.1
252	L	63	Low	65.2	Low	39 Å²	39	84.4 Å²	84.4	20%	0.204	45%	0.447	C	S	.	.			trans	-69.8	142.4	172.4	-69.5	148.3	0	0	0	109.5	R250 E256 Q257 L260	R250-L252 PolarHBondContact O-N 3.32Å; L252-E256 HydrophobicContact CB-CB 4.25Å; L252-E256 HydrophobicContact CD2-CB 3.88Å; L252-Q257 HydrophobicContact CB-CG 3.79Å; L252-L260 HydrophobicContact CD1-CD1 3.59Å; L252-L260 HydrophobicContact CD2-CD1 3.74Å; L252-L260 HydrophobicContact CG-CD1 4.29Å
253	T	62.3	Low	64.6	Low	71 Å²	71	81.6 Å²	81.6	44%	0.436	42%	0.424	S	S	.	.			trans	-69	159.3	170.8	71.7	0	0	0	0	110.1	E255 E256 Q257	T253-E255 PolarHBondContact O-N 2.87Å; T253-E255 VanDerWaalsContact O-N 3.12Å; T253-E256 PolarHBondContact N-OE2 3.45Å; T253-E256 PolarHBondContact O-N 3.45Å; T253-E256 WeakPolarHBondContact OG1-CG 3.04Å; T253-E256 PolarHBondContact OG1-N 3.45Å; T253-E256 VanDerWaalsContact OG1-N 3.16Å; T253-Q257 WeakPolarHBondContact O-CG 3.02Å; T253-Q257 PolarHBondContact O-N 3.19Å
254	H	51.1	Low	63.7	Low	143 Å²	143	79.6 Å²	79.6	66%	0.662	42%	0.418	S	S	*	.	H	α-helix	trans	-58.4	-28.5	177.7	-162.2	-19.8	0	0	0	112.3	L258	H254-L258 WeakPolarHBondContact O-CD1 3.44Å; H254-L258 WeakPolarHBondContact O-CG 3.34Å; H254-L258 PolarHBondContact O-N 3.29Å
255	E	56.2	Low	62.9	Low	151 Å²	151	81.3 Å²	81.3	71%	0.706	41%	0.412	S	S	*	.	H	α-helix	trans	-72.3	-44.7	175.2	-159.7	166.7	-136.5	0	0	111.5	T253 Q257 L258 E259	T253-E255 PolarHBondContact O-N 2.87Å; T253-E255 VanDerWaalsContact O-N 3.12Å; E255-Q257 VanDerWaalsContact C-N 3.34Å; E255-Q257 PolarHBondContact O-N 3.44Å; E255-L258 WeakPolarHBondContact O-CB 3.39Å; E255-L258 PolarHBondContact O-N 3Å; E255-E259 PolarHBondContact O-N 2.86Å
256	E	59.7	Low	61.6	Low	19 Å²	19	83.9 Å²	83.9	9%	0.089	42%	0.421	C	S	.	.	H	α-helix	trans	-66.9	-32.2	174.6	-69.2	175.3	164.7	0	0	112.8	K180 R250 L252 T253 L258 E259 L260	K180-E256 WeakPolarHBondContact CD-OE1 3.33Å; K180-E256 WeakPolarHBondContact CE-OE1 3.45Å; K180-E256 IonicContact NZ-OE1 2.66Å; K180-E256 PolarHBondContact NZ-OE1 3.46Å; R250-E256 IonicContact CZ-OE2 2.72Å; R250-E256 IonicContact NH1-OE1 2.69Å; R250-E256 IonicContact NH1-OE2 2.89Å; R250-E256 PolarHBondContact NH1-OE2 2.94Å; R250-E256 IonicContact NH2-OE1 3.7Å; R250-E256 IonicContact NH2-OE2 2.79Å; R250-E256 PolarHBondContact NH2-OE2 3.31Å; R250-E256 VanDerWaalsContact NH2-OE2 3.12Å; L252-E256 HydrophobicContact CB-CB 4.25Å; L252-E256 HydrophobicContact CD2-CB 3.88Å; T253-E256 PolarHBondContact N-OE2 3.45Å; T253-E256 PolarHBondContact O-N 3.45Å; T253-E256 WeakPolarHBondContact OG1-CG 3.04Å; T253-E256 PolarHBondContact OG1-N 3.45Å; T253-E256 VanDerWaalsContact OG1-N 3.16Å; E256-L258 VanDerWaalsContact C-N 3.35Å; E256-E259 PolarHBondContact O-N 3.24Å; E256-L260 WeakPolarHBondContact O-CG 3.48Å; E256-L260 PolarHBondContact O-N 3.05Å
257	Q	56.3	Low	60	Low	91 Å²	91	82.8 Å²	82.8	43%	0.425	42%	0.415	S	S	.	.	H	α-helix	trans	-64.8	-39	171.8	-70.9	177.8	-14.2	0	0	111.7	L252 T253 E255 Q261	L252-Q257 HydrophobicContact CB-CG 3.79Å; T253-Q257 WeakPolarHBondContact O-CG 3.02Å; T253-Q257 PolarHBondContact O-N 3.19Å; E255-Q257 VanDerWaalsContact C-N 3.34Å; E255-Q257 PolarHBondContact O-N 3.44Å; Q257-Q261 WeakPolarHBondContact O-CG 3.41Å; Q257-Q261 PolarHBondContact O-N 3.37Å
258	L	53	Low	57.8	Low	97 Å²	97	88.9 Å²	88.9	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-68.9	-38.6	174.5	-76.9	162.8	0	0	0	111.9	H254 E255 E256 Q261 S262	H254-L258 WeakPolarHBondContact O-CD1 3.44Å; H254-L258 WeakPolarHBondContact O-CG 3.34Å; H254-L258 PolarHBondContact O-N 3.29Å; E255-L258 WeakPolarHBondContact O-CB 3.39Å; E255-L258 PolarHBondContact O-N 3Å; E256-L258 VanDerWaalsContact C-N 3.35Å; L258-Q261 PolarHBondContact O-N 3.01Å; L258-S262 PolarHBondContact O-N 2.88Å
259	E	54.1	Low	55.9	Low	113 Å²	113	92.9 Å²	92.9	53%	0.528	46%	0.455	S	S	.	.	H	α-helix	trans	-60.9	-46.8	172.9	-71.6	-167.6	129.6	0	0	111.7	E255 E256 Q261 S262 I263	E255-E259 PolarHBondContact O-N 2.86Å; E256-E259 PolarHBondContact O-N 3.24Å; E259-Q261 PolarHBondContact O-N 3.46Å; E259-S262 WeakPolarHBondContact O-CA 3.46Å; E259-S262 WeakPolarHBondContact O-CB 3.48Å; E259-S262 PolarHBondContact O-N 2.88Å; E259-S262 VanDerWaalsContact O-N 3.08Å; E259-S262 PolarHBondContact O-OG 3.34Å; E259-I263 WeakPolarHBondContact O-CG1 3.37Å; E259-I263 PolarHBondContact O-N 3.01Å
260	L	55	Low	54.2	Low	57 Å²	57	92.8 Å²	92.8	30%	0.298	46%	0.46	S	S	.	.	H	α-helix	trans	-61.3	-40.8	176.4	-75.9	167.7	0	0	0	112.7	R211 L252 E256 S262 I263 N264	R211-L260 HydrophobicContact CG-CD2 4.42Å; L252-L260 HydrophobicContact CD1-CD1 3.59Å; L252-L260 HydrophobicContact CD2-CD1 3.74Å; L252-L260 HydrophobicContact CG-CD1 4.29Å; E256-L260 WeakPolarHBondContact O-CG 3.48Å; E256-L260 PolarHBondContact O-N 3.05Å; L260-S262 VanDerWaalsContact C-N 3.32Å; L260-S262 PolarHBondContact O-N 3Å; L260-I263 PolarHBondContact O-N 3.24Å; L260-N264 PolarHBondContact O-N 3.26Å
261	Q	51	Low	52.8	Low	115 Å²	115	95.7 Å²	95.7	54%	0.537	48%	0.477	S	S	.	.	H	α-helix	trans	-62.1	-39.8	172.1	-74.8	176.6	-10.8	0	0	111.6	Q257 L258 E259 I263 N264 I265	Q257-Q261 WeakPolarHBondContact O-CG 3.41Å; Q257-Q261 PolarHBondContact O-N 3.37Å; L258-Q261 PolarHBondContact O-N 3.01Å; E259-Q261 PolarHBondContact O-N 3.46Å; Q261-I263 VanDerWaalsContact C-N 3.33Å; Q261-I263 PolarHBondContact O-N 3.45Å; Q261-N264 PolarHBondContact O-N 3.09Å; Q261-I265 VanDerWaalsContact O-CG1 3.31Å; Q261-I265 WeakPolarHBondContact O-CG1 3.27Å; Q261-I265 PolarHBondContact O-N 3.12Å
262	S	46.5	Very low	51.6	Low	44 Å²	44	91.8 Å²	91.8	31%	0.308	45%	0.454	S	S	.	.	H	α-helix	trans	-65.1	-34.3	176.7	88.2	0	0	0	0	113.1	L258 E259 L260 K266	L258-S262 PolarHBondContact O-N 2.88Å; E259-S262 WeakPolarHBondContact O-CA 3.46Å; E259-S262 WeakPolarHBondContact O-CB 3.48Å; E259-S262 PolarHBondContact O-N 2.88Å; E259-S262 VanDerWaalsContact O-N 3.08Å; E259-S262 PolarHBondContact O-OG 3.34Å; L260-S262 VanDerWaalsContact C-N 3.32Å; L260-S262 PolarHBondContact O-N 3Å; S262-K266 WeakPolarHBondContact O-CB 3.3Å; S262-K266 VanDerWaalsContact O-CG 3.29Å; S262-K266 WeakPolarHBondContact O-CG 3.2Å; S262-K266 PolarHBondContact O-N 3.42Å
263	I	52.8	Low	50.6	Low	82 Å²	82	94 Å²	94	42%	0.421	47%	0.473	S	S	.	.	H	α-helix	trans	-69.5	-44.7	176.2	-67.3	164.6	0	0	0	109.9	E259 L260 Q261 I265 K266 N267	E259-I263 WeakPolarHBondContact O-CG1 3.37Å; E259-I263 PolarHBondContact O-N 3.01Å; L260-I263 PolarHBondContact O-N 3.24Å; Q261-I263 VanDerWaalsContact C-N 3.33Å; Q261-I263 PolarHBondContact O-N 3.45Å; I263-I265 VanDerWaalsContact C-N 3.33Å; I263-I265 PolarHBondContact O-N 3.35Å; I263-K266 PolarHBondContact O-N 3.44Å; I263-N267 WeakPolarHBondContact O-CB 3.4Å; I263-N267 VanDerWaalsContact O-CG 3.31Å; I263-N267 PolarHBondContact O-N 2.9Å
264	N	47.5	Very low	50	Low	109 Å²	109	96.7 Å²	96.7	58%	0.583	48%	0.483	S	S	*	.	H	α-helix	trans	-61.8	-39.3	175.4	-75.1	-16.2	0	0	0	112.3	L260 Q261 Y268	L260-N264 PolarHBondContact O-N 3.26Å; Q261-N264 PolarHBondContact O-N 3.09Å; N264-Y268 VanDerWaalsContact O-CB 3.25Å; N264-Y268 WeakPolarHBondContact O-CB 3.14Å; N264-Y268 PolarHBondContact O-N 2.86Å
265	I	53.5	Low	49.5	Very low	95 Å²	95	93.9 Å²	93.9	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-66.3	-44.4	175.3	-68.6	164.4	0	0	0	111.3	Q261 I263 Y268 Q269	Q261-I265 VanDerWaalsContact O-CG1 3.31Å; Q261-I265 WeakPolarHBondContact O-CG1 3.27Å; Q261-I265 PolarHBondContact O-N 3.12Å; I263-I265 VanDerWaalsContact C-N 3.33Å; I263-I265 PolarHBondContact O-N 3.35Å; I265-Y268 PolarHBondContact O-N 2.86Å; I265-Q269 HydrophobicContact CG2-CG 4.49Å; I265-Q269 WeakPolarHBondContact O-CB 3.39Å; I265-Q269 VanDerWaalsContact O-CG 3.3Å; I265-Q269 WeakPolarHBondContact O-CG 3.36Å; I265-Q269 PolarHBondContact O-N 3.05Å
266	K	47.5	Very low	48.9	Very low	130 Å²	130	92 Å²	92	57%	0.565	46%	0.464	S	S	*	.	H	α-helix	trans	-62	-44.9	176.4	-76.1	167.9	-179	169.2	0	112	S262 I263 Q269 S270	S262-K266 WeakPolarHBondContact O-CB 3.3Å; S262-K266 VanDerWaalsContact O-CG 3.29Å; S262-K266 WeakPolarHBondContact O-CG 3.2Å; S262-K266 PolarHBondContact O-N 3.42Å; I263-K266 PolarHBondContact O-N 3.44Å; K266-Q269 PolarHBondContact O-N 3.46Å; K266-S270 PolarHBondContact O-N 2.87Å; K266-S270 PolarHBondContact O-OG 3.46Å
267	N	49.9	Very low	48	Very low	82 Å²	82	95.6 Å²	95.6	44%	0.439	49%	0.492	S	S	.	.	H	α-helix	trans	-64	-40.6	176.9	-72.3	-7.2	0	0	0	111.4	I263 S270 I271	I263-N267 WeakPolarHBondContact O-CB 3.4Å; I263-N267 VanDerWaalsContact O-CG 3.31Å; I263-N267 PolarHBondContact O-N 2.9Å; N267-S270 WeakPolarHBondContact CA-OG 3.45Å; N267-S270 PolarHBondContact O-N 3.46Å; N267-S270 PolarHBondContact O-OG 2.91Å; N267-I271 VanDerWaalsContact O-CB 3.32Å; N267-I271 WeakPolarHBondContact O-CB 3.24Å; N267-I271 WeakPolarHBondContact O-CD1 3.44Å; N267-I271 WeakPolarHBondContact O-CG1 3.35Å; N267-I271 PolarHBondContact O-N 2.84Å
268	Y	40.7	Very low	47.4	Very low	148 Å²	148	94.4 Å²	94.4	58%	0.58	49%	0.493	S	S	*	.	H	α-helix	trans	-62.3	-42.5	174.1	-172	-102.9	0	0	0	111.7	N264 I265 I271 Q272	N264-Y268 VanDerWaalsContact O-CB 3.25Å; N264-Y268 WeakPolarHBondContact O-CB 3.14Å; N264-Y268 PolarHBondContact O-N 2.86Å; I265-Y268 PolarHBondContact O-N 2.86Å; Y268-I271 PolarHBondContact O-N 3.33Å; Y268-Q272 HydrophobicContact CD1-CG 4.36Å; Y268-Q272 VanDerWaalsContact CE1-CD 3.4Å; Y268-Q272 HydrophobicContact CE1-CG 4.15Å; Y268-Q272 VanDerWaalsContact CE1-NE2 3.29Å; Y268-Q272 WeakPolarHBondContact O-CB 3.25Å; Y268-Q272 WeakPolarHBondContact O-CG 3.25Å; Y268-Q272 PolarHBondContact O-N 3.23Å; Y268-Q272 PolarHBondContact OH-NE2 3.03Å
269	Q	45.8	Very low	47.2	Very low	114 Å²	114	92.5 Å²	92.5	53%	0.533	48%	0.483	S	S	.	.	H	α-helix	trans	-66.4	-40.9	176.5	-73.7	171.4	-21.6	0	0	112.6	I265 K266 Q272 S273	I265-Q269 HydrophobicContact CG2-CG 4.49Å; I265-Q269 WeakPolarHBondContact O-CB 3.39Å; I265-Q269 VanDerWaalsContact O-CG 3.3Å; I265-Q269 WeakPolarHBondContact O-CG 3.36Å; I265-Q269 PolarHBondContact O-N 3.05Å; K266-Q269 PolarHBondContact O-N 3.46Å; Q269-Q272 PolarHBondContact O-N 3.22Å; Q269-S273 PolarHBondContact O-N 3.42Å
270	S	46.1	Very low	46.7	Very low	52 Å²	52	92 Å²	92	36%	0.364	48%	0.484	S	S	.	.	H	α-helix	trans	-67.4	-38.7	174.1	56.6	0	0	0	0	112.3	K266 N267 S273 I274	K266-S270 PolarHBondContact O-N 2.87Å; K266-S270 PolarHBondContact O-OG 3.46Å; N267-S270 WeakPolarHBondContact CA-OG 3.45Å; N267-S270 PolarHBondContact O-N 3.46Å; N267-S270 PolarHBondContact O-OG 2.91Å; S270-S273 PolarHBondContact O-N 2.84Å; S270-S273 PolarHBondContact O-OG 3.4Å; S270-I274 WeakPolarHBondContact O-CD1 3.36Å; S270-I274 WeakPolarHBondContact O-CG1 3.47Å; S270-I274 PolarHBondContact O-N 3.2Å
271	I	48.7	Very low	46.3	Very low	101 Å²	101	96.3 Å²	96.3	52%	0.518	50%	0.503	S	S	.	.	H	α-helix	trans	-68	-38.6	176.6	-70.1	165.4	0	0	0	111.2	N267 Y268 I274 N275	N267-I271 VanDerWaalsContact O-CB 3.32Å; N267-I271 WeakPolarHBondContact O-CB 3.24Å; N267-I271 WeakPolarHBondContact O-CD1 3.44Å; N267-I271 WeakPolarHBondContact O-CG1 3.35Å; N267-I271 PolarHBondContact O-N 2.84Å; Y268-I271 PolarHBondContact O-N 3.33Å; I271-I274 PolarHBondContact O-N 3.03Å; I271-N275 PolarHBondContact O-N 3.45Å
272	Q	43	Very low	45.9	Very low	75 Å²	75	96.4 Å²	96.4	35%	0.35	51%	0.506	S	S	.	.	H	α-helix	trans	-61.8	-46.6	172.1	-77.9	-172.3	-38.1	0	0	111.5	Y268 Q269 I274 N275 Q276	Y268-Q272 HydrophobicContact CD1-CG 4.36Å; Y268-Q272 VanDerWaalsContact CE1-CD 3.4Å; Y268-Q272 HydrophobicContact CE1-CG 4.15Å; Y268-Q272 VanDerWaalsContact CE1-NE2 3.29Å; Y268-Q272 WeakPolarHBondContact O-CB 3.25Å; Y268-Q272 WeakPolarHBondContact O-CG 3.25Å; Y268-Q272 PolarHBondContact O-N 3.23Å; Y268-Q272 PolarHBondContact OH-NE2 3.03Å; Q269-Q272 PolarHBondContact O-N 3.22Å; Q272-I274 PolarHBondContact O-N 3.12Å; Q272-I274 VanDerWaalsContact O-N 3.09Å; Q272-N275 PolarHBondContact O-N 2.93Å; Q272-N275 VanDerWaalsContact O-N 3.08Å; Q272-Q276 PolarHBondContact O-N 2.99Å; Q272-Q276 PolarHBondContact O-OE1 3.32Å
273	S	41.7	Very low	45.7	Very low	85 Å²	85	98.5 Å²	98.5	59%	0.594	51%	0.514	S	S	*	.	H	α-helix	trans	-61.1	-21.1	179.6	73.1	0	0	0	0	114.5	Q269 S270	Q269-S273 PolarHBondContact O-N 3.42Å; S270-S273 PolarHBondContact O-N 2.84Å; S270-S273 PolarHBondContact O-OG 3.4Å
274	I	49.3	Very low	45.3	Very low	128 Å²	128	101.8 Å²	101.8	66%	0.656	53%	0.528	S	S	*	.	H	α-helix	trans	-88.8	-26.7	178.3	-69.4	167.7	0	0	0	112.3	S270 I271 Q272	S270-I274 WeakPolarHBondContact O-CD1 3.36Å; S270-I274 WeakPolarHBondContact O-CG1 3.47Å; S270-I274 PolarHBondContact O-N 3.2Å; I271-I274 PolarHBondContact O-N 3.03Å; Q272-I274 PolarHBondContact O-N 3.12Å; Q272-I274 VanDerWaalsContact O-N 3.09Å
275	N	40.6	Very low	44.9	Very low	84 Å²	84	102.6 Å²	102.6	45%	0.449	53%	0.531	S	S	.	.	H	α-helix	trans	-106.7	12.7	-177	-83.8	-25.7	0	0	0	114.8	I271 Q272 S277 S278	I271-N275 PolarHBondContact O-N 3.45Å; Q272-N275 PolarHBondContact O-N 2.93Å; Q272-N275 VanDerWaalsContact O-N 3.08Å; N275-S277 PolarHBondContact O-N 2.82Å; N275-S278 PolarHBondContact O-N 3.49Å
276	Q	43.7	Very low	44.3	Very low	110 Å²	110	102.2 Å²	102.2	51%	0.514	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-15.6	-176.4	-151.4	70.6	20.9	0	0	114.4	Q272	Q272-Q276 PolarHBondContact O-N 2.99Å; Q272-Q276 PolarHBondContact O-OE1 3.32Å
277	S	42.1	Very low	44	Very low	96 Å²	96	102.6 Å²	102.6	67%	0.671	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-22.8	176	50.5	0	0	0	0	114.6	N275	N275-S277 PolarHBondContact O-N 2.82Å
278	S	42.6	Very low	43.6	Very low	65 Å²	65	103 Å²	103	46%	0.455	55%	0.554	S	S	.	*	T	Hydrogen-bonded Turn	trans	-100.5	-22	-175.8	-58.2	0	0	0	0	114	N275 N280 Q281	N275-S278 PolarHBondContact O-N 3.49Å; S278-N280 VanDerWaalsContact C-N 3.31Å; S278-N280 PolarHBondContact O-N 3.14Å; S278-Q281 PolarHBondContact O-N 2.99Å
279	I	49	Very low	43.7	Very low	58 Å²	58	103.1 Å²	103.1	30%	0.297	56%	0.563	S	S	.	*	H	α-helix	trans	-67.8	-30.7	-177.1	-66.8	170.3	0	0	0	111.9	Q281 L282 N283	I279-Q281 VanDerWaalsContact C-N 3.29Å; I279-Q281 PolarHBondContact O-N 3.21Å; I279-L282 PolarHBondContact O-N 2.87Å; I279-L282 VanDerWaalsContact O-N 3.15Å; I279-N283 PolarHBondContact O-N 3.4Å
280	N	43.5	Very low	43	Very low	102 Å²	102	106.9 Å²	106.9	55%	0.545	58%	0.581	S	S	.	*	H	α-helix	trans	-65	-29.8	-178.1	-67.8	-20.4	0	0	0	113.4	S278 E284	S278-N280 VanDerWaalsContact C-N 3.31Å; S278-N280 PolarHBondContact O-N 3.14Å; N280-E284 PolarHBondContact O-N 2.9Å
281	Q	47	Very low	42.3	Very low	148 Å²	148	107.7 Å²	107.7	69%	0.692	60%	0.598	S	S	*	*	H	α-helix	trans	-77.4	-22.3	176.7	-68.8	-177.1	-34	0	0	113.2	S278 I279	S278-Q281 PolarHBondContact O-N 2.99Å; I279-Q281 VanDerWaalsContact C-N 3.29Å; I279-Q281 PolarHBondContact O-N 3.21Å
282	L	43.1	Very low	41.7	Very low	117 Å²	117	110.8 Å²	110.8	61%	0.613	61%	0.613	S	S	*	*	H	α-helix	trans	-79	-32.3	172.9	-80.2	157.6	0	0	0	112	I279 E284 L285 S286	I279-L282 PolarHBondContact O-N 2.87Å; I279-L282 VanDerWaalsContact O-N 3.15Å; L282-E284 VanDerWaalsContact C-N 3.34Å; L282-E284 PolarHBondContact O-N 3.32Å; L282-L285 WeakPolarHBondContact O-CB 3.36Å; L282-L285 PolarHBondContact O-N 2.94Å; L282-S286 PolarHBondContact O-N 3.04Å
283	N	41.1	Very low	41.4	Very low	87 Å²	87	111.4 Å²	111.4	47%	0.465	63%	0.626	S	S	.	*	H	α-helix	trans	-69.7	-28.2	177.2	-69.9	-21	0	0	0	113.1	I279 N287	I279-N283 PolarHBondContact O-N 3.4Å; N283-N287 PolarHBondContact O-ND2 3.04Å
284	E	45.1	Very low	41	Very low	152 Å²	152	115.1 Å²	115.1	71%	0.71	64%	0.64	S	S	*	*	H	α-helix	trans	-68.6	-35.9	169.6	-69.8	-171.7	125.4	0	0	112	N280 L282	N280-E284 PolarHBondContact O-N 2.9Å; L282-E284 VanDerWaalsContact C-N 3.34Å; L282-E284 PolarHBondContact O-N 3.32Å
285	L	40.1	Very low	40.5	Very low	125 Å²	125	114.7 Å²	114.7	65%	0.654	65%	0.645	S	S	*	*	H	α-helix	trans	-69.4	-36.8	176.8	-140.1	74.6	0	0	0	112.2	L282 N287 S288	L282-L285 WeakPolarHBondContact O-CB 3.36Å; L282-L285 PolarHBondContact O-N 2.94Å; L285-N287 VanDerWaalsContact C-N 3.27Å; L285-N287 PolarHBondContact O-N 3.25Å; L285-S288 PolarHBondContact O-N 3.45Å; L285-S288 PolarHBondContact O-OG 3.46Å
286	S	39.2	Very low	40	Very low	87 Å²	87	119.3 Å²	119.3	61%	0.608	67%	0.669	S	S	*	*	H	α-helix	trans	-67.8	-19.4	-178.5	-167.9	0	0	0	0	114.6	L282 S288	L282-S286 PolarHBondContact O-N 3.04Å; S286-S288 VanDerWaalsContact C-N 3.26Å; S286-S288 PolarHBondContact O-N 3.37Å
287	N	41.8	Very low	39.6	Very low	139 Å²	139	117.1 Å²	117.1	74%	0.743	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.3	2.6	-179.5	-76.4	-50.5	0	0	0	113.9	N283 L285	N283-N287 PolarHBondContact O-ND2 3.04Å; L285-N287 VanDerWaalsContact C-N 3.27Å; L285-N287 PolarHBondContact O-N 3.25Å
288	S	41.8	Very low	39	Very low	90 Å²	90	119.3 Å²	119.3	63%	0.629	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-5.1	-178.5	65.8	0	0	0	0	115	L285 S286	L285-S288 PolarHBondContact O-N 3.45Å; L285-S288 PolarHBondContact O-OG 3.46Å; S286-S288 VanDerWaalsContact C-N 3.26Å; S286-S288 PolarHBondContact O-N 3.37Å
289	I	42.5	Very low	38.4	Very low	150 Å²	150	121.3 Å²	121.3	77%	0.769	70%	0.699	S	S	*	*			trans	-123	81.5	-174.5	-51.5	-178.9	0	0	0	110.5
290	Q	31.9	Very low	37.6	Very low	194 Å²	194	126.1 Å²	126.1	91%	0.907	73%	0.726	S	S	*	*			trans	-90.3	131.9	164.3	-69.1	-177.9	-48.9	0	0	110.2
291	G	29.9	Very low	36.8	Very low	69 Å²	69	127.1 Å²	127.1	71%	0.711	74%	0.74	S	S	*	*			trans	167.9	140.5	165.7	0	0	0	0	0	116.8
292	I	36.9	Very low	35.9	Very low	165 Å²	165	128.6 Å²	128.6	85%	0.846	75%	0.752	S	S	*	*			trans	77	66.3	156	-43	178.1	0	0	0	117.2
293	S	36.4	Very low	35.3	Very low	89 Å²	89	126.6 Å²	126.6	62%	0.622	76%	0.76	S	S	*	*				49.4	107.1	122.7	64.8	0	0	0	0	122.9
294	D	34.5	Very low	34.7	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	78%	0.78	S	S	*	*				71.8	154.2	113.1	-63.4	-20.2	0	0	0	124.5
295	P	37.3	Very low	34	Very low	118 Å²	118	131.1 Å²	131.1	77%	0.766	79%	0.788	S	S	*	*			trans	-130.2	-177.2	-153.5	43	-25.7	0	0	0	116.1
296	L	31.3	Very low	33.5	Very low	182 Å²	182	134.9 Å²	134.9	95%	0.953	80%	0.799	S	S	*	*			trans	-154	145.5	168.5	-161.9	74.5	0	0	0	113.6
297	G	33.8	Very low	33.1	Very low	64 Å²	64	140 Å²	140	66%	0.66	81%	0.807	S	S	*	*			trans	107.3	42.7	135.7	0	0	0	0	0	121.4
298	T	30.2	Very low	32.6	Very low	141 Å²	141	141.2 Å²	141.2	87%	0.865	81%	0.813	S	S	*	*			trans	-3.1	131.1	152.1	51.8	0	0	0	0	120.3
299	S	30.2	Very low	32.2	Very low	108 Å²	108	145.8 Å²	145.8	76%	0.755	83%	0.825	S	S	*	*				-166.7	160.7	129.2	52.3	0	0	0	0	113.6
300	N	32.6	Very low	31.9	Very low	159 Å²	159	144.8 Å²	144.8	85%	0.85	82%	0.819	S	S	*	*			trans	67.6	94.3	165.9	-61	-13	0	0	0	119.2
301	S	26.9	Very low	32.3	Very low	122 Å²	122	144 Å²	144	85%	0.853	81%	0.813	S	S	*	*			trans	-81.7	111.7	168.1	52.3	0	0	0	0	112.9
302	L	28.3	Very low	32.8	Very low	180 Å²	180	146.1 Å²	146.1	94%	0.942	81%	0.812	S	S	*	*			trans	-159.2	64.6	164.6	-163.9	74	0	0	0	111.8
303	G	29.6	Very low	33.7	Very low	75 Å²	75	144 Å²	144	77%	0.773	80%	0.802	S	S	*	*			trans	-166.1	36.1	-167.4	0	0	0	0	0	118.8
304	T	28.8	Very low	34.8	Very low	145 Å²	145	142 Å²	142	89%	0.89	79%	0.788	S	S	*	*	S	Bend	trans	-136.9	27.5	-175.9	54	0	0	0	0	114.9
305	E	30	Very low	36.5	Very low	189 Å²	189	140.3 Å²	140.3	88%	0.883	78%	0.778	S	S	*	*	S	Bend	trans	-145.3	18.1	-171.9	-144.1	172.9	-149	0	0	115.3
306	K	30.1	Very low	38.3	Very low	203 Å²	203	142 Å²	142	88%	0.883	78%	0.775	S	S	*	*	S	Bend	trans	-135.5	21.1	-173.8	-148.1	-171.8	175	-177	0	116.2
307	Y	30	Very low	40.2	Very low	196 Å²	196	136.7 Å²	136.7	77%	0.769	75%	0.748	S	S	*	*	S	Bend	trans	-111.7	-17.1	179.6	-104.5	-87.1	0	0	0	115.4	Q309 I310	Y307-Q309 PolarHBondContact O-N 3.21Å; Y307-Q309 VanDerWaalsContact O-N 3.08Å; Y307-I310 HydrophobicContact CD1-CD1 4.35Å; Y307-I310 HydrophobicContact CE1-CD1 4.36Å
308	D	31.4	Very low	42.1	Very low	163 Å²	163	137.5 Å²	137.5	87%	0.872	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.7	10.7	-174.8	-62.7	-43.6	0	0	0	115.6
309	Q	33.3	Very low	44.5	Very low	187 Å²	187	136.9 Å²	136.9	87%	0.874	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	0	177.5	-70.4	-163.7	-14.4	0	0	114.7	Y307 K311	Y307-Q309 PolarHBondContact O-N 3.21Å; Y307-Q309 VanDerWaalsContact O-N 3.08Å; Q309-K311 PolarHBondContact O-N 2.74Å
310	I	37.1	Very low	47	Very low	128 Å²	128	136.2 Å²	136.2	66%	0.656	71%	0.711	S	S	*	*			trans	-76.6	77.2	168.3	-53.7	178.7	0	0	0	108.6	Y307 T312	Y307-I310 HydrophobicContact CD1-CD1 4.35Å; Y307-I310 HydrophobicContact CE1-CD1 4.36Å; I310-T312 PolarHBondContact O-N 3.46Å
311	K	39	Very low	49.4	Very low	177 Å²	177	132.3 Å²	132.3	77%	0.77	69%	0.686	S	S	*	*			trans	-70.1	94.8	173	-171.6	178.6	-179.4	-176	0	109.2	Q309 L313	Q309-K311 PolarHBondContact O-N 2.74Å; K311-L313 PolarHBondContact O-N 2.86Å
312	T	42.4	Very low	52.2	Low	115 Å²	115	130.5 Å²	130.5	71%	0.706	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-53.3	129.2	166	43.1	0	0	0	0	109.3	I310 S314	I310-T312 PolarHBondContact O-N 3.46Å; T312-S314 PolarHBondContact O-N 3.42Å
313	L	55	Low	55.1	Low	121 Å²	121	127.4 Å²	127.4	63%	0.634	65%	0.648	S	S	*	*	P	Polyproline II helix	trans	-62.5	132.4	167	-83	78	0	0	0	107.3	K311 D317 I318	K311-L313 PolarHBondContact O-N 2.86Å; L313-D317 HydrophobicContact CB-CB 4.5Å; L313-I318 HydrophobicContact CB-CD1 4.43Å; L313-I318 HydrophobicContact CB-CG1 4.31Å; L313-I318 HydrophobicContact CD2-CG1 4.38Å
314	S	58.3	Low	57.9	Low	46 Å²	46	126.1 Å²	126.1	32%	0.322	62%	0.621	S	S	.	*	P	Polyproline II helix	trans	-68	157.6	171.5	63.2	0	0	0	0	109.8	T312 E316 D317 I318	T312-S314 PolarHBondContact O-N 3.42Å; S314-E316 PolarHBondContact O-N 2.77Å; S314-D317 PolarHBondContact O-N 3.49Å; S314-D317 PolarHBondContact OG-N 3.37Å; S314-I318 PolarHBondContact O-N 2.82Å
315	I	71.1	Confident	60.8	Low	128 Å²	128	119.9 Å²	119.9	66%	0.656	58%	0.582	S	S	*	*	H	α-helix	trans	-59.1	-35.1	170.7	-66.2	163.4	0	0	0	109.6	D317 I318 E319	I315-D317 PolarHBondContact O-N 2.95Å; I315-I318 WeakPolarHBondContact O-CB 3.26Å; I315-I318 PolarHBondContact O-N 3.18Å; I315-I318 VanDerWaalsContact O-N 3.13Å; I315-E319 HydrophobicContact CG2-CG 4.21Å; I315-E319 WeakPolarHBondContact O-CG 3.32Å; I315-E319 PolarHBondContact O-N 3.37Å
316	E	75.4	Confident	63.7	Low	152 Å²	152	116.1 Å²	116.1	71%	0.71	57%	0.568	S	S	*	*	H	α-helix	trans	-59.9	-42.9	173.9	-54.1	176.4	154.2	0	0	113.3	S314 I318 E319 L320	S314-E316 PolarHBondContact O-N 2.77Å; E316-I318 PolarHBondContact O-N 2.92Å; E316-E319 PolarHBondContact O-N 2.96Å; E316-L320 WeakPolarHBondContact O-CB 3.06Å; E316-L320 PolarHBondContact O-N 3.33Å
317	D	70.1	Confident	66.6	Low	71 Å²	71	110.4 Å²	110.4	38%	0.38	55%	0.547	S	S	.	.	H	α-helix	trans	-63.8	-31	175.8	-89.2	-35.1	0	0	0	111.4	L313 S314 I315 K321	L313-D317 HydrophobicContact CB-CB 4.5Å; S314-D317 PolarHBondContact O-N 3.49Å; S314-D317 PolarHBondContact OG-N 3.37Å; I315-D317 PolarHBondContact O-N 2.95Å; D317-K321 WeakPolarHBondContact O-CB 3.43Å; D317-K321 PolarHBondContact O-N 2.95Å
318	I	74.8	Confident	69.5	Low	81 Å²	81	101.2 Å²	101.2	42%	0.415	51%	0.512	S	S	.	.	H	α-helix	trans	-78.3	-46.5	177.7	-62.3	170.1	0	0	0	110.9	L313 S314 I315 E316 L320 K321 N322	L313-I318 HydrophobicContact CB-CD1 4.43Å; L313-I318 HydrophobicContact CB-CG1 4.31Å; L313-I318 HydrophobicContact CD2-CG1 4.38Å; S314-I318 PolarHBondContact O-N 2.82Å; I315-I318 WeakPolarHBondContact O-CB 3.26Å; I315-I318 PolarHBondContact O-N 3.18Å; I315-I318 VanDerWaalsContact O-N 3.13Å; E316-I318 PolarHBondContact O-N 2.92Å; I318-L320 PolarHBondContact O-N 3.35Å; I318-K321 PolarHBondContact O-N 3.38Å; I318-N322 VanDerWaalsContact O-CG 3.31Å; I318-N322 PolarHBondContact O-N 3.43Å
319	E	80.9	Confident	72.4	Confident	129 Å²	129	93.9 Å²	93.9	60%	0.603	47%	0.473	S	S	*	.	H	α-helix	trans	-59.9	-45.4	175.5	-73.7	-176.9	175.7	0	0	111.3	I315 E316 K321 N322 Q323	I315-E319 HydrophobicContact CG2-CG 4.21Å; I315-E319 WeakPolarHBondContact O-CG 3.32Å; I315-E319 PolarHBondContact O-N 3.37Å; E316-E319 PolarHBondContact O-N 2.96Å; E319-K321 VanDerWaalsContact C-N 3.33Å; E319-K321 PolarHBondContact O-N 2.92Å; E319-N322 PolarHBondContact O-N 3.36Å; E319-Q323 PolarHBondContact O-N 2.89Å
320	L	81.3	Confident	75.2	Confident	93 Å²	93	92.2 Å²	92.2	49%	0.487	46%	0.46	S	S	.	.	H	α-helix	trans	-63.5	-36.9	177	-174.4	67.6	0	0	0	112.2	E316 I318 F324	E316-L320 WeakPolarHBondContact O-CB 3.06Å; E316-L320 PolarHBondContact O-N 3.33Å; I318-L320 PolarHBondContact O-N 3.35Å; L320-F324 WeakPolarHBondContact O-CB 3.36Å; L320-F324 PolarHBondContact O-N 3.28Å; L320-F324 VanDerWaalsContact O-N 3.07Å
321	K	84	Confident	77.7	Confident	77 Å²	77	88.2 Å²	88.2	34%	0.335	44%	0.44	S	S	.	.	H	α-helix	trans	-68.2	-40.5	174.3	177.7	172.2	173.3	175.7	0	111.8	D317 I318 E319 F324 N325 D359	D317-K321 WeakPolarHBondContact O-CB 3.43Å; D317-K321 PolarHBondContact O-N 2.95Å; I318-K321 PolarHBondContact O-N 3.38Å; E319-K321 VanDerWaalsContact C-N 3.33Å; E319-K321 PolarHBondContact O-N 2.92Å; K321-F324 PolarHBondContact O-N 3.18Å; K321-N325 VanDerWaalsContact O-CG 3.3Å; K321-N325 PolarHBondContact O-N 3.37Å; K321-N325 PolarHBondContact O-ND2 3.31Å; K321-D359 IonicContact NZ-OD1 3.55Å; K321-D359 PolarHBondContact NZ-OD1 3.5Å; K321-D359 IonicContact NZ-OD2 3.78Å; K321-D359 PolarHBondContact NZ-OD2 3.41Å
322	N	86.2	Confident	80.2	Confident	84 Å²	84	79.8 Å²	79.8	45%	0.449	40%	0.403	S	S	.	.	H	α-helix	trans	-65.8	-46.4	177.7	-70.5	-14.9	0	0	0	111	I318 E319 F324 N325 D326	I318-N322 VanDerWaalsContact O-CG 3.31Å; I318-N322 PolarHBondContact O-N 3.43Å; E319-N322 PolarHBondContact O-N 3.36Å; N322-F324 VanDerWaalsContact C-N 3.29Å; N322-F324 PolarHBondContact O-N 3.38Å; N322-N325 WeakPolarHBondContact O-CB 3.33Å; N322-N325 PolarHBondContact O-N 2.89Å; N322-N325 VanDerWaalsContact O-N 3.08Å; N322-D326 PolarHBondContact O-N 3.3Å
323	Q	88.2	Confident	82.6	Confident	116 Å²	116	75.2 Å²	75.2	54%	0.542	37%	0.373	S	S	.	.	H	α-helix	trans	-56.2	-44.4	173.7	-173.1	-171.2	-24.7	0	0	111.7	E319 N325 D326 D327	E319-Q323 PolarHBondContact O-N 2.89Å; Q323-N325 VanDerWaalsContact C-N 3.34Å; Q323-N325 PolarHBondContact O-N 2.84Å; Q323-D326 PolarHBondContact O-N 3.05Å; Q323-D327 PolarHBondContact O-N 2.92Å
324	F	88.4	Confident	84.3	Confident	48 Å²	48	74.3 Å²	74.3	21%	0.211	36%	0.364	C	S	.	.	H	α-helix	trans	-62.3	-38.4	176.9	176.8	-100.9	0	0	0	112.9	L320 K321 N322 A328 C358 A381 D382 I383 L734	L320-F324 WeakPolarHBondContact O-CB 3.36Å; L320-F324 PolarHBondContact O-N 3.28Å; L320-F324 VanDerWaalsContact O-N 3.07Å; K321-F324 PolarHBondContact O-N 3.18Å; N322-F324 VanDerWaalsContact C-N 3.29Å; N322-F324 PolarHBondContact O-N 3.38Å; F324-A328 WeakPolarHBondContact O-CB 3.43Å; F324-A328 PolarHBondContact O-N 3.36Å; F324-C358 HydrophobicContact CD1-CB 4.12Å; F324-C358 HydrophobicContact CE1-CB 3.63Å; F324-A381 VanDerWaalsContact CZ-O 3.26Å; F324-A381 WeakPolarHBondContact CZ-O 3.41Å; F324-D382 HydrophobicContact CE2-CB 4.35Å; F324-I383 HydrophobicContact CE1-CD1 4.23Å; F324-I383 HydrophobicContact CE1-CG1 3.89Å; F324-I383 HydrophobicContact CZ-CG1 4.08Å; F324-L734 HydrophobicContact CZ-CD1 4.05Å
325	N	91	Very high	85.7	Confident	14 Å²	14	74.1 Å²	74.1	8%	0.075	36%	0.358	C	S	.	.	H	α-helix	trans	-63.9	-39.7	173.5	-71.7	-31.5	0	0	0	112	K321 N322 Q323 S329 C356 C358	K321-N325 VanDerWaalsContact O-CG 3.3Å; K321-N325 PolarHBondContact O-N 3.37Å; K321-N325 PolarHBondContact O-ND2 3.31Å; N322-N325 WeakPolarHBondContact O-CB 3.33Å; N322-N325 PolarHBondContact O-N 2.89Å; N322-N325 VanDerWaalsContact O-N 3.08Å; Q323-N325 VanDerWaalsContact C-N 3.34Å; Q323-N325 PolarHBondContact O-N 2.84Å; N325-S329 VanDerWaalsContact O-CB 3.29Å; N325-S329 WeakPolarHBondContact O-CB 3.38Å; N325-S329 PolarHBondContact O-N 2.94Å; N325-S329 PolarHBondContact O-OG 3.48Å; N325-C356 WeakPolarHBondContact CB-O 3.27Å; N325-C358 WeakPolarHBondContact OD1-CB 3.37Å; N325-C358 PolarHBondContact OD1-N 3.49Å
326	D	90.3	Very high	86.5	Confident	110 Å²	110	68.5 Å²	68.5	59%	0.588	33%	0.331	S	S	*	.	H	α-helix	trans	-69.6	-45.9	179.1	-65.4	-26.6	0	0	0	111.6	N322 Q323 A328 S329 Y330	N322-D326 PolarHBondContact O-N 3.3Å; Q323-D326 PolarHBondContact O-N 3.05Å; D326-A328 VanDerWaalsContact C-N 3.33Å; D326-A328 PolarHBondContact O-N 3.42Å; D326-S329 WeakPolarHBondContact O-CB 3.24Å; D326-S329 PolarHBondContact O-N 2.94Å; D326-Y330 PolarHBondContact O-N 3.31Å
327	D	91.4	Very high	87.1	Confident	83 Å²	83	63.8 Å²	63.8	44%	0.444	31%	0.31	S	S	.	.	H	α-helix	trans	-58.6	-44.7	173.5	-80.5	-37.7	0	0	0	111	Q323 Y330 I331	Q323-D327 PolarHBondContact O-N 2.92Å; D327-Y330 PolarHBondContact O-N 3.14Å; D327-I331 VanDerWaalsContact O-CG1 3.27Å; D327-I331 WeakPolarHBondContact O-CG1 3.25Å; D327-I331 PolarHBondContact O-N 2.75Å
328	A	90.7	Very high	87.9	Confident	2 Å²	2	67 Å²	67	2%	0.017	32%	0.321	C	S	.	.	H	α-helix	trans	-63.8	-41.6	176	0	0	0	0	0	112.6	F324 D326 Y330 I331 L332 L734	F324-A328 WeakPolarHBondContact O-CB 3.43Å; F324-A328 PolarHBondContact O-N 3.36Å; D326-A328 VanDerWaalsContact C-N 3.33Å; D326-A328 PolarHBondContact O-N 3.42Å; A328-Y330 PolarHBondContact O-N 3.2Å; A328-I331 PolarHBondContact O-N 3.26Å; A328-L332 WeakPolarHBondContact O-CB 3.46Å; A328-L332 WeakPolarHBondContact O-CG 3.39Å; A328-L332 PolarHBondContact O-N 3.36Å; A328-L734 HydrophobicContact CB-CD1 3.86Å; A328-L734 HydrophobicContact CB-CD2 4.03Å; A328-L734 HydrophobicContact CB-CG 4.24Å
329	S	91.6	Very high	88.4	Confident	10 Å²	10	67.2 Å²	67.2	7%	0.07	32%	0.323	C	S	.	.	H	α-helix	trans	-58	-47.6	176.3	-64.5	0	0	0	0	111.5	N325 D326 F333 L354 C356	N325-S329 VanDerWaalsContact O-CB 3.29Å; N325-S329 WeakPolarHBondContact O-CB 3.38Å; N325-S329 PolarHBondContact O-N 2.94Å; N325-S329 PolarHBondContact O-OG 3.48Å; D326-S329 WeakPolarHBondContact O-CB 3.24Å; D326-S329 PolarHBondContact O-N 2.94Å; S329-F333 VanDerWaalsContact O-CB 3.29Å; S329-F333 WeakPolarHBondContact O-CB 3.39Å; S329-F333 PolarHBondContact O-N 2.88Å; S329-L354 WeakPolarHBondContact CB-O 3.18Å; S329-C356 VanDerWaalsContact OG-CB 3.3Å; S329-C356 WeakPolarHBondContact OG-CB 3.36Å; S329-C356 PolarHBondContact OG-N 3.05Å
330	Y	91.6	Very high	88.7	Confident	151 Å²	151	66.5 Å²	66.5	59%	0.592	32%	0.323	S	S	*	.	H	α-helix	trans	-62.9	-45.1	176.6	175.2	-103.2	0	0	0	112.6	D326 D327 A328 F333 K334	D326-Y330 PolarHBondContact O-N 3.31Å; D327-Y330 PolarHBondContact O-N 3.14Å; A328-Y330 PolarHBondContact O-N 3.2Å; Y330-F333 PolarHBondContact O-N 3.46Å; Y330-K334 WeakPolarHBondContact O-CB 3.12Å; Y330-K334 PolarHBondContact O-N 3.15Å; Y330-K334 VanDerWaalsContact O-N 3.09Å
331	I	90.8	Very high	88.8	Confident	45 Å²	45	67.4 Å²	67.4	23%	0.231	33%	0.328	C	S	.	.	H	α-helix	trans	-63.5	-45.8	-179.9	-70.6	167.6	0	0	0	111.3	D327 A328 K334 E335 Y730 L734	D327-I331 VanDerWaalsContact O-CG1 3.27Å; D327-I331 WeakPolarHBondContact O-CG1 3.25Å; D327-I331 PolarHBondContact O-N 2.75Å; A328-I331 PolarHBondContact O-N 3.26Å; I331-K334 PolarHBondContact O-N 3.49Å; I331-E335 PolarHBondContact O-N 3.22Å; I331-Y730 HydrophobicContact CD1-CE1 4.29Å; I331-L734 HydrophobicContact CB-CD2 4.38Å; I331-L734 HydrophobicContact CG2-CD2 4.06Å
332	L	91	Very high	88.8	Confident	0 Å²	0	64 Å²	64	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-70.2	-36.7	179.9	-69	177.2	0	0	0	112	A328 K334 E335 A336 L354 I731 L734 C738 C740 W762	A328-L332 WeakPolarHBondContact O-CB 3.46Å; A328-L332 WeakPolarHBondContact O-CG 3.39Å; A328-L332 PolarHBondContact O-N 3.36Å; L332-K334 VanDerWaalsContact C-N 3.33Å; L332-K334 PolarHBondContact O-N 3.11Å; L332-E335 PolarHBondContact O-N 2.98Å; L332-A336 PolarHBondContact O-N 3.37Å; L332-L354 HydrophobicContact CB-CD2 3.64Å; L332-I731 HydrophobicContact CD2-CG2 4.24Å; L332-L734 HydrophobicContact CD1-CD2 4.31Å; L332-L734 HydrophobicContact CD1-CG 4.16Å; L332-L734 HydrophobicContact CD2-CB 4.45Å; L332-L734 HydrophobicContact CD2-CD2 4.09Å; L332-L734 HydrophobicContact CD2-CG 4.33Å; L332-L734 HydrophobicContact CG-CD2 3.91Å; L332-L734 HydrophobicContact CG-CG 4.26Å; L332-C738 HydrophobicContact CD1-CB 4.01Å; L332-C740 VanDerWaalsContact CD1-SG 3.57Å; L332-W762 HydrophobicContact CB-CH2 4.03Å; L332-W762 HydrophobicContact CB-CZ2 4.05Å; L332-W762 HydrophobicContact CD1-CZ2 4.18Å; L332-W762 HydrophobicContact CD2-CZ2 4.21Å; L332-W762 HydrophobicContact CG-CZ2 4.38Å
333	F	91.8	Very high	88.8	Confident	18 Å²	18	61.8 Å²	61.8	8%	0.079	31%	0.305	C	S	.	.	H	α-helix	trans	-64.4	-36.3	175.3	-169.8	-143.5	0	0	0	112.8	S329 Y330 E335 A336 I337 K346 L352 H353 L354 Y742	S329-F333 VanDerWaalsContact O-CB 3.29Å; S329-F333 WeakPolarHBondContact O-CB 3.39Å; S329-F333 PolarHBondContact O-N 2.88Å; Y330-F333 PolarHBondContact O-N 3.46Å; F333-E335 PolarHBondContact O-N 3.03Å; F333-A336 HydrophobicContact CD2-CB 4.18Å; F333-A336 WeakPolarHBondContact O-CB 3.47Å; F333-A336 PolarHBondContact O-N 3.05Å; F333-A336 VanDerWaalsContact O-N 3.17Å; F333-I337 HydrophobicContact CD1-CD1 3.96Å; F333-I337 HydrophobicContact CD2-CD1 4.14Å; F333-I337 HydrophobicContact CD2-CG1 4.1Å; F333-I337 HydrophobicContact CE1-CD1 3.85Å; F333-I337 HydrophobicContact CE2-CD1 4Å; F333-I337 HydrophobicContact CE2-CG1 3.86Å; F333-I337 HydrophobicContact CG-CD1 4.11Å; F333-I337 HydrophobicContact CZ-CD1 3.84Å; F333-I337 HydrophobicContact CZ-CG1 4.12Å; F333-I337 WeakPolarHBondContact O-CD1 3.38Å; F333-I337 VanDerWaalsContact O-CG1 3.3Å; F333-I337 WeakPolarHBondContact O-CG1 3.37Å; F333-I337 PolarHBondContact O-N 3.35Å; F333-K346 HydrophobicContact CE1-CD 4.21Å; F333-K346 VanDerWaalsContact CE1-NZ 3.31Å; F333-K346 HydrophobicContact CZ-CD 3.78Å; F333-L352 WeakPolarHBondContact CE1-O 3.48Å; F333-L352 HydrophobicContact CE2-CD2 4.38Å; F333-L352 HydrophobicContact CE2-CG 4.45Å; F333-L352 HydrophobicContact CZ-CD2 4.43Å; F333-L352 HydrophobicContact CZ-CG 4.3Å; F333-L352 WeakPolarHBondContact CZ-O 3.48Å; F333-H353 HydrophobicContact CE1-CB 4.48Å; F333-L354 HydrophobicContact CB-CB 3.74Å; F333-L354 HydrophobicContact CB-CD2 4.47Å; F333-L354 HydrophobicContact CD2-CB 4Å; F333-L354 HydrophobicContact CG-CB 4.05Å; F333-Y742 HydrophobicContact CE2-CE1 4.44Å
334	K	91.2	Very high	88.6	Confident	103 Å²	103	61.8 Å²	61.8	45%	0.448	31%	0.305	S	S	.	.	H	α-helix	trans	-62.5	-29.5	174.8	-176.1	175.9	178.6	175.5	0	113	Y35 Y330 I331 L332	Y35-K334 PolarHBondContact OH-NZ 3.16Å; Y330-K334 WeakPolarHBondContact O-CB 3.12Å; Y330-K334 PolarHBondContact O-N 3.15Å; Y330-K334 VanDerWaalsContact O-N 3.09Å; I331-K334 PolarHBondContact O-N 3.49Å; L332-K334 VanDerWaalsContact C-N 3.33Å; L332-K334 PolarHBondContact O-N 3.11Å
335	E	88.2	Confident	88.4	Confident	42 Å²	42	60.8 Å²	60.8	20%	0.196	30%	0.301	C	S	.	.	H	α-helix	trans	-80.3	-40.7	171.7	-159.7	64	-153	0	0	111.2	I331 L332 F333 I337 K338 I731 S765	I331-E335 PolarHBondContact O-N 3.22Å; L332-E335 PolarHBondContact O-N 2.98Å; F333-E335 PolarHBondContact O-N 3.03Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.42Å; E335-K338 WeakPolarHBondContact O-CB 3.45Å; E335-K338 WeakPolarHBondContact O-CG 3.33Å; E335-K338 PolarHBondContact O-N 2.99Å; E335-K338 VanDerWaalsContact O-N 3.12Å; E335-K338 WeakPolarHBondContact OE1-CD 3.29Å; E335-K338 WeakPolarHBondContact OE1-CE 3.47Å; E335-K338 IonicContact OE1-NZ 2.73Å; E335-K338 PolarHBondContact OE1-NZ 2.64Å; E335-K338 VanDerWaalsContact OE2-CE 3.27Å; E335-K338 WeakPolarHBondContact OE2-CE 3.49Å; E335-K338 IonicContact OE2-NZ 3.67Å; E335-K338 PolarHBondContact OE2-NZ 2.77Å; E335-I731 HydrophobicContact CG-CG2 4.27Å; E335-S765 WeakPolarHBondContact CG-OG 3.34Å
336	A	86.7	Confident	88.1	Confident	10 Å²	10	63.8 Å²	63.8	8%	0.083	31%	0.314	C	S	.	.	H	α-helix	trans	-54.4	-43.8	178.3	0	0	0	0	0	113.3	L332 F333 K338 N339 I342 Y742 W762	L332-A336 PolarHBondContact O-N 3.37Å; F333-A336 HydrophobicContact CD2-CB 4.18Å; F333-A336 WeakPolarHBondContact O-CB 3.47Å; F333-A336 PolarHBondContact O-N 3.05Å; F333-A336 VanDerWaalsContact O-N 3.17Å; A336-K338 PolarHBondContact O-N 2.92Å; A336-K338 VanDerWaalsContact O-N 3.08Å; A336-N339 WeakPolarHBondContact O-CB 3.45Å; A336-N339 PolarHBondContact O-N 3.01Å; A336-N339 VanDerWaalsContact O-N 3.08Å; A336-I342 HydrophobicContact CB-CG2 4.28Å; A336-I342 WeakPolarHBondContact O-CB 3.27Å; A336-Y742 HydrophobicContact CB-CE1 4.46Å; A336-W762 HydrophobicContact CB-CH2 4.46Å; A336-W762 HydrophobicContact CB-CZ3 3.75Å
337	I	88.2	Confident	87.9	Confident	52 Å²	52	64.2 Å²	64.2	27%	0.267	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-15.3	-178.4	-68.6	162.1	0	0	0	112.9	F333 E335 N339 K346	F333-I337 HydrophobicContact CD1-CD1 3.96Å; F333-I337 HydrophobicContact CD2-CD1 4.14Å; F333-I337 HydrophobicContact CD2-CG1 4.1Å; F333-I337 HydrophobicContact CE1-CD1 3.85Å; F333-I337 HydrophobicContact CE2-CD1 4Å; F333-I337 HydrophobicContact CE2-CG1 3.86Å; F333-I337 HydrophobicContact CG-CD1 4.11Å; F333-I337 HydrophobicContact CZ-CD1 3.84Å; F333-I337 HydrophobicContact CZ-CG1 4.12Å; F333-I337 WeakPolarHBondContact O-CD1 3.38Å; F333-I337 VanDerWaalsContact O-CG1 3.3Å; F333-I337 WeakPolarHBondContact O-CG1 3.37Å; F333-I337 PolarHBondContact O-N 3.35Å; E335-I337 VanDerWaalsContact C-N 3.32Å; E335-I337 PolarHBondContact O-N 3.42Å; I337-N339 PolarHBondContact O-N 2.74Å; I337-K346 HydrophobicContact CD1-CD 3.82Å; I337-K346 HydrophobicContact CG1-CD 4.18Å
338	K	87.7	Confident	87.5	Confident	139 Å²	139	64.7 Å²	64.7	60%	0.604	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-14.4	174.2	-60.6	-179.2	-172.5	171.3	0	113.8	E335 A336	E335-K338 WeakPolarHBondContact O-CB 3.45Å; E335-K338 WeakPolarHBondContact O-CG 3.33Å; E335-K338 PolarHBondContact O-N 2.99Å; E335-K338 VanDerWaalsContact O-N 3.12Å; E335-K338 WeakPolarHBondContact OE1-CD 3.29Å; E335-K338 WeakPolarHBondContact OE1-CE 3.47Å; E335-K338 IonicContact OE1-NZ 2.73Å; E335-K338 PolarHBondContact OE1-NZ 2.64Å; E335-K338 VanDerWaalsContact OE2-CE 3.27Å; E335-K338 WeakPolarHBondContact OE2-CE 3.49Å; E335-K338 IonicContact OE2-NZ 3.67Å; E335-K338 PolarHBondContact OE2-NZ 2.77Å; A336-K338 PolarHBondContact O-N 2.92Å; A336-K338 VanDerWaalsContact O-N 3.08Å
339	N	85.6	Confident	87.2	Confident	85 Å²	85	66 Å²	66	46%	0.455	33%	0.332	S	S	.	.	S	Bend	trans	-82.6	122.7	170.6	179.3	-14.3	0	0	0	108.8	A336 I337 N341 I342 S343	A336-N339 WeakPolarHBondContact O-CB 3.45Å; A336-N339 PolarHBondContact O-N 3.01Å; A336-N339 VanDerWaalsContact O-N 3.08Å; I337-N339 PolarHBondContact O-N 2.74Å; N339-N341 PolarHBondContact O-N 2.85Å; N339-N341 VanDerWaalsContact O-N 3.11Å; N339-N341 PolarHBondContact OD1-N 3.05Å; N339-N341 VanDerWaalsContact OD1-N 3.09Å; N339-I342 HydrophobicContact CB-CB 4.36Å; N339-I342 HydrophobicContact CB-CG1 3.94Å; N339-I342 WeakPolarHBondContact O-CA 3.48Å; N339-I342 PolarHBondContact O-N 3.42Å; N339-S343 PolarHBondContact O-N 3.18Å
340	D	86	Confident	86.8	Confident	114 Å²	114	70.1 Å²	70.1	61%	0.61	36%	0.359	S	S	*	.	H	α-helix	trans	-56.4	-30.1	-177.1	-67.4	-47.1	0	0	0	113.5	I342 S343 Q344	D340-I342 VanDerWaalsContact C-N 3.33Å; D340-I342 PolarHBondContact O-N 3.45Å; D340-S343 WeakPolarHBondContact CA-OG 3.4Å; D340-S343 PolarHBondContact O-OG 2.93Å; D340-Q344 WeakPolarHBondContact O-CB 3.45Å; D340-Q344 WeakPolarHBondContact O-CG 3.04Å; D340-Q344 PolarHBondContact O-N 3.25Å; D340-Q344 PolarHBondContact O-NE2 3.37Å
341	N	84.3	Confident	86.4	Confident	113 Å²	113	68 Å²	68	60%	0.604	36%	0.358	S	S	*	.	H	α-helix	trans	-68.3	-34.6	175.6	-64.1	-1.5	0	0	0	111.7	N339 L345	N339-N341 PolarHBondContact O-N 2.85Å; N339-N341 VanDerWaalsContact O-N 3.11Å; N339-N341 PolarHBondContact OD1-N 3.05Å; N339-N341 VanDerWaalsContact OD1-N 3.09Å; N341-L345 WeakPolarHBondContact O-CB 3.41Å; N341-L345 PolarHBondContact O-N 3.34Å
342	I	84.8	Confident	86.2	Confident	5 Å²	5	66 Å²	66	3%	0.026	35%	0.348	C	S	.	.	H	α-helix	trans	-81.4	-34.1	179.1	-53.2	-57.6	0	0	0	110.9	A336 N339 D340 L345 K346 Y742 P760	A336-I342 HydrophobicContact CB-CG2 4.28Å; A336-I342 WeakPolarHBondContact O-CB 3.27Å; N339-I342 HydrophobicContact CB-CB 4.36Å; N339-I342 HydrophobicContact CB-CG1 3.94Å; N339-I342 WeakPolarHBondContact O-CA 3.48Å; N339-I342 PolarHBondContact O-N 3.42Å; D340-I342 VanDerWaalsContact C-N 3.33Å; D340-I342 PolarHBondContact O-N 3.45Å; I342-L345 PolarHBondContact O-N 3.04Å; I342-K346 WeakPolarHBondContact O-CB 3.48Å; I342-K346 PolarHBondContact O-N 3.08Å; I342-Y742 HydrophobicContact CD1-CE1 4.31Å; I342-Y742 HydrophobicContact CD1-CE2 4.34Å; I342-Y742 WeakPolarHBondContact CD1-OH 3.28Å; I342-Y742 HydrophobicContact CG2-CE1 4.01Å; I342-P760 HydrophobicContact CD1-CB 4.21Å; I342-P760 HydrophobicContact CD1-CG 3.46Å; I342-P760 VanDerWaalsContact CD1-CG 3.46Å
343	S	85.1	Confident	86	Confident	38 Å²	38	69.3 Å²	69.3	27%	0.266	36%	0.363	S	S	.	.	H	α-helix	trans	-65	-43.1	172.8	76.5	0	0	0	0	111.1	N339 D340 K346 T347	N339-S343 PolarHBondContact O-N 3.18Å; D340-S343 WeakPolarHBondContact CA-OG 3.4Å; D340-S343 PolarHBondContact O-OG 2.93Å; S343-K346 PolarHBondContact O-N 3.38Å; S343-T347 PolarHBondContact O-N 3.03Å
344	Q	84.9	Confident	85.8	Confident	116 Å²	116	68.6 Å²	68.6	54%	0.542	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-46.4	171.7	-73	171.6	40.6	0	0	112.2	D340 K346 T347 T348	D340-Q344 WeakPolarHBondContact O-CB 3.45Å; D340-Q344 WeakPolarHBondContact O-CG 3.04Å; D340-Q344 PolarHBondContact O-N 3.25Å; D340-Q344 PolarHBondContact O-NE2 3.37Å; Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 3.26Å; Q344-T347 WeakPolarHBondContact CA-OG1 3.42Å; Q344-T347 PolarHBondContact O-N 3.15Å; Q344-T347 PolarHBondContact O-OG1 3.35Å; Q344-T348 PolarHBondContact O-N 3.3Å; Q344-T348 PolarHBondContact O-OG1 2.9Å; Q344-T348 VanDerWaalsContact O-OG1 3.09Å
345	L	84.1	Confident	85.7	Confident	26 Å²	26	68 Å²	68	14%	0.136	36%	0.357	C	S	.	.	H	α-helix	trans	-58.7	-39.8	176.7	-168.5	68.4	0	0	0	111.5	N341 I342 T347 T348 F349 L352 L759 P760	N341-L345 WeakPolarHBondContact O-CB 3.41Å; N341-L345 PolarHBondContact O-N 3.34Å; I342-L345 PolarHBondContact O-N 3.04Å; L345-T347 PolarHBondContact O-N 3.36Å; L345-T348 WeakPolarHBondContact O-CB 3.44Å; L345-T348 PolarHBondContact O-N 2.82Å; L345-T348 VanDerWaalsContact O-N 3.14Å; L345-F349 HydrophobicContact CD1-CD2 3.69Å; L345-F349 HydrophobicContact CD1-CE2 3.8Å; L345-F349 HydrophobicContact CG-CD2 4.17Å; L345-F349 PolarHBondContact O-N 3.24Å; L345-L352 HydrophobicContact CB-CD2 4.15Å; L345-L352 HydrophobicContact CD2-CD1 4.28Å; L345-L352 HydrophobicContact CD2-CD2 3.9Å; L345-L352 HydrophobicContact CG-CD2 3.88Å; L345-L759 HydrophobicContact CD2-CD2 3.93Å; L345-P760 HydrophobicContact CD2-CG 3.87Å
346	K	85.2	Confident	85.9	Confident	77 Å²	77	66.2 Å²	66.2	34%	0.335	35%	0.349	S	S	.	.	H	α-helix	trans	-68.4	-29.1	174.4	-168.2	171.8	-171.9	171.2	0	113.8	F333 I337 I342 S343 Q344 T348 F349 L352	F333-K346 HydrophobicContact CE1-CD 4.21Å; F333-K346 VanDerWaalsContact CE1-NZ 3.31Å; F333-K346 HydrophobicContact CZ-CD 3.78Å; I337-K346 HydrophobicContact CD1-CD 3.82Å; I337-K346 HydrophobicContact CG1-CD 4.18Å; I342-K346 WeakPolarHBondContact O-CB 3.48Å; I342-K346 PolarHBondContact O-N 3.08Å; S343-K346 PolarHBondContact O-N 3.38Å; Q344-K346 VanDerWaalsContact C-N 3.27Å; Q344-K346 PolarHBondContact O-N 3.26Å; K346-T348 VanDerWaalsContact C-N 3.3Å; K346-F349 CarbonylContact O-C 3.35Å; K346-F349 VanDerWaalsContact O-O 3.13Å; K346-L352 HydrophobicContact CB-CD2 4.09Å
347	T	86	Confident	86.1	Confident	120 Å²	120	69.2 Å²	69.2	74%	0.736	37%	0.367	S	S	*	.	H	α-helix	trans	-74	-21.8	170.7	59	0	0	0	0	113.3	S343 Q344 L345	S343-T347 PolarHBondContact O-N 3.03Å; Q344-T347 WeakPolarHBondContact CA-OG1 3.42Å; Q344-T347 PolarHBondContact O-N 3.15Å; Q344-T347 PolarHBondContact O-OG1 3.35Å; L345-T347 PolarHBondContact O-N 3.36Å
348	T	83	Confident	86.3	Confident	93 Å²	93	67 Å²	67	57%	0.571	36%	0.356	S	S	*	.	H	α-helix	trans	-82.6	-43.5	173.9	-50.4	0	0	0	0	110.9	Q344 L345 K346	Q344-T348 PolarHBondContact O-N 3.3Å; Q344-T348 PolarHBondContact O-OG1 2.9Å; Q344-T348 VanDerWaalsContact O-OG1 3.09Å; L345-T348 WeakPolarHBondContact O-CB 3.44Å; L345-T348 PolarHBondContact O-N 2.82Å; L345-T348 VanDerWaalsContact O-N 3.14Å; K346-T348 VanDerWaalsContact C-N 3.3Å
349	F	84.2	Confident	86.3	Confident	28 Å²	28	63.7 Å²	63.7	12%	0.123	35%	0.345	C	S	.	.			trans	-117.7	92.6	-178.1	-62.8	-75.9	0	0	0	109.6	L345 K346 N351 L352 I744 V757	L345-F349 HydrophobicContact CD1-CD2 3.69Å; L345-F349 HydrophobicContact CD1-CE2 3.8Å; L345-F349 HydrophobicContact CG-CD2 4.17Å; L345-F349 PolarHBondContact O-N 3.24Å; K346-F349 CarbonylContact O-C 3.35Å; K346-F349 VanDerWaalsContact O-O 3.13Å; F349-N351 PolarHBondContact O-N 3.45Å; F349-L352 HydrophobicContact CB-CB 4.03Å; F349-L352 WeakPolarHBondContact O-CB 3.41Å; F349-L352 PolarHBondContact O-N 3.35Å; F349-I744 HydrophobicContact CB-CG2 4.15Å; F349-I744 HydrophobicContact CD1-CD1 4.08Å; F349-I744 HydrophobicContact CD1-CG2 3.76Å; F349-I744 HydrophobicContact CE1-CD1 4.14Å; F349-I744 HydrophobicContact CG-CD1 4.42Å; F349-I744 HydrophobicContact CG-CG2 4.23Å; F349-V757 HydrophobicContact CE2-CG1 4.21Å; F349-V757 HydrophobicContact CZ-CB 4.45Å; F349-V757 HydrophobicContact CZ-CG1 4.39Å; F349-V757 HydrophobicContact CZ-CG2 4.21Å
350	P	82.4	Confident	86.4	Confident	98 Å²	98	60.8 Å²	60.8	64%	0.636	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-27.1	-173.8	25.1	-34.4	0	0	0	113.3	L352	P350-L352 VanDerWaalsContact C-N 3.31Å
351	N	84	Confident	86.2	Confident	105 Å²	105	59.2 Å²	59.2	56%	0.561	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-0.1	177.1	-64.9	-5.5	0	0	0	113.4	F349 H353 I744	F349-N351 PolarHBondContact O-N 3.45Å; N351-H353 PolarHBondContact O-N 3.34Å; N351-H353 PolarHBondContact O-ND1 3.31Å; N351-I744 CarbonylContact C-O 3.48Å; N351-I744 WeakPolarHBondContact CB-O 3.49Å
352	L	85.2	Confident	85.8	Confident	4 Å²	4	58.8 Å²	58.8	2%	0.021	32%	0.32	C	S	.	.			trans	-54.5	123.9	175.5	-176.1	76	0	0	0	109.9	F333 L345 K346 F349 P350 Y742 I744 L759	F333-L352 WeakPolarHBondContact CE1-O 3.48Å; F333-L352 HydrophobicContact CE2-CD2 4.38Å; F333-L352 HydrophobicContact CE2-CG 4.45Å; F333-L352 HydrophobicContact CZ-CD2 4.43Å; F333-L352 HydrophobicContact CZ-CG 4.3Å; F333-L352 WeakPolarHBondContact CZ-O 3.48Å; L345-L352 HydrophobicContact CB-CD2 4.15Å; L345-L352 HydrophobicContact CD2-CD1 4.28Å; L345-L352 HydrophobicContact CD2-CD2 3.9Å; L345-L352 HydrophobicContact CG-CD2 3.88Å; K346-L352 HydrophobicContact CB-CD2 4.09Å; F349-L352 HydrophobicContact CB-CB 4.03Å; F349-L352 WeakPolarHBondContact O-CB 3.41Å; F349-L352 PolarHBondContact O-N 3.35Å; P350-L352 VanDerWaalsContact C-N 3.31Å; L352-Y742 HydrophobicContact CD1-CD1 4.29Å; L352-I744 HydrophobicContact CD1-CG1 4.4Å; L352-L759 HydrophobicContact CD1-CD2 4.32Å
353	H	87.2	Confident	85.5	Confident	69 Å²	69	61.1 Å²	61.1	32%	0.319	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	172.9	171.4	67.2	-72.1	0	0	0	110.4	F333 N351 Y742 D743	F333-H353 HydrophobicContact CE1-CB 4.48Å; N351-H353 PolarHBondContact O-N 3.34Å; N351-H353 PolarHBondContact O-ND1 3.31Å; H353-Y742 WeakPolarHBondContact O-CA 3.23Å; H353-D743 VanDerWaalsContact CE1-CB 3.45Å; H353-D743 WeakPolarHBondContact CE1-CB 3.5Å; H353-D743 IonicContact CE1-OD1 2.95Å; H353-D743 IonicContact CE1-OD2 3.09Å; H353-D743 PolarHBondContact N-O 3.27Å; H353-D743 PolarHBondContact ND1-O 2.94Å; H353-D743 IonicContact NE2-OD2 3.89Å; H353-D743 PolarHBondContact O-N 2.04Å
354	L	88.7	Confident	85.5	Confident	4 Å²	4	59.8 Å²	59.8	2%	0.021	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	139.3	170.3	-165.6	74.5	0	0	0	107.1	S329 L332 F333 C740 H741 Y742 W762	S329-L354 WeakPolarHBondContact CB-O 3.18Å; L332-L354 HydrophobicContact CB-CD2 3.64Å; F333-L354 HydrophobicContact CB-CB 3.74Å; F333-L354 HydrophobicContact CB-CD2 4.47Å; F333-L354 HydrophobicContact CD2-CB 4Å; F333-L354 HydrophobicContact CG-CB 4.05Å; L354-C740 HydrophobicContact CD1-CB 3.91Å; L354-C740 HydrophobicContact CD2-CB 3.91Å; L354-C740 HydrophobicContact CG-CB 3.8Å; L354-H741 WeakPolarHBondContact CA-O 3.05Å; L354-H741 WeakPolarHBondContact CD1-O 3.06Å; L354-Y742 HydrophobicContact CD1-CD1 3.86Å; L354-Y742 HydrophobicContact CD1-CD2 4.4Å; L354-Y742 HydrophobicContact CD1-CE1 3.83Å; L354-Y742 HydrophobicContact CD1-CE2 4.39Å; L354-Y742 HydrophobicContact CD1-CG 4.16Å; L354-W762 HydrophobicContact CD1-CD2 4.25Å; L354-W762 HydrophobicContact CD1-CE3 3.87Å; L354-W762 HydrophobicContact CD1-CZ3 4.36Å; L354-W762 HydrophobicContact CD2-CD2 4.42Å; L354-W762 HydrophobicContact CD2-CE3 4.14Å; L354-W762 HydrophobicContact CD2-CH2 4.01Å; L354-W762 HydrophobicContact CD2-CZ2 4.26Å; L354-W762 HydrophobicContact CD2-CZ3 3.95Å
355	K	89.5	Confident	85.3	Confident	89 Å²	89	55.5 Å²	55.5	39%	0.387	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	111.6	-177.9	-175.2	171	173.1	-170.9	0	109	C740 H741 D743	K355-C740 WeakPolarHBondContact O-CA 3.41Å; K355-H741 PolarHBondContact N-O 3Å; K355-H741 PolarHBondContact O-CE1 3.37Å; K355-H741 PolarHBondContact O-N 3.27Å; K355-H741 VanDerWaalsContact O-N 3.08Å; K355-H741 PolarHBondContact O-ND1 3.25Å; K355-D743 HydrophobicContact CB-CB 4.33Å; K355-D743 HydrophobicContact CD-CB 4.27Å; K355-D743 VanDerWaalsContact CD-OD2 3.23Å; K355-D743 WeakPolarHBondContact CD-OD2 3.23Å; K355-D743 IonicContact NZ-OD2 3.57Å; K355-D743 PolarHBondContact NZ-OD2 3.42Å
356	C	92.1	Very high	85.1	Confident	5 Å²	5	57.8 Å²	57.8	3%	0.034	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	147.7	-169.8	-61.3	0	0	0	0	113.4	N325 S329 C738 H739 C740	N325-C356 WeakPolarHBondContact CB-O 3.27Å; S329-C356 VanDerWaalsContact OG-CB 3.3Å; S329-C356 WeakPolarHBondContact OG-CB 3.36Å; S329-C356 PolarHBondContact OG-N 3.05Å; C356-C738 HydrophobicContact CB-CB 4.16Å; C356-H739 CarbonylContact C-O 3.55Å; C356-H739 WeakPolarHBondContact CA-O 3.11Å; C356-H739 WeakPolarHBondContact CB-O 3.37Å; C356-C740 HydrophobicContact CB-CB 4.12Å; C356-C740 WeakPolarHBondContact CB-SG 3.49Å; C356-C740 WeakPolarHBondContact SG-CB 3.46Å; C356-C740 CovalentContact SG-SG 2.04Å; C356-C740 PolarHBondContact SG-SG 2.87Å
357	T	90.3	Very high	84.7	Confident	74 Å²	74	55.2 Å²	55.2	45%	0.454	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	116	170.4	52.7	0	0	0	0	109.4	C738 H739	T357-C738 CarbonylContact O-C 3.54Å; T357-C738 WeakPolarHBondContact O-CA 3.31Å; T357-H739 PolarHBondContact N-O 3.39Å; T357-H739 PolarHBondContact O-N 2.86Å
358	C	91.4	Very high	83.9	Confident	4 Å²	4	55.8 Å²	55.8	3%	0.027	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.9	-169.3	-50.7	0	0	0	0	110.9	F324 N325 I383 C738	F324-C358 HydrophobicContact CD1-CB 4.12Å; F324-C358 HydrophobicContact CE1-CB 3.63Å; N325-C358 WeakPolarHBondContact OD1-CB 3.37Å; N325-C358 PolarHBondContact OD1-N 3.49Å; C358-I383 HydrophobicContact CB-CD1 4.02Å; C358-C738 HydrophobicContact CB-CB 4.08Å; C358-C738 WeakPolarHBondContact CB-SG 3.42Å; C358-C738 WeakPolarHBondContact SG-CB 3.37Å; C358-C738 CovalentContact SG-SG 2.04Å; C358-C738 PolarHBondContact SG-SG 3.33Å
359	D	88.5	Confident	82.5	Confident	71 Å²	71	58.4 Å²	58.4	38%	0.38	31%	0.31	S	S	.	.			trans	-150.2	157.7	-176.7	-89.4	-58.9	0	0	0	111.8	K321 R361 A737	K321-D359 IonicContact NZ-OD1 3.55Å; K321-D359 PolarHBondContact NZ-OD1 3.5Å; K321-D359 IonicContact NZ-OD2 3.78Å; K321-D359 PolarHBondContact NZ-OD2 3.41Å; D359-R361 VanDerWaalsContact C-N 3.32Å; D359-R361 PolarHBondContact O-N 2.94Å; D359-A737 PolarHBondContact N-O 3.01Å
360	C	87.4	Confident	81.1	Confident	24 Å²	24	57.7 Å²	57.7	16%	0.162	31%	0.308	C	S	.	.	S	Bend	trans	-76.3	84.6	173.4	-164.6	0	0	0	0	111.2	I383 C386	C360-I383 HydrophobicContact CB-CG2 4.11Å; C360-C386 VanDerWaalsContact CA-SG 3.55Å; C360-C386 HydrophobicContact CB-CB 3.67Å; C360-C386 WeakPolarHBondContact CB-SG 3.44Å; C360-C386 WeakPolarHBondContact SG-CA 3.45Å; C360-C386 WeakPolarHBondContact SG-CB 3.5Å; C360-C386 CovalentContact SG-SG 2.03Å; C360-C386 PolarHBondContact SG-SG 3.41Å
361	R	82.5	Confident	79.5	Confident	80 Å²	80	55.4 Å²	55.4	30%	0.302	30%	0.302	S	S	.	.			trans	-122.8	158.4	-174.3	69.4	-157.1	-175.9	92	17.9	111.1	D359 L364 I736 A737 C738	D359-R361 VanDerWaalsContact C-N 3.32Å; D359-R361 PolarHBondContact O-N 2.94Å; R361-L364 WeakPolarHBondContact O-CA 3.29Å; R361-L364 WeakPolarHBondContact O-CB 3.34Å; R361-L364 PolarHBondContact O-N 2.89Å; R361-I736 PolarHBondContact NH2-O 2.9Å; R361-A737 PolarHBondContact NE-O 3.46Å; R361-C738 VanDerWaalsContact NH2-C 3.27Å; R361-C738 PolarHBondContact NH2-O 3.4Å; R361-C738 VanDerWaalsContact NH2-O 3.12Å
362	P	75.6	Confident	78	Confident	105 Å²	105	53.5 Å²	53.5	68%	0.682	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	134.9	174.5	-27.3	35.7	0	0	0	111.3
363	P	79.3	Confident	76.2	Confident	54 Å²	54	61 Å²	61	35%	0.351	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	cis	-84.8	1.9	14	35	-37.7	0	0	0	116.1	P389 P393 I736	P363-P389 WeakPolarHBondContact O-CD 3.49Å; P363-P389 WeakPolarHBondContact O-CG 3.39Å; P363-P393 HydrophobicContact CB-CB 3.8Å; P363-P393 HydrophobicContact CG-CB 3.59Å; P363-P393 HydrophobicContact CG-CG 4.04Å; P363-I736 HydrophobicContact CG-CG2 3.72Å
364	L	84.5	Confident	74.1	Confident	9 Å²	9	62.4 Å²	62.4	5%	0.047	35%	0.348	C	S	.	.	S	Bend	trans	-75.2	157.6	174.9	-55.5	175.4	0	0	0	111.5	R361 V380 M388 I736 A737	R361-L364 WeakPolarHBondContact O-CA 3.29Å; R361-L364 WeakPolarHBondContact O-CB 3.34Å; R361-L364 PolarHBondContact O-N 2.89Å; L364-V380 HydrophobicContact CD1-CG1 4.23Å; L364-V380 HydrophobicContact CD2-CG1 4.21Å; L364-M388 HydrophobicContact CD2-CG 4.21Å; L364-I736 HydrophobicContact CD1-CG2 4.25Å; L364-I736 HydrophobicContact CD2-CG2 4Å; L364-I736 HydrophobicContact CG-CG2 3.89Å; L364-A737 HydrophobicContact CD1-CB 4.04Å
365	I	80.6	Confident	72.2	Confident	27 Å²	27	64.4 Å²	64.4	14%	0.138	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	124.3	-177.5	-58.9	174.4	0	0	0	109.6	S387 P389 I555	I365-S387 PolarHBondContact N-O 2.83Å; I365-S387 PolarHBondContact O-N 3.24Å; I365-P389 HydrophobicContact CD1-CB 4.18Å; I365-I555 HydrophobicContact CB-CG2 4.31Å; I365-I555 HydrophobicContact CD1-CG2 3.91Å; I365-I555 HydrophobicContact CG2-CG2 3.9Å
366	N	80.7	Confident	70.5	Confident	74 Å²	74	66.3 Å²	66.3	40%	0.396	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	130.7	177.9	-171.2	-38.4	0	0	0	110.8	K368	N366-K368 WeakPolarHBondContact OD1-CB 3.42Å; N366-K368 VanDerWaalsContact OD1-CG 3.31Å; N366-K368 WeakPolarHBondContact OD1-CG 3.35Å; N366-K368 PolarHBondContact OD1-N 2.94Å; N366-K368 VanDerWaalsContact OD1-N 3.1Å
367	I	76.5	Confident	68.9	Low	22 Å²	22	71.9 Å²	71.9	11%	0.113	39%	0.391	C	S	.	.			trans	-103.1	-10.1	-170	-41	173.4	0	0	0	112	N369 L370 M372 I378 D385	I367-N369 PolarHBondContact O-N 3.12Å; I367-L370 HydrophobicContact CG2-CB 4.12Å; I367-L370 HydrophobicContact CG2-CD2 4.09Å; I367-L370 WeakPolarHBondContact O-CB 3.23Å; I367-L370 PolarHBondContact O-N 3.44Å; I367-M372 HydrophobicContact CG2-SD 4.48Å; I367-I378 HydrophobicContact CD1-CB 3.75Å; I367-I378 HydrophobicContact CD1-CD1 4.03Å; I367-I378 HydrophobicContact CD1-CG1 4.4Å; I367-I378 HydrophobicContact CD1-CG2 3.91Å; I367-D385 WeakPolarHBondContact CG1-O 3.32Å; I367-D385 PolarHBondContact N-O 3.33Å
368	K	68	Low	68.2	Low	133 Å²	133	69.6 Å²	69.6	58%	0.578	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.8	-34	-166.1	-72.1	179.8	178.9	-178	0	115.2	N366 D385	N366-K368 WeakPolarHBondContact OD1-CB 3.42Å; N366-K368 VanDerWaalsContact OD1-CG 3.31Å; N366-K368 WeakPolarHBondContact OD1-CG 3.35Å; N366-K368 PolarHBondContact OD1-N 2.94Å; N366-K368 VanDerWaalsContact OD1-N 3.1Å; K368-D385 HydrophobicContact CD-CB 4.41Å; K368-D385 WeakPolarHBondContact CE-OD2 3.44Å; K368-D385 HydrophobicContact CG-CB 3.46Å; K368-D385 VanDerWaalsContact CG-CB 3.46Å
369	N	54.1	Low	67.8	Low	147 Å²	147	70.3 Å²	70.3	79%	0.786	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.5	7.6	-174.4	-60.7	1.6	0	0	0	113.8	I367 G371	I367-N369 PolarHBondContact O-N 3.12Å; N369-G371 PolarHBondContact O-N 3.32Å
370	L	55.5	Low	67.6	Low	13 Å²	13	67 Å²	67	7%	0.068	36%	0.362	C	S	.	.	S	Bend	trans	-84.8	1.3	-173.1	-89.5	64.1	0	0	0	115.2	I367 M372 L470 P471	I367-L370 HydrophobicContact CG2-CB 4.12Å; I367-L370 HydrophobicContact CG2-CD2 4.09Å; I367-L370 WeakPolarHBondContact O-CB 3.23Å; I367-L370 PolarHBondContact O-N 3.44Å; L370-M372 HydrophobicContact CB-CG 4.3Å; L370-M372 HydrophobicContact CB-SD 4.43Å; L370-M372 PolarHBondContact O-N 2.99Å; L370-M372 VanDerWaalsContact O-N 3.11Å; L370-L470 HydrophobicContact CD1-CD2 4.32Å; L370-L470 HydrophobicContact CD2-CD2 4.04Å; L370-L470 HydrophobicContact CD2-CG 4.08Å; L370-P471 HydrophobicContact CB-CG 4.25Å; L370-P471 HydrophobicContact CD2-CG 4.29Å; L370-P471 HydrophobicContact CG-CG 4.19Å
371	G	49	Very low	67.5	Low	50 Å²	50	65.9 Å²	65.9	52%	0.515	36%	0.355	S	S	.	.			trans	64.7	15	174.2	0	0	0	0	0	115.9	N369 N373	N369-G371 PolarHBondContact O-N 3.32Å; G371-N373 VanDerWaalsContact C-N 3.26Å; G371-N373 PolarHBondContact O-N 3.21Å; G371-N373 PolarHBondContact O-OD1 3.44Å
372	M	51	Low	67.5	Low	65 Å²	65	66.7 Å²	66.7	32%	0.32	37%	0.366	S	S	.	.			trans	-78.4	67.7	-174.8	-68.3	179.6	65.1	0	0	112.5	I367 L370 S374 H375	I367-M372 HydrophobicContact CG2-SD 4.48Å; L370-M372 HydrophobicContact CB-CG 4.3Å; L370-M372 HydrophobicContact CB-SD 4.43Å; L370-M372 PolarHBondContact O-N 2.99Å; L370-M372 VanDerWaalsContact O-N 3.11Å; M372-S374 PolarHBondContact O-N 3.19Å; M372-H375 HydrophobicContact CE-CB 4.49Å; M372-H375 VanDerWaalsContact CE-CD2 3.45Å; M372-H375 WeakPolarHBondContact CE-CD2 3.33Å
373	N	46.9	Very low	68	Low	163 Å²	163	62.7 Å²	62.7	87%	0.872	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	21	-174.7	-66.3	-7.7	0	0	0	115.9	G371	G371-N373 VanDerWaalsContact C-N 3.26Å; G371-N373 PolarHBondContact O-N 3.21Å; G371-N373 PolarHBondContact O-OD1 3.44Å
374	S	43.2	Very low	68.2	Low	97 Å²	97	65 Å²	65	68%	0.678	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-148.4	7.4	-170.9	60.3	0	0	0	0	115.7	M372	M372-S374 PolarHBondContact O-N 3.19Å
375	H	48.8	Very low	68	Low	47 Å²	47	67 Å²	67	22%	0.218	35%	0.354	C	S	.	.	S	Bend	trans	-104	136	179.4	-79.1	-107.4	0	0	0	112.7	M372 K377 N561	M372-H375 HydrophobicContact CE-CB 4.49Å; M372-H375 VanDerWaalsContact CE-CD2 3.45Å; M372-H375 WeakPolarHBondContact CE-CD2 3.33Å; H375-K377 PolarHBondContact O-N 3.4Å; H375-N561 PolarHBondContact CE1-ND2 2.78Å; H375-N561 VanDerWaalsContact CE1-ND2 3.35Å; H375-N561 PolarHBondContact NE2-ND2 2.59Å
376	E	54.8	Low	68.1	Low	128 Å²	128	65.7 Å²	65.7	60%	0.598	35%	0.347	S	S	*	.			trans	-50.4	130.4	168.8	-169.4	-162.3	178	0	0	109.6	I378 K647	E376-I378 WeakPolarHBondContact O-CG1 3.41Å; E376-I378 PolarHBondContact O-N 3.04Å; E376-K647 IonicContact OE1-NZ 2.7Å; E376-K647 PolarHBondContact OE1-NZ 3.09Å; E376-K647 IonicContact OE2-NZ 3.24Å; E376-K647 PolarHBondContact OE2-NZ 2.97Å
377	K	59.4	Low	68.4	Low	123 Å²	123	62.2 Å²	62.2	54%	0.535	33%	0.328	S	S	.	.			trans	-49.1	103.9	-167.1	-163	163	-161	156.4	0	112	H375 T379 K384	H375-K377 PolarHBondContact O-N 3.4Å; K377-T379 PolarHBondContact O-N 3.2Å; K377-K384 HydrophobicContact CD-CG 4.32Å
378	I	74.2	Confident	68.7	Low	25 Å²	25	61.7 Å²	61.7	13%	0.128	33%	0.325	C	S	.	.			trans	-73.9	123.4	-175.9	-51.1	179.4	0	0	0	107.7	I367 E376 D385 C386 Y558	I367-I378 HydrophobicContact CD1-CB 3.75Å; I367-I378 HydrophobicContact CD1-CD1 4.03Å; I367-I378 HydrophobicContact CD1-CG1 4.4Å; I367-I378 HydrophobicContact CD1-CG2 3.91Å; E376-I378 WeakPolarHBondContact O-CG1 3.41Å; E376-I378 PolarHBondContact O-N 3.04Å; I378-D385 PolarHBondContact O-N 3.17Å; I378-C386 WeakPolarHBondContact CG2-O 3.45Å; I378-C386 PolarHBondContact O-N 3.43Å; I378-Y558 HydrophobicContact CD1-CD2 4.17Å; I378-Y558 HydrophobicContact CD1-CG 4.31Å; I378-Y558 HydrophobicContact CG2-CD2 4.25Å; I378-Y558 HydrophobicContact CG2-CE1 4.4Å; I378-Y558 HydrophobicContact CG2-CE2 4.11Å; I378-Y558 HydrophobicContact CG2-CG 4.46Å
379	T	82.6	Confident	69.5	Low	20 Å²	20	56.2 Å²	56.2	12%	0.123	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	154.8	178.6	54.7	0	0	0	0	110.7	K377 I383 K384 N646	K377-T379 PolarHBondContact O-N 3.2Å; T379-I383 WeakPolarHBondContact CA-O 3.24Å; T379-K384 HydrophobicContact CG2-CG 4.5Å; T379-N646 PolarHBondContact O-ND2 3.37Å; T379-N646 PolarHBondContact O-OD1 2.86Å
380	V	85.1	Confident	71.2	Confident	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	121.8	163.8	174.8	0	0	0	0	106.2	L364 D382 I383 M388 Q733	L364-V380 HydrophobicContact CD1-CG1 4.23Å; L364-V380 HydrophobicContact CD2-CG1 4.21Å; V380-D382 VanDerWaalsContact C-N 3.26Å; V380-D382 PolarHBondContact O-N 3.38Å; V380-I383 PolarHBondContact N-O 3.12Å; V380-I383 WeakPolarHBondContact O-CB 3.23Å; V380-I383 PolarHBondContact O-N 2.88Å; V380-M388 HydrophobicContact CG1-CG 4.47Å; V380-M388 HydrophobicContact CG2-CG 4.08Å; V380-Q733 HydrophobicContact CG1-CB 3.93Å; V380-Q733 HydrophobicContact CG1-CG 4.06Å
381	A	84.9	Confident	72.7	Confident	2 Å²	2	50.7 Å²	50.7	2%	0.017	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	43.5	51.8	-167.1	0	0	0	0	0	112.6	F324 I383 Y730 Q733 L734	F324-A381 VanDerWaalsContact CZ-O 3.26Å; F324-A381 WeakPolarHBondContact CZ-O 3.41Å; A381-I383 PolarHBondContact O-N 3.12Å; A381-Y730 HydrophobicContact CB-CE2 4.46Å; A381-Q733 HydrophobicContact CB-CB 3.86Å; A381-L734 HydrophobicContact CB-CB 4Å; A381-L734 HydrophobicContact CB-CD1 3.96Å
382	D	83.9	Confident	74.5	Confident	97 Å²	97	48.6 Å²	48.6	52%	0.519	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.5	-5	-177.3	-57.5	-48.3	0	0	0	117.5	F324 V380 K384 Y730	F324-D382 HydrophobicContact CE2-CB 4.35Å; V380-D382 VanDerWaalsContact C-N 3.26Å; V380-D382 PolarHBondContact O-N 3.38Å; D382-K384 PolarHBondContact O-N 3.19Å; D382-K384 VanDerWaalsContact O-N 3.16Å; D382-Y730 WeakPolarHBondContact OD2-CE2 3.19Å
383	I	86.2	Confident	76.1	Confident	21 Å²	21	47 Å²	47	11%	0.108	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	117.1	172.2	-55.6	-165.3	0	0	0	109.6	F324 C358 C360 T379 V380 A381 C386 A737	F324-I383 HydrophobicContact CE1-CD1 4.23Å; F324-I383 HydrophobicContact CE1-CG1 3.89Å; F324-I383 HydrophobicContact CZ-CG1 4.08Å; C358-I383 HydrophobicContact CB-CD1 4.02Å; C360-I383 HydrophobicContact CB-CG2 4.11Å; T379-I383 WeakPolarHBondContact CA-O 3.24Å; V380-I383 PolarHBondContact N-O 3.12Å; V380-I383 WeakPolarHBondContact O-CB 3.23Å; V380-I383 PolarHBondContact O-N 2.88Å; A381-I383 PolarHBondContact O-N 3.12Å; I383-C386 HydrophobicContact CB-CB 4.48Å; I383-C386 HydrophobicContact CG2-CB 4.18Å; I383-C386 WeakPolarHBondContact O-CB 3.3Å; I383-A737 HydrophobicContact CD1-CB 3.76Å
384	K	82.6	Confident	78	Confident	102 Å²	102	41 Å²	41	44%	0.443	21%	0.208	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.4	145.8	-176.1	-62.8	157.8	-172.2	161.7	0	111.7	K377 T379 D382 C386	K377-K384 HydrophobicContact CD-CG 4.32Å; T379-K384 HydrophobicContact CG2-CG 4.5Å; D382-K384 PolarHBondContact O-N 3.19Å; D382-K384 VanDerWaalsContact O-N 3.16Å; K384-C386 VanDerWaalsContact C-N 3.28Å; K384-C386 PolarHBondContact O-N 3.03Å
385	D	79.5	Confident	80	Confident	51 Å²	51	37.3 Å²	37.3	27%	0.273	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.3	38.1	172.6	-36.7	-44	0	0	0	111.9	I367 K368 I378	I367-D385 WeakPolarHBondContact CG1-O 3.32Å; I367-D385 PolarHBondContact N-O 3.33Å; K368-D385 HydrophobicContact CD-CB 4.41Å; K368-D385 WeakPolarHBondContact CE-OD2 3.44Å; K368-D385 HydrophobicContact CG-CB 3.46Å; K368-D385 VanDerWaalsContact CG-CB 3.46Å; I378-D385 PolarHBondContact O-N 3.17Å
386	C	84.1	Confident	81.4	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	139.2	-172.9	-158	0	0	0	0	111.8	C360 I378 I383 K384	C360-C386 VanDerWaalsContact CA-SG 3.55Å; C360-C386 HydrophobicContact CB-CB 3.67Å; C360-C386 WeakPolarHBondContact CB-SG 3.44Å; C360-C386 WeakPolarHBondContact SG-CA 3.45Å; C360-C386 WeakPolarHBondContact SG-CB 3.5Å; C360-C386 CovalentContact SG-SG 2.03Å; C360-C386 PolarHBondContact SG-SG 3.41Å; I378-C386 WeakPolarHBondContact CG2-O 3.45Å; I378-C386 PolarHBondContact O-N 3.43Å; I383-C386 HydrophobicContact CB-CB 4.48Å; I383-C386 HydrophobicContact CG2-CB 4.18Å; I383-C386 WeakPolarHBondContact O-CB 3.3Å; K384-C386 VanDerWaalsContact C-N 3.28Å; K384-C386 PolarHBondContact O-N 3.03Å
387	S	85.2	Confident	82.1	Confident	1 Å²	1	36.7 Å²	36.7	1%	0.007	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	147.8	-173.2	173.2	0	0	0	0	111.3	I365 Y558	I365-S387 PolarHBondContact N-O 2.83Å; I365-S387 PolarHBondContact O-N 3.24Å; S387-Y558 WeakPolarHBondContact OG-CE2 3.25Å
388	M	84.1	Confident	82.5	Confident	10 Å²	10	37.2 Å²	37.2	5%	0.049	19%	0.194	C	C	.	.			trans	-75.2	143	165.9	-75.3	-166	-73.4	0	0	110.9	L364 V380 L556 Y558 P636	L364-M388 HydrophobicContact CD2-CG 4.21Å; V380-M388 HydrophobicContact CG1-CG 4.47Å; V380-M388 HydrophobicContact CG2-CG 4.08Å; M388-L556 HydrophobicContact CB-CD2 4.14Å; M388-L556 HydrophobicContact CE-CD2 3.97Å; M388-L556 WeakPolarHBondContact O-CB 3.27Å; M388-L556 PolarHBondContact O-N 2.85Å; M388-L556 VanDerWaalsContact O-N 3.08Å; M388-Y558 PolarHBondContact N-OH 3.26Å; M388-P636 HydrophobicContact CE-CG 4.27Å
389	P	85.5	Confident	82.5	Confident	18 Å²	18	40 Å²	40	12%	0.117	22%	0.216	C	C	.	.	B	Isolated β-bridge	trans	-59.6	149.9	165.9	27.5	-34.5	0	0	0	110.3	P363 I365 Y391	P363-P389 WeakPolarHBondContact O-CD 3.49Å; P363-P389 WeakPolarHBondContact O-CG 3.39Å; I365-P389 HydrophobicContact CD1-CB 4.18Å; P389-Y391 WeakPolarHBondContact CG-O 3.5Å; P389-Y391 PolarHBondContact O-N 3.47Å; P389-Y391 VanDerWaalsContact O-N 3.07Å
390	C	87.7	Confident	82.5	Confident	1 Å²	1	39.7 Å²	39.7	1%	0.007	21%	0.214	C	C	.	.	S	Bend	trans	-58.4	-25.8	-177.8	179.5	0	0	0	0	113.9	H462 C467 K554 P636	C390-H462 PolarHBondContact O-NE2 3.4Å; C390-C467 HydrophobicContact CB-CB 3.83Å; C390-C467 WeakPolarHBondContact CB-SG 3.09Å; C390-C467 WeakPolarHBondContact SG-CA 3.25Å; C390-C467 WeakPolarHBondContact SG-CB 3.42Å; C390-C467 PolarHBondContact SG-N 3.26Å; C390-C467 VanDerWaalsContact SG-N 3.37Å; C390-C467 CovalentContact SG-SG 2.02Å; C390-C467 PolarHBondContact SG-SG 2.74Å; C390-K554 HydrophobicContact CB-CB 4.19Å; C390-K554 WeakPolarHBondContact CB-O 3.5Å; C390-K554 PolarHBondContact N-O 3.44Å; C390-P636 WeakPolarHBondContact O-CA 3.36Å
391	Y	87.5	Confident	82.4	Confident	44 Å²	44	40.4 Å²	40.4	17%	0.173	22%	0.217	C	C	.	.	S	Bend	trans	-106.3	128.4	173.4	-72.7	-71.6	0	0	0	109.1	P389 Y401 H462 Q463 I551	P389-Y391 WeakPolarHBondContact CG-O 3.5Å; P389-Y391 PolarHBondContact O-N 3.47Å; P389-Y391 VanDerWaalsContact O-N 3.07Å; Y391-Y401 AromaticContact CD1-CD1 3.96Å; Y391-Y401 HydrophobicContact CD1-CD1 3.96Å; Y391-Y401 AromaticContact CD1-CD2 3.61Å; Y391-Y401 HydrophobicContact CD1-CD2 3.61Å; Y391-Y401 AromaticContact CD1-CE1 3.82Å; Y391-Y401 HydrophobicContact CD1-CE1 3.82Å; Y391-Y401 AromaticContact CD1-CE2 3.43Å; Y391-Y401 HydrophobicContact CD1-CE2 3.43Å; Y391-Y401 VanDerWaalsContact CD1-CE2 3.43Å; Y391-Y401 AromaticContact CD1-CG 3.91Å; Y391-Y401 HydrophobicContact CD1-CG 3.91Å; Y391-Y401 AromaticContact CD1-CZ 3.59Å; Y391-Y401 HydrophobicContact CE1-CD1 4.32Å; Y391-Y401 AromaticContact CE1-CD2 3.92Å; Y391-Y401 HydrophobicContact CE1-CD2 3.92Å; Y391-Y401 HydrophobicContact CE1-CE2 4.21Å; Y391-Y401 HydrophobicContact CE1-CG 4.02Å; Y391-Y401 HydrophobicContact CG-CD2 4.42Å; Y391-Y401 AromaticContact CG-CE2 3.91Å; Y391-Y401 HydrophobicContact CG-CE2 3.91Å; Y391-H462 AromaticContact CD1-CD2 3.98Å; Y391-H462 AromaticContact CD1-NE2 3.81Å; Y391-H462 HydrophobicContact CE1-CB 4.17Å; Y391-H462 AromaticContact CE1-CD2 3.63Å; Y391-H462 AromaticContact CE1-CG 3.77Å; Y391-H462 AromaticContact CE1-NE2 3.95Å; Y391-Q463 HydrophobicContact CE2-CG 3.99Å; Y391-Q463 WeakPolarHBondContact OH-CG 3.3Å; Y391-Q463 PolarHBondContact OH-NE2 3.46Å; Y391-I551 HydrophobicContact CD2-CG2 4.09Å; Y391-I551 HydrophobicContact CE2-CG2 4.02Å
392	T	87.4	Confident	82.4	Confident	5 Å²	5	47.2 Å²	47.2	3%	0.031	25%	0.248	C	C	.	.			trans	-59	135.9	-176.7	-178.6	0	0	0	0	113.4	Y394 Y395 Y401 P636 I637	T392-Y394 WeakPolarHBondContact OG1-CD2 3.37Å; T392-Y395 HydrophobicContact CG2-CD2 3.78Å; T392-Y395 HydrophobicContact CG2-CE2 4.21Å; T392-Y401 HydrophobicContact CG2-CE1 4.13Å; T392-Y401 VanDerWaalsContact CG2-OH 3.25Å; T392-Y401 WeakPolarHBondContact CG2-OH 3.28Å; T392-Y401 PolarHBondContact N-OH 3.48Å; T392-Y401 PolarHBondContact O-OH 3.29Å; T392-P636 PolarHBondContact N-O 3.04Å; T392-P636 VanDerWaalsContact N-O 3.09Å; T392-I637 HydrophobicContact CG2-CB 4.26Å; T392-I637 HydrophobicContact CG2-CG1 4Å
393	P	85.1	Confident	82.8	Confident	31 Å²	31	46.7 Å²	46.7	20%	0.201	24%	0.242	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-6.3	179.6	33.7	-36.5	0	0	0	114.3	P363 Y395 I736	P363-P393 HydrophobicContact CB-CB 3.8Å; P363-P393 HydrophobicContact CG-CB 3.59Å; P363-P393 HydrophobicContact CG-CG 4.04Å; P393-Y395 PolarHBondContact O-N 2.83Å; P393-I736 HydrophobicContact CG-CD1 3.6Å; P393-I736 HydrophobicContact CG-CG1 4.48Å
394	Y	87.2	Confident	83	Confident	37 Å²	37	45.8 Å²	45.8	15%	0.145	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-14.4	-175.7	-59.7	-63.8	0	0	0	114.7	T392 W732 Q733 I736 K766 P767	T392-Y394 WeakPolarHBondContact OG1-CD2 3.37Å; Y394-W732 HydrophobicContact CE1-CB 3.99Å; Y394-W732 VanDerWaalsContact OH-C 3.25Å; Y394-W732 VanDerWaalsContact OH-CB 3.27Å; Y394-W732 WeakPolarHBondContact OH-CB 3.41Å; Y394-W732 PolarHBondContact OH-O 2.89Å; Y394-Q733 PolarHBondContact OH-N 3.12Å; Y394-I736 HydrophobicContact CD1-CD1 3.92Å; Y394-I736 HydrophobicContact CD1-CG1 4.34Å; Y394-I736 HydrophobicContact CE1-CD1 3.27Å; Y394-I736 HydrophobicContact CE1-CG1 3.79Å; Y394-I736 HydrophobicContact CE2-CD1 4.32Å; Y394-I736 VanDerWaalsContact CZ-CD1 3.47Å; Y394-K766 HydrophobicContact CD1-CB 3.88Å; Y394-K766 HydrophobicContact CG-CB 4.41Å; Y394-P767 HydrophobicContact CD1-CG 4.32Å; Y394-P767 HydrophobicContact CD2-CG 3.37Å; Y394-P767 HydrophobicContact CE1-CG 4.48Å; Y394-P767 HydrophobicContact CE2-CG 3.65Å; Y394-P767 HydrophobicContact CG-CG 3.79Å
395	Y	85.3	Confident	83.5	Confident	20 Å²	20	43 Å²	43	8%	0.078	23%	0.229	C	C	.	.	S	Bend	trans	-143.4	153.3	-171	-43.2	-77.1	0	0	0	112.4	T392 P393 I397 S400 I637 P767 Y769	T392-Y395 HydrophobicContact CG2-CD2 3.78Å; T392-Y395 HydrophobicContact CG2-CE2 4.21Å; P393-Y395 PolarHBondContact O-N 2.83Å; Y395-I397 PolarHBondContact O-N 2.84Å; Y395-S400 VanDerWaalsContact CB-OG 3.31Å; Y395-S400 WeakPolarHBondContact CB-OG 3.23Å; Y395-I637 HydrophobicContact CD2-CD1 4.3Å; Y395-I637 HydrophobicContact CE2-CD1 3.5Å; Y395-I637 HydrophobicContact CE2-CG1 4.22Å; Y395-P767 PolarHBondContact OH-O 2.9Å; Y395-Y769 HydrophobicContact CD1-CD2 4.5Å; Y395-Y769 HydrophobicContact CD2-CD2 4.24Å; Y395-Y769 HydrophobicContact CE1-CD2 4.31Å; Y395-Y769 HydrophobicContact CE1-CG 4.45Å; Y395-Y769 HydrophobicContact CE2-CD2 4.05Å; Y395-Y769 HydrophobicContact CG-CD2 4.45Å; Y395-Y769 WeakPolarHBondContact OH-CA 3.27Å; Y395-Y769 PolarHBondContact OH-N 3.22Å; Y395-Y769 VanDerWaalsContact OH-N 3.16Å
396	P	77.4	Confident	84.2	Confident	78 Å²	78	46.9 Å²	46.9	51%	0.506	24%	0.243	S	C	.	.			trans	-66.6	124.7	177.2	26.8	-34.9	0	0	0	112.3	N398 S399 S400	P396-N398 VanDerWaalsContact C-N 3.35Å; P396-N398 PolarHBondContact O-N 3.23Å; P396-S399 PolarHBondContact O-N 3.27Å; P396-S400 PolarHBondContact O-N 3.1Å; P396-S400 PolarHBondContact O-OG 3.38Å
397	I	68.6	Low	84.7	Confident	84 Å²	84	50.3 Å²	50.3	43%	0.431	26%	0.256	S	S	.	.	H	α-helix	trans	-48.2	-51.5	-171.8	-60.7	-174.5	0	0	0	112.7	Y395 S399 Y401	Y395-I397 PolarHBondContact O-N 2.84Å; I397-S399 PolarHBondContact O-N 3.32Å; I397-Y401 HydrophobicContact CB-CD2 4.22Å; I397-Y401 HydrophobicContact CB-CE2 3.94Å; I397-Y401 HydrophobicContact CG1-CE2 4.05Å; I397-Y401 HydrophobicContact CG2-CD2 3.7Å; I397-Y401 HydrophobicContact CG2-CE2 3.77Å; I397-Y401 WeakPolarHBondContact O-CD2 3.42Å; I397-Y401 PolarHBondContact O-N 3.06Å
398	N	67.6	Low	85.1	Confident	134 Å²	134	50.3 Å²	50.3	72%	0.717	26%	0.256	S	S	*	.	H	α-helix	trans	-67.9	-35.1	-164.6	-59.9	1.9	0	0	0	113.2	P396 H402	P396-N398 VanDerWaalsContact C-N 3.35Å; P396-N398 PolarHBondContact O-N 3.23Å; N398-H402 PolarHBondContact O-CD2 3.09Å
399	S	75.2	Confident	85.7	Confident	84 Å²	84	50.2 Å²	50.2	59%	0.587	26%	0.258	S	S	*	.	H	α-helix	trans	-84.8	-47.7	179.3	-169.8	0	0	0	0	111.6	P396 I397 F403	P396-S399 PolarHBondContact O-N 3.27Å; I397-S399 PolarHBondContact O-N 3.32Å; S399-F403 PolarHBondContact O-N 3.43Å; S399-F403 VanDerWaalsContact O-N 3.14Å
400	S	81.5	Confident	86.3	Confident	13 Å²	13	52 Å²	52	9%	0.091	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-44.6	-168.1	-63.2	0	0	0	0	113.1	Y395 P396 F403 T404 Y769	Y395-S400 VanDerWaalsContact CB-OG 3.31Å; Y395-S400 WeakPolarHBondContact CB-OG 3.23Å; P396-S400 PolarHBondContact O-N 3.1Å; P396-S400 PolarHBondContact O-OG 3.38Å; S400-F403 PolarHBondContact O-N 3.49Å; S400-T404 PolarHBondContact O-N 3.49Å; S400-T404 PolarHBondContact O-OG1 2.9Å; S400-Y769 PolarHBondContact O-OH 2.54Å; S400-Y769 VanDerWaalsContact O-OH 3.11Å
401	Y	83	Confident	86.7	Confident	16 Å²	16	54.5 Å²	54.5	6%	0.063	28%	0.275	C	S	.	.	H	α-helix	trans	-74.9	-32.7	-175.6	-56.6	-51.8	0	0	0	113.4	Y391 T392 I397 T405	Y391-Y401 AromaticContact CD1-CD1 3.96Å; Y391-Y401 HydrophobicContact CD1-CD1 3.96Å; Y391-Y401 AromaticContact CD1-CD2 3.61Å; Y391-Y401 HydrophobicContact CD1-CD2 3.61Å; Y391-Y401 AromaticContact CD1-CE1 3.82Å; Y391-Y401 HydrophobicContact CD1-CE1 3.82Å; Y391-Y401 AromaticContact CD1-CE2 3.43Å; Y391-Y401 HydrophobicContact CD1-CE2 3.43Å; Y391-Y401 VanDerWaalsContact CD1-CE2 3.43Å; Y391-Y401 AromaticContact CD1-CG 3.91Å; Y391-Y401 HydrophobicContact CD1-CG 3.91Å; Y391-Y401 AromaticContact CD1-CZ 3.59Å; Y391-Y401 HydrophobicContact CE1-CD1 4.32Å; Y391-Y401 AromaticContact CE1-CD2 3.92Å; Y391-Y401 HydrophobicContact CE1-CD2 3.92Å; Y391-Y401 HydrophobicContact CE1-CE2 4.21Å; Y391-Y401 HydrophobicContact CE1-CG 4.02Å; Y391-Y401 HydrophobicContact CG-CD2 4.42Å; Y391-Y401 AromaticContact CG-CE2 3.91Å; Y391-Y401 HydrophobicContact CG-CE2 3.91Å; T392-Y401 HydrophobicContact CG2-CE1 4.13Å; T392-Y401 VanDerWaalsContact CG2-OH 3.25Å; T392-Y401 WeakPolarHBondContact CG2-OH 3.28Å; T392-Y401 PolarHBondContact N-OH 3.48Å; T392-Y401 PolarHBondContact O-OH 3.29Å; I397-Y401 HydrophobicContact CB-CD2 4.22Å; I397-Y401 HydrophobicContact CB-CE2 3.94Å; I397-Y401 HydrophobicContact CG1-CE2 4.05Å; I397-Y401 HydrophobicContact CG2-CD2 3.7Å; I397-Y401 HydrophobicContact CG2-CE2 3.77Å; I397-Y401 WeakPolarHBondContact O-CD2 3.42Å; I397-Y401 PolarHBondContact O-N 3.06Å; Y401-T405 WeakPolarHBondContact O-CB 3.13Å; Y401-T405 PolarHBondContact O-N 3.42Å; Y401-T405 PolarHBondContact O-OG1 3.34Å
402	H	86.1	Confident	87.2	Confident	145 Å²	145	52.4 Å²	52.4	67%	0.671	27%	0.267	S	S	*	.	H	α-helix	trans	-65.2	-46.1	172.8	-75.6	-97.8	0	0	0	110.6	N398 T405 F406	N398-H402 PolarHBondContact O-CD2 3.09Å; H402-T405 PolarHBondContact O-N 3Å; H402-F406 WeakPolarHBondContact O-CB 3.4Å; H402-F406 PolarHBondContact O-N 3.37Å
403	F	91.1	Very high	87.7	Confident	86 Å²	86	56.1 Å²	56.1	38%	0.377	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-47.4	174.9	-171.7	-87.7	0	0	0	112.5	S399 S400 T405 F406 W407 Y769 M773	S399-F403 PolarHBondContact O-N 3.43Å; S399-F403 VanDerWaalsContact O-N 3.14Å; S400-F403 PolarHBondContact O-N 3.49Å; F403-T405 VanDerWaalsContact C-N 3.29Å; F403-T405 PolarHBondContact O-N 3.45Å; F403-F406 PolarHBondContact O-N 3.44Å; F403-W407 HydrophobicContact CD1-CB 4.34Å; F403-W407 HydrophobicContact CE1-CB 4.09Å; F403-W407 HydrophobicContact CE1-CD2 4.13Å; F403-W407 AromaticContact CE1-CE3 3.97Å; F403-W407 HydrophobicContact CE1-CE3 3.97Å; F403-W407 HydrophobicContact CE1-CG 4.22Å; F403-W407 HydrophobicContact CE2-CE3 4.5Å; F403-W407 HydrophobicContact CZ-CD2 4.24Å; F403-W407 AromaticContact CZ-CE3 3.6Å; F403-W407 HydrophobicContact CZ-CE3 3.6Å; F403-W407 HydrophobicContact CZ-CZ3 4.15Å; F403-W407 VanDerWaalsContact O-CB 3.25Å; F403-W407 WeakPolarHBondContact O-CB 3.16Å; F403-W407 PolarHBondContact O-N 2.99Å; F403-Y769 AromaticContact CD1-CE1 3.86Å; F403-Y769 HydrophobicContact CD1-CE1 3.86Å; F403-Y769 WeakPolarHBondContact CD1-OH 3.33Å; F403-Y769 HydrophobicContact CE1-CE1 4.28Å; F403-M773 HydrophobicContact CD1-CE 4.5Å; F403-M773 HydrophobicContact CE1-CE 4.49Å
404	T	91.7	Very high	88.2	Confident	1 Å²	1	59.7 Å²	59.7	1%	0.006	30%	0.298	C	S	.	.	H	α-helix	trans	-56.2	-45.3	177.4	-58	0	0	0	0	111.1	S400 L408 Y769 M773	S400-T404 PolarHBondContact O-N 3.49Å; S400-T404 PolarHBondContact O-OG1 2.9Å; T404-L408 HydrophobicContact CG2-CD1 3.83Å; T404-L408 HydrophobicContact CG2-CG 4.21Å; T404-L408 WeakPolarHBondContact O-CB 3.37Å; T404-L408 VanDerWaalsContact O-CG 3.3Å; T404-L408 WeakPolarHBondContact O-CG 3.4Å; T404-L408 PolarHBondContact O-N 2.96Å; T404-Y769 PolarHBondContact N-OH 3.12Å; T404-Y769 PolarHBondContact OG1-OH 2.92Å; T404-M773 HydrophobicContact CG2-CE 4.11Å; T404-M773 HydrophobicContact CG2-SD 4.14Å
405	T	92	Very high	88.7	Confident	44 Å²	44	57.9 Å²	57.9	27%	0.27	29%	0.291	S	S	.	.	H	α-helix	trans	-64.9	-46.5	-177.9	-53.1	0	0	0	0	111.6	Y401 H402 F403 G409 R457 V458	Y401-T405 WeakPolarHBondContact O-CB 3.13Å; Y401-T405 PolarHBondContact O-N 3.42Å; Y401-T405 PolarHBondContact O-OG1 3.34Å; H402-T405 PolarHBondContact O-N 3Å; F403-T405 VanDerWaalsContact C-N 3.29Å; F403-T405 PolarHBondContact O-N 3.45Å; T405-G409 PolarHBondContact O-N 3.22Å; T405-R457 PolarHBondContact OG1-NH2 3.48Å; T405-V458 HydrophobicContact CG2-CG1 4.37Å
406	F	93.7	Very high	89.3	Confident	132 Å²	132	57.6 Å²	57.6	58%	0.579	29%	0.293	S	S	*	.	H	α-helix	trans	-61.5	-48.2	176.8	174.1	-104.6	0	0	0	112.2	H402 F403 G409 I410	H402-F406 WeakPolarHBondContact O-CB 3.4Å; H402-F406 PolarHBondContact O-N 3.37Å; F403-F406 PolarHBondContact O-N 3.44Å; F406-G409 PolarHBondContact O-N 3.36Å; F406-I410 HydrophobicContact CD1-CD1 4.12Å; F406-I410 HydrophobicContact CD2-CD1 4.17Å; F406-I410 HydrophobicContact CE1-CD1 3.62Å; F406-I410 HydrophobicContact CE2-CD1 3.67Å; F406-I410 HydrophobicContact CG-CD1 4.38Å; F406-I410 HydrophobicContact CZ-CD1 3.38Å; F406-I410 PolarHBondContact O-N 3.44Å
407	W	95	Very high	90.1	Very high	73 Å²	73	58.2 Å²	58.2	28%	0.277	29%	0.291	S	S	.	.	H	α-helix	trans	-63.6	-48.7	-178.4	-176.1	-89.9	0	0	0	112.6	F403 G409 I410 W411 M773 F777	F403-W407 HydrophobicContact CD1-CB 4.34Å; F403-W407 HydrophobicContact CE1-CB 4.09Å; F403-W407 HydrophobicContact CE1-CD2 4.13Å; F403-W407 AromaticContact CE1-CE3 3.97Å; F403-W407 HydrophobicContact CE1-CE3 3.97Å; F403-W407 HydrophobicContact CE1-CG 4.22Å; F403-W407 HydrophobicContact CE2-CE3 4.5Å; F403-W407 HydrophobicContact CZ-CD2 4.24Å; F403-W407 AromaticContact CZ-CE3 3.6Å; F403-W407 HydrophobicContact CZ-CE3 3.6Å; F403-W407 HydrophobicContact CZ-CZ3 4.15Å; F403-W407 VanDerWaalsContact O-CB 3.25Å; F403-W407 WeakPolarHBondContact O-CB 3.16Å; F403-W407 PolarHBondContact O-N 2.99Å; W407-G409 VanDerWaalsContact C-N 3.29Å; W407-G409 PolarHBondContact O-N 2.65Å; W407-I410 PolarHBondContact O-N 2.8Å; W407-W411 AromaticContact CD1-CD1 3.79Å; W407-W411 AromaticContact CD2-CD1 3.85Å; W407-W411 AromaticContact CD2-NE1 3.65Å; W407-W411 AromaticContact CE2-CD1 3.57Å; W407-W411 AromaticContact CE2-NE1 3.32Å; W407-W411 VanDerWaalsContact CE2-NE1 3.32Å; W407-W411 AromaticContact CE3-NE1 3.96Å; W407-W411 AromaticContact CH2-NE1 3.71Å; W407-W411 AromaticContact CZ2-NE1 3.36Å; W407-W411 AromaticContact CZ3-NE1 3.99Å; W407-W411 AromaticContact NE1-CD1 3.55Å; W407-W411 AromaticContact NE1-NE1 3.81Å; W407-W411 PolarHBondContact O-N 3.37Å; W407-M773 HydrophobicContact CB-CE 3.7Å; W407-M773 HydrophobicContact CG-CE 3.59Å; W407-F777 HydrophobicContact CZ2-CB 4.37Å; W407-F777 HydrophobicContact CZ2-CD2 4.23Å; W407-F777 HydrophobicContact CZ2-CG 4.34Å
408	L	95.1	Very high	91.4	Very high	1 Å²	1	55 Å²	55	1%	0.005	28%	0.276	C	S	.	.	H	α-helix	trans	-65.9	-34.3	176.7	-63.6	-176.4	0	0	0	111.5	T404 S412 Y454 H776	T404-L408 HydrophobicContact CG2-CD1 3.83Å; T404-L408 HydrophobicContact CG2-CG 4.21Å; T404-L408 WeakPolarHBondContact O-CB 3.37Å; T404-L408 VanDerWaalsContact O-CG 3.3Å; T404-L408 WeakPolarHBondContact O-CG 3.4Å; T404-L408 PolarHBondContact O-N 2.96Å; L408-S412 VanDerWaalsContact O-CB 3.23Å; L408-S412 WeakPolarHBondContact O-CB 3.44Å; L408-S412 PolarHBondContact O-N 3.35Å; L408-S412 PolarHBondContact O-OG 2.97Å; L408-Y454 HydrophobicContact CB-CD1 4.34Å; L408-Y454 HydrophobicContact CD1-CD1 4.2Å; L408-Y454 HydrophobicContact CD1-CE1 4.34Å; L408-Y454 HydrophobicContact CD2-CD1 4.1Å; L408-Y454 HydrophobicContact CD2-CE1 3.93Å; L408-Y454 HydrophobicContact CG-CD1 4.44Å; L408-H776 HydrophobicContact CD2-CB 3.48Å; L408-H776 VanDerWaalsContact CD2-CB 3.48Å
409	G	96.1	Very high	92.7	Very high	8 Å²	8	48.6 Å²	48.6	8%	0.082	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-54.6	172.9	0	0	0	0	0	112.7	T405 F406 W407 W411 S412 I413	T405-G409 PolarHBondContact O-N 3.22Å; F406-G409 PolarHBondContact O-N 3.36Å; W407-G409 VanDerWaalsContact C-N 3.29Å; W407-G409 PolarHBondContact O-N 2.65Å; G409-W411 PolarHBondContact O-N 3.36Å; G409-S412 PolarHBondContact O-N 2.92Å; G409-S412 PolarHBondContact O-OG 3.37Å; G409-S412 VanDerWaalsContact O-OG 3.11Å; G409-I413 WeakPolarHBondContact O-CB 3.41Å; G409-I413 VanDerWaalsContact O-CG1 3.24Å; G409-I413 WeakPolarHBondContact O-CG1 3.16Å; G409-I413 PolarHBondContact O-N 2.94Å
410	I	97	Very high	93.6	Very high	56 Å²	56	47.6 Å²	47.6	29%	0.287	23%	0.229	S	C	.	.	H	α-helix	trans	-58.5	-51.8	-179	-72.4	171.9	0	0	0	111.7	F406 W407 S412 I413 F414	F406-I410 HydrophobicContact CD1-CD1 4.12Å; F406-I410 HydrophobicContact CD2-CD1 4.17Å; F406-I410 HydrophobicContact CE1-CD1 3.62Å; F406-I410 HydrophobicContact CE2-CD1 3.67Å; F406-I410 HydrophobicContact CG-CD1 4.38Å; F406-I410 HydrophobicContact CZ-CD1 3.38Å; F406-I410 PolarHBondContact O-N 3.44Å; W407-I410 PolarHBondContact O-N 2.8Å; I410-S412 VanDerWaalsContact C-N 3.34Å; I410-S412 PolarHBondContact O-N 3.43Å; I410-I413 PolarHBondContact O-N 3.44Å; I410-F414 HydrophobicContact CG2-CD2 3.89Å; I410-F414 HydrophobicContact CG2-CE2 3.57Å; I410-F414 HydrophobicContact CG2-CZ 4.2Å; I410-F414 PolarHBondContact O-N 3.02Å
411	W	97.3	Very high	94.1	Very high	53 Å²	53	49.9 Å²	49.9	20%	0.201	24%	0.24	C	C	.	.	H	α-helix	trans	-71.2	-28.6	-174.8	-66.8	115.6	0	0	0	113.1	W407 G409 F414 C415 F777 L780 M781 I784	W407-W411 AromaticContact CD1-CD1 3.79Å; W407-W411 AromaticContact CD2-CD1 3.85Å; W407-W411 AromaticContact CD2-NE1 3.65Å; W407-W411 AromaticContact CE2-CD1 3.57Å; W407-W411 AromaticContact CE2-NE1 3.32Å; W407-W411 VanDerWaalsContact CE2-NE1 3.32Å; W407-W411 AromaticContact CE3-NE1 3.96Å; W407-W411 AromaticContact CH2-NE1 3.71Å; W407-W411 AromaticContact CZ2-NE1 3.36Å; W407-W411 AromaticContact CZ3-NE1 3.99Å; W407-W411 AromaticContact NE1-CD1 3.55Å; W407-W411 AromaticContact NE1-NE1 3.81Å; W407-W411 PolarHBondContact O-N 3.37Å; G409-W411 PolarHBondContact O-N 3.36Å; W411-F414 AromaticContact CE3-CD2 3.98Å; W411-F414 HydrophobicContact CE3-CD2 3.98Å; W411-F414 AromaticContact CZ3-CD2 3.94Å; W411-F414 HydrophobicContact CZ3-CD2 3.94Å; W411-C415 VanDerWaalsContact O-CB 3.23Å; W411-C415 WeakPolarHBondContact O-CB 3.24Å; W411-C415 PolarHBondContact O-N 2.55Å; W411-F777 AromaticContact CD1-CD2 3.93Å; W411-F777 AromaticContact CD2-CD2 3.67Å; W411-F777 HydrophobicContact CD2-CD2 3.67Å; W411-F777 AromaticContact CD2-CE2 3.77Å; W411-F777 HydrophobicContact CD2-CE2 3.77Å; W411-F777 AromaticContact CE2-CD2 3.57Å; W411-F777 AromaticContact CE2-CE2 3.53Å; W411-F777 HydrophobicContact CE3-CD2 4.21Å; W411-F777 AromaticContact CE3-CE2 3.93Å; W411-F777 HydrophobicContact CE3-CE2 3.93Å; W411-F777 AromaticContact CG-CD2 3.95Å; W411-F777 HydrophobicContact CG-CD2 3.95Å; W411-F777 AromaticContact CH2-CE2 3.74Å; W411-F777 HydrophobicContact CH2-CE2 3.74Å; W411-F777 HydrophobicContact CZ2-CD2 4.06Å; W411-F777 AromaticContact CZ2-CE2 3.53Å; W411-F777 HydrophobicContact CZ2-CE2 3.53Å; W411-F777 AromaticContact CZ3-CE2 3.92Å; W411-F777 HydrophobicContact CZ3-CE2 3.92Å; W411-F777 AromaticContact NE1-CD2 3.69Å; W411-L780 HydrophobicContact CB-CB 4.38Å; W411-L780 HydrophobicContact CB-CD1 3.9Å; W411-M781 HydrophobicContact CZ3-CE 4.17Å; W411-I784 HydrophobicContact CE3-CD1 3.67Å; W411-I784 HydrophobicContact CZ3-CD1 4.05Å
412	S	97.5	Very high	94.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-75.9	-35	172.5	61	0	0	0	0	112.8	L408 G409 I410 C415 A416 S451 L455	L408-S412 VanDerWaalsContact O-CB 3.23Å; L408-S412 WeakPolarHBondContact O-CB 3.44Å; L408-S412 PolarHBondContact O-N 3.35Å; L408-S412 PolarHBondContact O-OG 2.97Å; G409-S412 PolarHBondContact O-N 2.92Å; G409-S412 PolarHBondContact O-OG 3.37Å; G409-S412 VanDerWaalsContact O-OG 3.11Å; I410-S412 VanDerWaalsContact C-N 3.34Å; I410-S412 PolarHBondContact O-N 3.43Å; S412-C415 PolarHBondContact O-N 3.45Å; S412-A416 WeakPolarHBondContact O-CB 3.35Å; S412-A416 PolarHBondContact O-N 2.96Å; S412-S451 VanDerWaalsContact C-OG 3.32Å; S412-S451 WeakPolarHBondContact CA-OG 3.49Å; S412-S451 WeakPolarHBondContact CB-OG 3.44Å; S412-S451 PolarHBondContact O-OG 3.08Å; S412-L455 WeakPolarHBondContact OG-CD2 3.5Å
413	I	97.6	Very high	94.9	Very high	83 Å²	83	43.4 Å²	43.4	43%	0.426	21%	0.211	S	C	.	.	H	α-helix	trans	-61.7	-48.1	171.2	-70	168.1	0	0	0	110.4	G409 I410 A416 I417 L455	G409-I413 WeakPolarHBondContact O-CB 3.41Å; G409-I413 VanDerWaalsContact O-CG1 3.24Å; G409-I413 WeakPolarHBondContact O-CG1 3.16Å; G409-I413 PolarHBondContact O-N 2.94Å; I410-I413 PolarHBondContact O-N 3.44Å; I413-A416 PolarHBondContact O-N 2.87Å; I413-I417 HydrophobicContact CG2-CD1 3.7Å; I413-I417 VanDerWaalsContact O-CG1 3.31Å; I413-I417 WeakPolarHBondContact O-CG1 3.31Å; I413-I417 PolarHBondContact O-N 3.48Å; I413-L455 HydrophobicContact CG1-CD2 3.87Å
414	F	96.5	Very high	94.9	Very high	105 Å²	105	43.8 Å²	43.8	46%	0.461	21%	0.213	S	C	.	.	H	α-helix	trans	-65	-40.5	177.8	-68.2	-24.6	0	0	0	113.2	I410 W411 S418 I784	I410-F414 HydrophobicContact CG2-CD2 3.89Å; I410-F414 HydrophobicContact CG2-CE2 3.57Å; I410-F414 HydrophobicContact CG2-CZ 4.2Å; I410-F414 PolarHBondContact O-N 3.02Å; W411-F414 AromaticContact CE3-CD2 3.98Å; W411-F414 HydrophobicContact CE3-CD2 3.98Å; W411-F414 AromaticContact CZ3-CD2 3.94Å; W411-F414 HydrophobicContact CZ3-CD2 3.94Å; F414-S418 VanDerWaalsContact O-CB 3.24Å; F414-S418 WeakPolarHBondContact O-CB 3.24Å; F414-S418 PolarHBondContact O-N 2.83Å; F414-I784 HydrophobicContact CB-CD1 3.84Å; F414-I784 HydrophobicContact CB-CG1 4.35Å
415	C	97	Very high	94.9	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-63.4	-44.1	174.6	-178	0	0	0	0	111.8	W411 S412 S418 T419 S451 L780 I784	W411-C415 VanDerWaalsContact O-CB 3.23Å; W411-C415 WeakPolarHBondContact O-CB 3.24Å; W411-C415 PolarHBondContact O-N 2.55Å; S412-C415 PolarHBondContact O-N 3.45Å; C415-S418 PolarHBondContact O-N 3.44Å; C415-T419 WeakPolarHBondContact O-CB 3.37Å; C415-T419 WeakPolarHBondContact O-CG2 3.26Å; C415-T419 PolarHBondContact O-N 2.99Å; C415-T419 PolarHBondContact O-OG1 3.14Å; C415-S451 WeakPolarHBondContact CB-OG 3.41Å; C415-L780 HydrophobicContact CB-CB 4.36Å; C415-L780 HydrophobicContact CB-CD2 4.07Å; C415-I784 HydrophobicContact CB-CG1 4.1Å
416	A	97.2	Very high	94.8	Very high	13 Å²	13	44 Å²	44	11%	0.107	21%	0.21	C	C	.	.	H	α-helix	trans	-63.4	-45.7	177.8	0	0	0	0	0	112	S412 I413 T419 L420 L455	S412-A416 WeakPolarHBondContact O-CB 3.35Å; S412-A416 PolarHBondContact O-N 2.96Å; I413-A416 PolarHBondContact O-N 2.87Å; A416-T419 PolarHBondContact O-OG1 3Å; A416-L420 WeakPolarHBondContact O-CB 3.27Å; A416-L420 PolarHBondContact O-N 2.89Å; A416-L455 HydrophobicContact CB-CD1 4.18Å
417	I	95.8	Very high	94.7	Very high	91 Å²	91	43 Å²	43	47%	0.467	21%	0.21	S	C	.	.	H	α-helix	trans	-63.7	-46.3	177.7	-68	168.1	0	0	0	111	I413 L420 I421	I413-I417 HydrophobicContact CG2-CD1 3.7Å; I413-I417 VanDerWaalsContact O-CG1 3.31Å; I413-I417 WeakPolarHBondContact O-CG1 3.31Å; I413-I417 PolarHBondContact O-N 3.48Å; I417-L420 PolarHBondContact O-N 2.92Å; I417-I421 HydrophobicContact CG2-CD1 3.78Å; I417-I421 VanDerWaalsContact O-CG1 3.28Å; I417-I421 WeakPolarHBondContact O-CG1 3.31Å; I417-I421 PolarHBondContact O-N 3.2Å
418	S	94.9	Very high	94.4	Very high	17 Å²	17	42.1 Å²	42.1	12%	0.119	21%	0.21	C	C	.	.	H	α-helix	trans	-57.1	-51.3	177.8	171.9	0	0	0	0	112.4	F414 C415 T422 G783 I784 G787	F414-S418 VanDerWaalsContact O-CB 3.24Å; F414-S418 WeakPolarHBondContact O-CB 3.24Å; F414-S418 PolarHBondContact O-N 2.83Å; C415-S418 PolarHBondContact O-N 3.44Å; S418-T422 PolarHBondContact O-N 3.37Å; S418-G783 WeakPolarHBondContact CB-O 3.41Å; S418-G783 PolarHBondContact OG-O 2.89Å; S418-I784 WeakPolarHBondContact OG-CA 3.4Å; S418-I784 PolarHBondContact OG-O 3.33Å; S418-G787 VanDerWaalsContact OG-CA 3.29Å; S418-G787 WeakPolarHBondContact OG-CA 3.36Å; S418-G787 PolarHBondContact OG-N 2.99Å
419	T	95.4	Very high	94	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.3	-37.3	-179	51.2	0	0	0	0	112.2	C415 A416 T422 I423 S444 F448	C415-T419 WeakPolarHBondContact O-CB 3.37Å; C415-T419 WeakPolarHBondContact O-CG2 3.26Å; C415-T419 PolarHBondContact O-N 2.99Å; C415-T419 PolarHBondContact O-OG1 3.14Å; A416-T419 PolarHBondContact O-OG1 3Å; T419-T422 VanDerWaalsContact O-CB 3.31Å; T419-T422 WeakPolarHBondContact O-CB 3.31Å; T419-T422 PolarHBondContact O-N 2.99Å; T419-I423 WeakPolarHBondContact O-CD1 3.41Å; T419-I423 VanDerWaalsContact O-CG1 3.24Å; T419-I423 WeakPolarHBondContact O-CG1 3.35Å; T419-I423 PolarHBondContact O-N 3.49Å; T419-S444 WeakPolarHBondContact CB-O 3.5Å; T419-S444 WeakPolarHBondContact CG2-O 3.42Å; T419-F448 WeakPolarHBondContact OG1-CA 3.27Å; T419-F448 WeakPolarHBondContact OG1-CB 3.35Å
420	L	94.3	Very high	93.6	Very high	63 Å²	63	47 Å²	47	33%	0.33	24%	0.239	S	C	.	.	H	α-helix	trans	-66.4	-40.7	177.4	-174.8	60.9	0	0	0	112.5	A416 I417 T422 I423 F424 F448	A416-L420 WeakPolarHBondContact O-CB 3.27Å; A416-L420 PolarHBondContact O-N 2.89Å; I417-L420 PolarHBondContact O-N 2.92Å; L420-T422 VanDerWaalsContact C-N 3.27Å; L420-T422 PolarHBondContact O-N 3.32Å; L420-I423 PolarHBondContact O-N 2.04Å; L420-F424 HydrophobicContact CD1-CD2 3.9Å; L420-F424 HydrophobicContact CD1-CE2 3.48Å; L420-F424 VanDerWaalsContact CD1-CE2 3.48Å; L420-F424 HydrophobicContact CD1-CZ 3.94Å; L420-F424 HydrophobicContact CD2-CE2 3.95Å; L420-F424 HydrophobicContact CG-CD2 3.77Å; L420-F424 HydrophobicContact CG-CE2 3.49Å; L420-F424 VanDerWaalsContact CG-CE2 3.49Å; L420-F424 HydrophobicContact CG-CZ 4.41Å; L420-F424 WeakPolarHBondContact O-CD2 3.31Å; L420-F424 PolarHBondContact O-N 3.45Å; L420-F448 HydrophobicContact CB-CD2 4.22Å; L420-F448 HydrophobicContact CB-CE2 4.09Å; L420-F448 HydrophobicContact CD1-CE2 4.07Å; L420-F448 HydrophobicContact CD1-CZ 4.45Å; L420-F448 HydrophobicContact CD2-CE2 4.45Å; L420-F448 HydrophobicContact CG-CE2 4.43Å
421	I	92.2	Very high	93	Very high	61 Å²	61	52.9 Å²	52.9	31%	0.313	26%	0.259	S	S	.	.	H	α-helix	trans	-60.3	-39.6	171.9	-69.8	165.6	0	0	0	110.6	I417 T425 W799	I417-I421 HydrophobicContact CG2-CD1 3.78Å; I417-I421 VanDerWaalsContact O-CG1 3.28Å; I417-I421 WeakPolarHBondContact O-CG1 3.31Å; I417-I421 PolarHBondContact O-N 3.2Å; I421-T425 WeakPolarHBondContact O-CB 3.27Å; I421-T425 PolarHBondContact O-N 2.02Å; I421-T425 PolarHBondContact O-OG1 3.06Å; I421-W799 HydrophobicContact CG2-CZ2 4.42Å
422	T	91.8	Very high	92.4	Very high	0 Å²	0	53 Å²	53	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.3	-49.9	174.8	-78.4	0	0	0	0	112.1	S418 T419 L420 T425 F426 I441 S444 I790	S418-T422 PolarHBondContact O-N 3.37Å; T419-T422 VanDerWaalsContact O-CB 3.31Å; T419-T422 WeakPolarHBondContact O-CB 3.31Å; T419-T422 PolarHBondContact O-N 2.99Å; L420-T422 VanDerWaalsContact C-N 3.27Å; L420-T422 PolarHBondContact O-N 3.32Å; T422-T425 PolarHBondContact O-N 3.39Å; T422-F426 PolarHBondContact O-N 3.42Å; T422-I441 HydrophobicContact CG2-CD1 4.07Å; T422-S444 VanDerWaalsContact CG2-CB 3.47Å; T422-S444 WeakPolarHBondContact CG2-OG 3.49Å; T422-I790 HydrophobicContact CG2-CD1 3.57Å
423	I	93.1	Very high	91.8	Very high	25 Å²	25	53.3 Å²	53.3	13%	0.128	26%	0.261	C	S	.	.	H	α-helix	trans	-62.7	-45.3	-179.9	-64.2	160.8	0	0	0	110.3	T419 L420 T425 F426 I427 L445 F448	T419-I423 WeakPolarHBondContact O-CD1 3.41Å; T419-I423 VanDerWaalsContact O-CG1 3.24Å; T419-I423 WeakPolarHBondContact O-CG1 3.35Å; T419-I423 PolarHBondContact O-N 3.49Å; L420-I423 PolarHBondContact O-N 2.04Å; I423-T425 VanDerWaalsContact C-N 3.35Å; I423-T425 PolarHBondContact O-N 3.4Å; I423-F426 WeakPolarHBondContact O-CB 3.15Å; I423-F426 PolarHBondContact O-N 3.47Å; I423-I427 HydrophobicContact CG2-CD1 3.87Å; I423-I427 WeakPolarHBondContact O-CG1 3.44Å; I423-I427 PolarHBondContact O-N 3.12Å; I423-L445 HydrophobicContact CD1-CD1 4.18Å; I423-F448 HydrophobicContact CD1-CB 3.88Å; I423-F448 HydrophobicContact CD1-CG 4.11Å
424	F	91.7	Very high	91.3	Very high	94 Å²	94	53.7 Å²	53.7	41%	0.412	26%	0.261	S	S	.	.	H	α-helix	trans	-63.4	-37.7	175.3	-77.2	-49.5	0	0	0	113	L420 F426 I427 I428 W799	L420-F424 HydrophobicContact CD1-CD2 3.9Å; L420-F424 HydrophobicContact CD1-CE2 3.48Å; L420-F424 VanDerWaalsContact CD1-CE2 3.48Å; L420-F424 HydrophobicContact CD1-CZ 3.94Å; L420-F424 HydrophobicContact CD2-CE2 3.95Å; L420-F424 HydrophobicContact CG-CD2 3.77Å; L420-F424 HydrophobicContact CG-CE2 3.49Å; L420-F424 VanDerWaalsContact CG-CE2 3.49Å; L420-F424 HydrophobicContact CG-CZ 4.41Å; L420-F424 WeakPolarHBondContact O-CD2 3.31Å; L420-F424 PolarHBondContact O-N 3.45Å; F424-F426 VanDerWaalsContact C-N 3.28Å; F424-F426 PolarHBondContact O-N 2.65Å; F424-I427 HydrophobicContact CD1-CD1 4.26Å; F424-I427 PolarHBondContact O-N 2.9Å; F424-I428 VanDerWaalsContact O-CG1 3.28Å; F424-I428 WeakPolarHBondContact O-CG1 3.47Å; F424-I428 PolarHBondContact O-N 3.23Å; F424-W799 HydrophobicContact CB-CH2 3.69Å; F424-W799 HydrophobicContact CB-CZ2 3.67Å; F424-W799 HydrophobicContact CD2-CH2 4.39Å; F424-W799 HydrophobicContact CG-CH2 4.36Å
425	T	90.8	Very high	91	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-61.6	-39.2	175.1	-54.6	0	0	0	0	111.4	I421 T422 I423 D429 F433 I790 T795 W799	I421-T425 WeakPolarHBondContact O-CB 3.27Å; I421-T425 PolarHBondContact O-N 2.02Å; I421-T425 PolarHBondContact O-OG1 3.06Å; T422-T425 PolarHBondContact O-N 3.39Å; I423-T425 VanDerWaalsContact C-N 3.35Å; I423-T425 PolarHBondContact O-N 3.4Å; T425-D429 PolarHBondContact O-N 3.49Å; T425-D429 VanDerWaalsContact O-N 3.16Å; T425-F433 HydrophobicContact CG2-CE2 4.17Å; T425-F433 HydrophobicContact CG2-CZ 3.97Å; T425-I790 HydrophobicContact CG2-CG2 3.79Å; T425-T795 HydrophobicContact CG2-CG2 3.87Å; T425-W799 PolarHBondContact OG1-NE1 3.05Å
426	F	90.4	Very high	90.6	Very high	49 Å²	49	50.3 Å²	50.3	22%	0.215	25%	0.248	C	C	.	.	H	α-helix	trans	-67.7	-38.1	173.5	174	-100.4	0	0	0	112.9	T422 I423 F424 D429 S430 F433 L438 I441	T422-F426 PolarHBondContact O-N 3.42Å; I423-F426 WeakPolarHBondContact O-CB 3.15Å; I423-F426 PolarHBondContact O-N 3.47Å; F424-F426 VanDerWaalsContact C-N 3.28Å; F424-F426 PolarHBondContact O-N 2.65Å; F426-D429 CarbonylContact O-C 3.56Å; F426-S430 WeakPolarHBondContact O-CA 3.12Å; F426-S430 VanDerWaalsContact O-CB 3.26Å; F426-S430 WeakPolarHBondContact O-CB 3.3Å; F426-S430 PolarHBondContact O-N 3.44Å; F426-F433 HydrophobicContact CB-CD2 4.32Å; F426-F433 HydrophobicContact CB-CE2 4.47Å; F426-F433 HydrophobicContact CD2-CB 3.84Å; F426-F433 AromaticContact CD2-CD2 3.78Å; F426-F433 HydrophobicContact CD2-CD2 3.78Å; F426-F433 HydrophobicContact CD2-CG 4.06Å; F426-F433 HydrophobicContact CE2-CB 4.1Å; F426-L438 HydrophobicContact CE2-CD1 3.64Å; F426-L438 HydrophobicContact CZ-CD1 4.01Å; F426-I441 HydrophobicContact CB-CD1 4.2Å; F426-I441 HydrophobicContact CB-CG1 4.4Å; F426-I441 HydrophobicContact CB-CG2 3.85Å; F426-I441 HydrophobicContact CD1-CG2 3.86Å; F426-I441 HydrophobicContact CD2-CB 4.46Å; F426-I441 HydrophobicContact CD2-CD1 4.46Å; F426-I441 HydrophobicContact CD2-CG1 3.91Å; F426-I441 HydrophobicContact CD2-CG2 3.99Å; F426-I441 HydrophobicContact CE1-CG2 4.42Å; F426-I441 HydrophobicContact CG-CG1 4.27Å; F426-I441 HydrophobicContact CG-CG2 3.62Å
427	I	91.1	Very high	90.2	Very high	112 Å²	112	50.7 Å²	50.7	57%	0.574	25%	0.247	S	C	*	.	H	α-helix	trans	-66.2	-40	177.5	-68.9	164.7	0	0	0	111.5	I423 F424	I423-I427 HydrophobicContact CG2-CD1 3.87Å; I423-I427 WeakPolarHBondContact O-CG1 3.44Å; I423-I427 PolarHBondContact O-N 3.12Å; F424-I427 HydrophobicContact CD1-CD1 4.26Å; F424-I427 PolarHBondContact O-N 2.9Å
428	I	89.5	Confident	89.9	Confident	54 Å²	54	47.3 Å²	47.3	28%	0.277	23%	0.23	S	C	.	.	H	α-helix	trans	-72.2	-34.5	-179.8	-63.4	163.5	0	0	0	111.9	F424 T798 W799 F802	F424-I428 VanDerWaalsContact O-CG1 3.28Å; F424-I428 WeakPolarHBondContact O-CG1 3.47Å; F424-I428 PolarHBondContact O-N 3.23Å; I428-T798 HydrophobicContact CB-CG2 4.32Å; I428-T798 HydrophobicContact CG2-CG2 3.56Å; I428-W799 HydrophobicContact CD1-CD2 4.31Å; I428-W799 HydrophobicContact CD1-CE3 4.42Å; I428-W799 HydrophobicContact CD1-CH2 4.37Å; I428-W799 HydrophobicContact CD1-CZ2 4.25Å; I428-W799 HydrophobicContact CD1-CZ3 4.45Å; I428-F802 HydrophobicContact CD1-CB 4.39Å; I428-F802 HydrophobicContact CD1-CD1 4.03Å; I428-F802 HydrophobicContact CD1-CD2 4.17Å; I428-F802 HydrophobicContact CD1-CE1 4.35Å; I428-F802 HydrophobicContact CD1-CE2 4.49Å; I428-F802 HydrophobicContact CD1-CG 3.93Å; I428-F802 HydrophobicContact CG1-CD2 4.08Å; I428-F802 HydrophobicContact CG1-CE2 4.24Å; I428-F802 HydrophobicContact CG1-CG 4.36Å; I428-F802 HydrophobicContact CG2-CB 4.29Å; I428-F802 HydrophobicContact CG2-CD2 4.13Å; I428-F802 HydrophobicContact CG2-CG 4.41Å
429	D	87.4	Confident	89.9	Confident	46 Å²	46	46.5 Å²	46.5	25%	0.246	22%	0.224	C	C	.	.			trans	-140.5	60.3	-172.5	-174.3	12	0	0	0	111.1	T425 F426 Y431 R432 F433 T798	T425-D429 PolarHBondContact O-N 3.49Å; T425-D429 VanDerWaalsContact O-N 3.16Å; F426-D429 CarbonylContact O-C 3.56Å; D429-Y431 VanDerWaalsContact C-N 3.29Å; D429-Y431 PolarHBondContact O-N 2.99Å; D429-R432 WeakPolarHBondContact O-CB 3.21Å; D429-R432 PolarHBondContact O-N 3.22Å; D429-R432 WeakPolarHBondContact OD1-CB 3.34Å; D429-R432 WeakPolarHBondContact OD2-CB 3.42Å; D429-R432 WeakPolarHBondContact OD2-CD 3.43Å; D429-F433 VanDerWaalsContact O-CD2 3.25Å; D429-F433 WeakPolarHBondContact O-CD2 3.42Å; D429-T798 HydrophobicContact CB-CG2 3.81Å; D429-T798 PolarHBondContact OD2-OG1 2.83Å
430	S	87.9	Confident	89.7	Confident	66 Å²	66	46.6 Å²	46.6	46%	0.462	23%	0.225	S	C	.	.	G	3₁₀ helix	trans	-65.7	-31.5	-175.7	58.6	0	0	0	0	113.1	F426 R432 F433	F426-S430 WeakPolarHBondContact O-CA 3.12Å; F426-S430 VanDerWaalsContact O-CB 3.26Å; F426-S430 WeakPolarHBondContact O-CB 3.3Å; F426-S430 PolarHBondContact O-N 3.44Å; S430-R432 PolarHBondContact O-N 2.84Å; S430-F433 PolarHBondContact O-N 3.45Å; S430-F433 VanDerWaalsContact O-N 3.15Å
431	Y	84.7	Confident	89.6	Confident	179 Å²	179	43.9 Å²	43.9	70%	0.702	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-66.2	-20.9	-178.6	-143.1	-87.7	0	0	0	113.3	D429	D429-Y431 VanDerWaalsContact C-N 3.29Å; D429-Y431 PolarHBondContact O-N 2.99Å
432	R	84.4	Confident	89.7	Confident	56 Å²	56	43.3 Å²	43.3	21%	0.211	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-70.2	-30.3	174.3	168.3	-178.6	167.1	-177.5	-6.6	113.3	D429 S430 Q434 S792 T795	D429-R432 WeakPolarHBondContact O-CB 3.21Å; D429-R432 PolarHBondContact O-N 3.22Å; D429-R432 WeakPolarHBondContact OD1-CB 3.34Å; D429-R432 WeakPolarHBondContact OD2-CB 3.42Å; D429-R432 WeakPolarHBondContact OD2-CD 3.43Å; S430-R432 PolarHBondContact O-N 2.84Å; R432-Q434 PolarHBondContact O-N 2.81Å; R432-S792 PolarHBondContact NH2-OG 2.98Å; R432-T795 PolarHBondContact NH1-OG1 2.96Å; R432-T795 PolarHBondContact NH2-OG1 3.05Å
433	F	83.8	Confident	89.8	Confident	5 Å²	5	43.3 Å²	43.3	2%	0.022	21%	0.205	C	C	.	.			trans	-102.4	74.4	-169.3	-61.2	-79.3	0	0	0	112	T425 F426 D429 S430 I441 W789 I790	T425-F433 HydrophobicContact CG2-CE2 4.17Å; T425-F433 HydrophobicContact CG2-CZ 3.97Å; F426-F433 HydrophobicContact CB-CD2 4.32Å; F426-F433 HydrophobicContact CB-CE2 4.47Å; F426-F433 HydrophobicContact CD2-CB 3.84Å; F426-F433 AromaticContact CD2-CD2 3.78Å; F426-F433 HydrophobicContact CD2-CD2 3.78Å; F426-F433 HydrophobicContact CD2-CG 4.06Å; F426-F433 HydrophobicContact CE2-CB 4.1Å; D429-F433 VanDerWaalsContact O-CD2 3.25Å; D429-F433 WeakPolarHBondContact O-CD2 3.42Å; S430-F433 PolarHBondContact O-N 3.45Å; S430-F433 VanDerWaalsContact O-N 3.15Å; F433-I441 HydrophobicContact CB-CG1 4.45Å; F433-I441 HydrophobicContact CD1-CD1 4.11Å; F433-I441 HydrophobicContact CE1-CD1 4.35Å; F433-I441 HydrophobicContact CG-CD1 4.35Å; F433-W789 HydrophobicContact CD1-CH2 4.38Å; F433-W789 HydrophobicContact CD1-CZ3 4.31Å; F433-W789 HydrophobicContact CE1-CH2 4.28Å; F433-W789 AromaticContact CE1-CZ3 3.95Å; F433-W789 HydrophobicContact CE1-CZ3 3.95Å; F433-I790 HydrophobicContact CE1-CD1 4.02Å; F433-I790 HydrophobicContact CZ-CD1 4.02Å
434	Q	87.6	Confident	89.9	Confident	92 Å²	92	42.1 Å²	42.1	43%	0.43	20%	0.198	S	C	.	.			trans	-87.6	169.2	174.8	-60.1	-171.8	-1	0	0	111.7	R432 E437 L438 S601	R432-Q434 PolarHBondContact O-N 2.81Å; Q434-E437 WeakPolarHBondContact O-CA 3.47Å; Q434-E437 WeakPolarHBondContact O-CB 3.09Å; Q434-E437 PolarHBondContact O-N 3.37Å; Q434-L438 PolarHBondContact O-N 3.35Å; Q434-S601 PolarHBondContact OE1-OG 3.17Å; Q434-S601 VanDerWaalsContact OE1-OG 3.06Å
435	Y	89.8	Confident	90.1	Very high	14 Å²	14	40.8 Å²	40.8	6%	0.055	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.8	138.6	166.8	-72.7	-79.5	0	0	0	110.7	L438 P439 T590 S601 I604 S608 F611	Y435-L438 HydrophobicContact CD1-CB 4.44Å; Y435-L438 HydrophobicContact CD2-CD2 4.38Å; Y435-L438 HydrophobicContact CE1-CB 4.49Å; Y435-L438 HydrophobicContact CE1-CD2 4.5Å; Y435-L438 HydrophobicContact CE2-CD2 3.85Å; Y435-P439 HydrophobicContact CD1-CG 4.39Å; Y435-P439 HydrophobicContact CE1-CG 4.23Å; Y435-T590 HydrophobicContact CD1-CG2 4.19Å; Y435-T590 HydrophobicContact CE1-CG2 4.48Å; Y435-S601 WeakPolarHBondContact O-CB 3.45Å; Y435-I604 HydrophobicContact CD1-CG2 3.71Å; Y435-I604 HydrophobicContact CD2-CG2 4.48Å; Y435-I604 HydrophobicContact CE1-CG2 4.46Å; Y435-I604 HydrophobicContact CG-CB 4.37Å; Y435-I604 HydrophobicContact CG-CG2 3.72Å; Y435-S608 VanDerWaalsContact OH-CB 3.26Å; Y435-S608 WeakPolarHBondContact OH-CB 3.44Å; Y435-F611 HydrophobicContact CE1-CD2 4.06Å; Y435-F611 HydrophobicContact CE1-CE2 4.41Å
436	P	88.7	Confident	90.4	Very high	20 Å²	20	40.8 Å²	40.8	13%	0.13	20%	0.195	C	C	.	.	T	Hydrogen-bonded Turn	cis	-91.8	10.7	9.5	37.3	-37.7	0	0	0	115.6	P439 A594 I704	P436-P439 WeakPolarHBondContact O-CD 3.24Å; P436-A594 HydrophobicContact CB-CB 4.32Å; P436-A594 HydrophobicContact CG-CB 3.88Å; P436-I704 HydrophobicContact CG-CD1 4.1Å
437	E	88.3	Confident	90.7	Very high	20 Å²	20	38.4 Å²	38.4	9%	0.093	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-30.9	-178.8	-64.3	-172	160.9	0	0	113.5	Q434 P439 L440 L700 I704 W789	Q434-E437 WeakPolarHBondContact O-CA 3.47Å; Q434-E437 WeakPolarHBondContact O-CB 3.09Å; Q434-E437 PolarHBondContact O-N 3.37Å; E437-P439 VanDerWaalsContact O-N 3.16Å; E437-L440 WeakPolarHBondContact O-CB 3.25Å; E437-L440 PolarHBondContact O-N 2.79Å; E437-L700 WeakPolarHBondContact OE1-CD1 3.33Å; E437-L700 WeakPolarHBondContact OE1-CD2 3.43Å; E437-L700 VanDerWaalsContact OE1-CG 3.24Å; E437-L700 WeakPolarHBondContact OE1-CG 3.44Å; E437-I704 HydrophobicContact CG-CD1 3.58Å; E437-I704 HydrophobicContact CG-CG1 4.24Å; E437-W789 HydrophobicContact CB-CH2 3.95Å; E437-W789 HydrophobicContact CB-CZ2 4.37Å; E437-W789 HydrophobicContact CG-CH2 3.94Å; E437-W789 HydrophobicContact CG-CZ2 3.94Å; E437-W789 WeakPolarHBondContact OE1-CZ2 3.45Å; E437-W789 WeakPolarHBondContact OE2-CH2 3.4Å
438	L	91.2	Very high	91	Very high	21 Å²	21	35.8 Å²	35.8	11%	0.11	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-50.4	-38.9	-172.9	-173.9	62.7	0	0	0	116	F426 Q434 Y435 L440 I441 Y442	F426-L438 HydrophobicContact CE2-CD1 3.64Å; F426-L438 HydrophobicContact CZ-CD1 4.01Å; Q434-L438 PolarHBondContact O-N 3.35Å; Y435-L438 HydrophobicContact CD1-CB 4.44Å; Y435-L438 HydrophobicContact CD2-CD2 4.38Å; Y435-L438 HydrophobicContact CE1-CB 4.49Å; Y435-L438 HydrophobicContact CE1-CD2 4.5Å; Y435-L438 HydrophobicContact CE2-CD2 3.85Å; L438-L440 PolarHBondContact O-N 3.46Å; L438-L440 VanDerWaalsContact O-N 3.13Å; L438-I441 HydrophobicContact CD1-CG1 4.46Å; L438-I441 WeakPolarHBondContact O-CB 3.17Å; L438-I441 PolarHBondContact O-N 2.79Å; L438-Y442 HydrophobicContact CD1-CE2 4.23Å; L438-Y442 HydrophobicContact CD2-CE2 4Å; L438-Y442 HydrophobicContact CG-CD2 4.42Å; L438-Y442 HydrophobicContact CG-CE2 3.7Å
439	P	93.6	Very high	91.4	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-56.2	-27.5	176.2	-27.8	37.5	0	0	0	114.9	Y435 P436 E437 I441 Y442 L443 W583 I586 L587	Y435-P439 HydrophobicContact CD1-CG 4.39Å; Y435-P439 HydrophobicContact CE1-CG 4.23Å; P436-P439 WeakPolarHBondContact O-CD 3.24Å; E437-P439 VanDerWaalsContact O-N 3.16Å; P439-I441 VanDerWaalsContact C-N 3.27Å; P439-I441 PolarHBondContact O-N 3.33Å; P439-Y442 PolarHBondContact O-N 3.5Å; P439-L443 WeakPolarHBondContact O-CB 3.43Å; P439-L443 PolarHBondContact O-N 2.88Å; P439-W583 HydrophobicContact CB-CE3 4.09Å; P439-I586 HydrophobicContact CB-CG2 4.39Å; P439-I586 HydrophobicContact CG-CG2 4.01Å; P439-L587 HydrophobicContact CB-CB 4.02Å; P439-L587 HydrophobicContact CB-CD1 4.16Å
440	L	91.1	Very high	91.9	Very high	1 Å²	1	33.7 Å²	33.7	1%	0.005	16%	0.158	C	C	.	.	H	α-helix	trans	-68.2	-27	177.7	-168.6	154.1	0	0	0	112.2	E437 L438 L443 S444 Y707 W789	E437-L440 WeakPolarHBondContact O-CB 3.25Å; E437-L440 PolarHBondContact O-N 2.79Å; L438-L440 PolarHBondContact O-N 3.46Å; L438-L440 VanDerWaalsContact O-N 3.13Å; L440-L443 WeakPolarHBondContact O-CB 3.39Å; L440-S444 PolarHBondContact O-N 2.88Å; L440-S444 VanDerWaalsContact O-N 3.1Å; L440-S444 PolarHBondContact O-OG 3.24Å; L440-Y707 HydrophobicContact CD1-CD1 3.58Å; L440-Y707 HydrophobicContact CD1-CD2 4.37Å; L440-Y707 HydrophobicContact CD1-CE1 3.46Å; L440-Y707 VanDerWaalsContact CD1-CE1 3.46Å; L440-Y707 HydrophobicContact CD1-CE2 4.23Å; L440-Y707 HydrophobicContact CD1-CG 4.08Å; L440-Y707 HydrophobicContact CG-CE1 3.99Å; L440-W789 HydrophobicContact CD1-CB 4.35Å; L440-W789 HydrophobicContact CD1-CD2 3.54Å; L440-W789 HydrophobicContact CD1-CE3 3.69Å; L440-W789 HydrophobicContact CD1-CG 3.8Å; L440-W789 HydrophobicContact CD1-CZ2 4.5Å; L440-W789 HydrophobicContact CD1-CZ3 4.26Å; L440-W789 HydrophobicContact CD2-CD2 4.15Å; L440-W789 HydrophobicContact CD2-CE3 3.47Å; L440-W789 VanDerWaalsContact CD2-CE3 3.47Å; L440-W789 HydrophobicContact CD2-CZ3 3.93Å; L440-W789 HydrophobicContact CG-CE3 4.22Å
441	I	92.7	Very high	92.4	Very high	6 Å²	6	30.6 Å²	30.6	3%	0.031	14%	0.136	C	C	.	.	H	α-helix	trans	-71.6	-45.6	173.7	-52.3	-54.2	0	0	0	110.3	T422 F426 F433 L438 P439 L443 S444 L445 I790	T422-I441 HydrophobicContact CG2-CD1 4.07Å; F426-I441 HydrophobicContact CB-CD1 4.2Å; F426-I441 HydrophobicContact CB-CG1 4.4Å; F426-I441 HydrophobicContact CB-CG2 3.85Å; F426-I441 HydrophobicContact CD1-CG2 3.86Å; F426-I441 HydrophobicContact CD2-CB 4.46Å; F426-I441 HydrophobicContact CD2-CD1 4.46Å; F426-I441 HydrophobicContact CD2-CG1 3.91Å; F426-I441 HydrophobicContact CD2-CG2 3.99Å; F426-I441 HydrophobicContact CE1-CG2 4.42Å; F426-I441 HydrophobicContact CG-CG1 4.27Å; F426-I441 HydrophobicContact CG-CG2 3.62Å; F433-I441 HydrophobicContact CB-CG1 4.45Å; F433-I441 HydrophobicContact CD1-CD1 4.11Å; F433-I441 HydrophobicContact CE1-CD1 4.35Å; F433-I441 HydrophobicContact CG-CD1 4.35Å; L438-I441 HydrophobicContact CD1-CG1 4.46Å; L438-I441 WeakPolarHBondContact O-CB 3.17Å; L438-I441 PolarHBondContact O-N 2.79Å; P439-I441 VanDerWaalsContact C-N 3.27Å; P439-I441 PolarHBondContact O-N 3.33Å; I441-L443 VanDerWaalsContact C-N 3.34Å; I441-L443 PolarHBondContact O-N 2.96Å; I441-S444 WeakPolarHBondContact O-CB 3.47Å; I441-S444 PolarHBondContact O-N 3.38Å; I441-S444 VanDerWaalsContact O-N 3.13Å; I441-L445 PolarHBondContact O-N 3.02Å; I441-I790 HydrophobicContact CD1-CD1 3.96Å
442	Y	94.9	Very high	93	Very high	49 Å²	49	26 Å²	26	19%	0.192	12%	0.122	C	C	.	.	H	α-helix	trans	-66.6	-35.9	176	-59.9	-52	0	0	0	112.6	L438 P439 S444 L445 C446 W583 H612	L438-Y442 HydrophobicContact CD1-CE2 4.23Å; L438-Y442 HydrophobicContact CD2-CE2 4Å; L438-Y442 HydrophobicContact CG-CD2 4.42Å; L438-Y442 HydrophobicContact CG-CE2 3.7Å; P439-Y442 PolarHBondContact O-N 3.5Å; Y442-S444 VanDerWaalsContact C-N 3.29Å; Y442-S444 PolarHBondContact O-N 3.23Å; Y442-L445 WeakPolarHBondContact O-CB 3.46Å; Y442-L445 PolarHBondContact O-N 3.43Å; Y442-C446 PolarHBondContact O-N 3.26Å; Y442-C446 PolarHBondContact O-SG 3.5Å; Y442-C446 VanDerWaalsContact O-SG 3.33Å; Y442-W583 HydrophobicContact CD2-CD2 4.32Å; Y442-W583 HydrophobicContact CD2-CE3 4.01Å; Y442-W583 AromaticContact CD2-CH2 3.49Å; Y442-W583 HydrophobicContact CD2-CH2 3.49Å; Y442-W583 VanDerWaalsContact CD2-CH2 3.49Å; Y442-W583 AromaticContact CD2-CZ2 3.8Å; Y442-W583 HydrophobicContact CD2-CZ2 3.8Å; Y442-W583 AromaticContact CD2-CZ3 3.59Å; Y442-W583 HydrophobicContact CD2-CZ3 3.59Å; Y442-W583 AromaticContact CE2-CH2 3.98Å; Y442-W583 HydrophobicContact CE2-CH2 3.98Å; Y442-W583 HydrophobicContact CE2-CZ2 4.48Å; Y442-W583 HydrophobicContact CE2-CZ3 4.28Å; Y442-W583 HydrophobicContact CG-CD2 4.35Å; Y442-W583 HydrophobicContact CG-CE3 4.48Å; Y442-W583 HydrophobicContact CG-CH2 4.13Å; Y442-W583 AromaticContact CG-CZ2 3.95Å; Y442-W583 HydrophobicContact CG-CZ2 3.95Å; Y442-W583 HydrophobicContact CG-CZ3 4.38Å; Y442-H612 AromaticContact CD2-CE1 3.93Å; Y442-H612 AromaticContact CE1-CE1 3.89Å; Y442-H612 AromaticContact CE2-CE1 3.32Å; Y442-H612 WeakPolarHBondContact CE2-CE1 3.47Å; Y442-H612 AromaticContact CE2-NE2 3.46Å; Y442-H612 WeakPolarHBondContact CE2-NE2 3.23Å; Y442-H612 AromaticContact CZ-CE1 3.31Å; Y442-H612 AromaticContact CZ-NE2 3.54Å; Y442-H612 PolarHBondContact OH-CE1 2.87Å; Y442-H612 PolarHBondContact OH-NE2 3.16Å
443	L	94.1	Very high	93.6	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-55	-46.2	168.8	-166.8	78	0	0	0	111.3	P439 L440 I441 C446 Y447 A580 W583 W584 Y707 Y711	P439-L443 WeakPolarHBondContact O-CB 3.43Å; P439-L443 PolarHBondContact O-N 2.88Å; L440-L443 WeakPolarHBondContact O-CB 3.39Å; I441-L443 VanDerWaalsContact C-N 3.34Å; I441-L443 PolarHBondContact O-N 2.96Å; L443-C446 WeakPolarHBondContact O-CB 3.22Å; L443-C446 PolarHBondContact O-N 3.13Å; L443-Y447 HydrophobicContact CD1-CE2 4.21Å; L443-Y447 HydrophobicContact CG-CD2 4.21Å; L443-Y447 HydrophobicContact CG-CE2 4.13Å; L443-Y447 VanDerWaalsContact O-CD2 3.27Å; L443-Y447 WeakPolarHBondContact O-CD2 3.41Å; L443-Y447 PolarHBondContact O-N 2.93Å; L443-A580 HydrophobicContact CD1-CB 4.13Å; L443-A580 VanDerWaalsContact CD1-O 3.24Å; L443-A580 WeakPolarHBondContact CD1-O 3.33Å; L443-W583 HydrophobicContact CD1-CB 4.2Å; L443-W584 HydrophobicContact CD1-CB 4.16Å; L443-Y707 HydrophobicContact CD2-CE1 4.34Å; L443-Y711 HydrophobicContact CD1-CE2 3.68Å; L443-Y711 HydrophobicContact CD2-CD2 3.97Å; L443-Y711 HydrophobicContact CD2-CE2 3.73Å; L443-Y711 HydrophobicContact CG-CE2 4.1Å
444	S	94.4	Very high	94.2	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-70.3	-32.9	179.7	-55.7	0	0	0	0	112.6	T419 T422 L440 I441 Y442 Y447 F448 S786	T419-S444 WeakPolarHBondContact CB-O 3.5Å; T419-S444 WeakPolarHBondContact CG2-O 3.42Å; T422-S444 VanDerWaalsContact CG2-CB 3.47Å; T422-S444 WeakPolarHBondContact CG2-OG 3.49Å; L440-S444 PolarHBondContact O-N 2.88Å; L440-S444 VanDerWaalsContact O-N 3.1Å; L440-S444 PolarHBondContact O-OG 3.24Å; I441-S444 WeakPolarHBondContact O-CB 3.47Å; I441-S444 PolarHBondContact O-N 3.38Å; I441-S444 VanDerWaalsContact O-N 3.13Å; Y442-S444 VanDerWaalsContact C-N 3.29Å; Y442-S444 PolarHBondContact O-N 3.23Å; S444-Y447 PolarHBondContact O-N 2.91Å; S444-F448 WeakPolarHBondContact O-CB 3.48Å; S444-F448 PolarHBondContact O-N 3.33Å; S444-S786 VanDerWaalsContact OG-CB 3.32Å; S444-S786 WeakPolarHBondContact OG-CB 3.41Å; S444-S786 PolarHBondContact OG-OG 2.82Å
445	L	95.6	Very high	94.7	Very high	66 Å²	66	20 Å²	20	35%	0.346	10%	0.097	S	C	.	.	H	α-helix	trans	-61	-43.8	169.5	-174.4	72.5	0	0	0	111.4	I423 I441 Y442 F448 M449	I423-L445 HydrophobicContact CD1-CD1 4.18Å; I441-L445 PolarHBondContact O-N 3.02Å; Y442-L445 WeakPolarHBondContact O-CB 3.46Å; Y442-L445 PolarHBondContact O-N 3.43Å; L445-F448 PolarHBondContact O-N 3.5Å; L445-M449 WeakPolarHBondContact O-CG 3.06Å; L445-M449 PolarHBondContact O-N 3.31Å
446	C	97.4	Very high	95	Very high	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-47.4	174.6	-65	0	0	0	0	111.6	Y442 L443 F448 M449 I450 F576 A580	Y442-C446 PolarHBondContact O-N 3.26Å; Y442-C446 PolarHBondContact O-SG 3.5Å; Y442-C446 VanDerWaalsContact O-SG 3.33Å; L443-C446 WeakPolarHBondContact O-CB 3.22Å; L443-C446 PolarHBondContact O-N 3.13Å; C446-F448 VanDerWaalsContact C-N 3.33Å; C446-F448 PolarHBondContact O-N 3.44Å; C446-M449 PolarHBondContact O-N 3.09Å; C446-M449 VanDerWaalsContact O-N 3.16Å; C446-I450 WeakPolarHBondContact O-CG1 3.4Å; C446-I450 PolarHBondContact O-N 2.79Å; C446-F576 HydrophobicContact CB-CB 4.3Å; C446-F576 HydrophobicContact CB-CD1 4.39Å; C446-A580 HydrophobicContact CB-CB 3.84Å
447	Y	96.7	Very high	95.2	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-66.7	-30.6	179.2	-80.3	-71	0	0	0	114	L443 S444 I450 S451 A580 Y711 T779 I782	L443-Y447 HydrophobicContact CD1-CE2 4.21Å; L443-Y447 HydrophobicContact CG-CD2 4.21Å; L443-Y447 HydrophobicContact CG-CE2 4.13Å; L443-Y447 VanDerWaalsContact O-CD2 3.27Å; L443-Y447 WeakPolarHBondContact O-CD2 3.41Å; L443-Y447 PolarHBondContact O-N 2.93Å; S444-Y447 PolarHBondContact O-N 2.91Å; Y447-I450 HydrophobicContact CD1-CD1 3.79Å; Y447-I450 HydrophobicContact CE1-CD1 3.76Å; Y447-I450 HydrophobicContact CG-CD1 4.4Å; Y447-S451 VanDerWaalsContact O-CB 3.31Å; Y447-S451 WeakPolarHBondContact O-CB 3.35Å; Y447-S451 PolarHBondContact O-N 3.46Å; Y447-A580 HydrophobicContact CD2-CB 4.46Å; Y447-A580 HydrophobicContact CE2-CB 3.74Å; Y447-Y711 HydrophobicContact CE2-CE2 4.12Å; Y447-Y711 PolarHBondContact OH-OH 2.93Å; Y447-T779 VanDerWaalsContact CE1-O 3.25Å; Y447-T779 WeakPolarHBondContact CE1-O 3.43Å; Y447-I782 HydrophobicContact CD2-CG2 4.04Å; Y447-I782 HydrophobicContact CE1-CB 3.94Å; Y447-I782 HydrophobicContact CE1-CD1 4.34Å; Y447-I782 HydrophobicContact CE1-CG2 4.15Å; Y447-I782 HydrophobicContact CE2-CB 4.06Å; Y447-I782 HydrophobicContact CE2-CG2 3.35Å; Y447-I782 VanDerWaalsContact CZ-CG2 3.44Å; Y447-I782 WeakPolarHBondContact OH-CD1 3.19Å
448	F	97.4	Very high	95.5	Very high	57 Å²	57	21.2 Å²	21.2	25%	0.25	11%	0.105	C	C	.	.	H	α-helix	trans	-59.8	-46.7	169.6	-179.6	-99.9	0	0	0	111.6	T419 L420 I423 S444 L445 C446 S451 M452	T419-F448 WeakPolarHBondContact OG1-CA 3.27Å; T419-F448 WeakPolarHBondContact OG1-CB 3.35Å; L420-F448 HydrophobicContact CB-CD2 4.22Å; L420-F448 HydrophobicContact CB-CE2 4.09Å; L420-F448 HydrophobicContact CD1-CE2 4.07Å; L420-F448 HydrophobicContact CD1-CZ 4.45Å; L420-F448 HydrophobicContact CD2-CE2 4.45Å; L420-F448 HydrophobicContact CG-CE2 4.43Å; I423-F448 HydrophobicContact CD1-CB 3.88Å; I423-F448 HydrophobicContact CD1-CG 4.11Å; S444-F448 WeakPolarHBondContact O-CB 3.48Å; S444-F448 PolarHBondContact O-N 3.33Å; L445-F448 PolarHBondContact O-N 3.5Å; C446-F448 VanDerWaalsContact C-N 3.33Å; C446-F448 PolarHBondContact O-N 3.44Å; F448-S451 PolarHBondContact O-N 2.94Å; F448-M452 PolarHBondContact O-N 2.87Å
449	M	98	Very high	95.6	Very high	56 Å²	56	28.1 Å²	28.1	28%	0.276	13%	0.134	S	C	.	.	H	α-helix	trans	-68.7	-40.6	179.8	-63.7	-62.7	-76.7	0	0	112.7	L445 C446 S451 M452 G453 L572 F576	L445-M449 WeakPolarHBondContact O-CG 3.06Å; L445-M449 PolarHBondContact O-N 3.31Å; C446-M449 PolarHBondContact O-N 3.09Å; C446-M449 VanDerWaalsContact O-N 3.16Å; M449-S451 VanDerWaalsContact C-N 3.31Å; M449-S451 PolarHBondContact O-N 2.93Å; M449-M452 WeakPolarHBondContact O-CB 3.03Å; M449-M452 PolarHBondContact O-N 3.25Å; M449-G453 PolarHBondContact O-N 3.37Å; M449-G453 VanDerWaalsContact O-N 3.12Å; M449-L572 HydrophobicContact CB-CD2 4.38Å; M449-L572 HydrophobicContact CE-CD2 3.62Å; M449-F576 HydrophobicContact CB-CB 4.35Å; M449-F576 HydrophobicContact CB-CD1 3.78Å; M449-F576 HydrophobicContact CB-CD2 3.68Å; M449-F576 HydrophobicContact CB-CE1 3.91Å; M449-F576 HydrophobicContact CB-CE2 3.82Å; M449-F576 HydrophobicContact CB-CG 3.65Å; M449-F576 HydrophobicContact CB-CZ 3.93Å; M449-F576 HydrophobicContact CE-CE2 3.94Å; M449-F576 HydrophobicContact CE-CZ 3.73Å; M449-F576 HydrophobicContact CG-CD1 4.05Å; M449-F576 HydrophobicContact CG-CD2 4.48Å; M449-F576 HydrophobicContact CG-CE1 3.74Å; M449-F576 HydrophobicContact CG-CE2 4.2Å; M449-F576 HydrophobicContact CG-CG 4.41Å; M449-F576 HydrophobicContact CG-CZ 3.82Å
450	I	97.8	Very high	95.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-56.7	-48.6	171	-65.6	165.1	0	0	0	109.5	C446 Y447 M452 G453 Y454 L572 F576 N577	C446-I450 WeakPolarHBondContact O-CG1 3.4Å; C446-I450 PolarHBondContact O-N 2.79Å; Y447-I450 HydrophobicContact CD1-CD1 3.79Å; Y447-I450 HydrophobicContact CE1-CD1 3.76Å; Y447-I450 HydrophobicContact CG-CD1 4.4Å; I450-M452 VanDerWaalsContact C-N 3.29Å; I450-M452 PolarHBondContact O-N 3.15Å; I450-G453 WeakPolarHBondContact O-CA 3.39Å; I450-G453 PolarHBondContact O-N 3.1Å; I450-Y454 HydrophobicContact CG2-CD2 4.09Å; I450-Y454 HydrophobicContact CG2-CE2 3.82Å; I450-Y454 WeakPolarHBondContact O-CD2 3.19Å; I450-Y454 PolarHBondContact O-N 3.34Å; I450-L572 WeakPolarHBondContact CA-O 3.47Å; I450-F576 HydrophobicContact CD1-CB 4.3Å; I450-F576 HydrophobicContact CG1-CB 3.72Å; I450-N577 HydrophobicContact CD1-CB 3.98Å
451	S	97.8	Very high	95.5	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-62.1	-36.9	-179.8	-145.6	0	0	0	0	112.5	S412 C415 Y447 F448 M449 G453 Y454 L455	S412-S451 VanDerWaalsContact C-OG 3.32Å; S412-S451 WeakPolarHBondContact CA-OG 3.49Å; S412-S451 WeakPolarHBondContact CB-OG 3.44Å; S412-S451 PolarHBondContact O-OG 3.08Å; C415-S451 WeakPolarHBondContact CB-OG 3.41Å; Y447-S451 VanDerWaalsContact O-CB 3.31Å; Y447-S451 WeakPolarHBondContact O-CB 3.35Å; Y447-S451 PolarHBondContact O-N 3.46Å; F448-S451 PolarHBondContact O-N 2.94Å; M449-S451 VanDerWaalsContact C-N 3.31Å; M449-S451 PolarHBondContact O-N 2.93Å; S451-G453 VanDerWaalsContact C-N 3.29Å; S451-G453 PolarHBondContact O-N 2.93Å; S451-Y454 PolarHBondContact O-N 3.02Å; S451-L455 WeakPolarHBondContact O-CG 3.36Å; S451-L455 PolarHBondContact O-N 3.13Å
452	M	97.4	Very high	95.4	Very high	83 Å²	83	34.4 Å²	34.4	41%	0.409	17%	0.171	S	C	.	.	H	α-helix	trans	-62	-36.3	173.1	-164.7	64.6	174.4	0	0	112.1	F448 M449 I450 L455 I456	F448-M452 PolarHBondContact O-N 2.87Å; M449-M452 WeakPolarHBondContact O-CB 3.03Å; M449-M452 PolarHBondContact O-N 3.25Å; I450-M452 VanDerWaalsContact C-N 3.29Å; I450-M452 PolarHBondContact O-N 3.15Å; M452-L455 PolarHBondContact O-N 2.89Å; M452-L455 HydrophobicContact SD-CD1 4.45Å; M452-I456 HydrophobicContact CG-CD1 4.11Å; M452-I456 WeakPolarHBondContact O-CB 3.27Å; M452-I456 WeakPolarHBondContact O-CD1 3.3Å; M452-I456 VanDerWaalsContact O-CG1 3.27Å; M452-I456 WeakPolarHBondContact O-CG1 3.25Å; M452-I456 PolarHBondContact O-N 3.26Å
453	G	96.4	Very high	95.1	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-43.9	172.6	0	0	0	0	0	113.2	M449 I450 S451 R457	M449-G453 PolarHBondContact O-N 3.37Å; M449-G453 VanDerWaalsContact O-N 3.12Å; I450-G453 WeakPolarHBondContact O-CA 3.39Å; I450-G453 PolarHBondContact O-N 3.1Å; S451-G453 VanDerWaalsContact C-N 3.29Å; S451-G453 PolarHBondContact O-N 2.93Å; G453-R457 PolarHBondContact O-N 3.11Å
454	Y	97.6	Very high	94.7	Very high	7 Å²	7	35.9 Å²	35.9	3%	0.027	18%	0.183	C	C	.	.	H	α-helix	trans	-63.8	-44.4	172.8	-78.4	-91	0	0	0	112	L408 I450 S451 I456 R457 V458 I573 L640 H776 L780	L408-Y454 HydrophobicContact CB-CD1 4.34Å; L408-Y454 HydrophobicContact CD1-CD1 4.2Å; L408-Y454 HydrophobicContact CD1-CE1 4.34Å; L408-Y454 HydrophobicContact CD2-CD1 4.1Å; L408-Y454 HydrophobicContact CD2-CE1 3.93Å; L408-Y454 HydrophobicContact CG-CD1 4.44Å; I450-Y454 HydrophobicContact CG2-CD2 4.09Å; I450-Y454 HydrophobicContact CG2-CE2 3.82Å; I450-Y454 WeakPolarHBondContact O-CD2 3.19Å; I450-Y454 PolarHBondContact O-N 3.34Å; S451-Y454 PolarHBondContact O-N 3.02Å; Y454-I456 PolarHBondContact O-N 3.07Å; Y454-R457 PolarHBondContact O-N 2.95Å; Y454-V458 PolarHBondContact O-N 2.86Å; Y454-I573 HydrophobicContact CD2-CD1 4.06Å; Y454-I573 HydrophobicContact CD2-CG1 4.44Å; Y454-I573 HydrophobicContact CE2-CD1 4.03Å; Y454-I573 HydrophobicContact CE2-CG1 4.4Å; Y454-L640 HydrophobicContact CD1-CD1 3.96Å; Y454-L640 HydrophobicContact CD1-CD2 4.34Å; Y454-L640 HydrophobicContact CE1-CD1 3.49Å; Y454-L640 VanDerWaalsContact CE1-CD1 3.49Å; Y454-H776 HydrophobicContact CE1-CB 4.05Å; Y454-H776 AromaticContact CE1-ND1 3.58Å; Y454-H776 AromaticContact CZ-ND1 3.7Å; Y454-H776 PolarHBondContact OH-ND1 3.46Å; Y454-L780 HydrophobicContact CD1-CD1 4.27Å; Y454-L780 HydrophobicContact CD2-CD1 4.38Å; Y454-L780 HydrophobicContact CD2-CD2 3.85Å; Y454-L780 HydrophobicContact CD2-CG 4.39Å; Y454-L780 HydrophobicContact CE1-CD1 4.36Å; Y454-L780 HydrophobicContact CE2-CD1 4.49Å; Y454-L780 HydrophobicContact CE2-CD2 4.06Å; Y454-L780 HydrophobicContact CE2-CG 4.28Å; Y454-L780 HydrophobicContact CG-CD1 4.28Å; Y454-L780 HydrophobicContact CG-CD2 4.42Å
455	L	97.2	Very high	94.6	Very high	20 Å²	20	35.9 Å²	35.9	11%	0.105	18%	0.183	C	C	.	.	H	α-helix	trans	-61.7	-40.8	178.3	-73.2	171.2	0	0	0	112.2	S412 I413 A416 S451 M452 R457 V458 F459	S412-L455 WeakPolarHBondContact OG-CD2 3.5Å; I413-L455 HydrophobicContact CG1-CD2 3.87Å; A416-L455 HydrophobicContact CB-CD1 4.18Å; S451-L455 WeakPolarHBondContact O-CG 3.36Å; S451-L455 PolarHBondContact O-N 3.13Å; M452-L455 PolarHBondContact O-N 2.89Å; M452-L455 HydrophobicContact SD-CD1 4.45Å; L455-R457 VanDerWaalsContact C-N 3.3Å; L455-R457 PolarHBondContact O-N 3.02Å; L455-V458 CarbonylContact O-C 3.47Å; L455-V458 WeakPolarHBondContact O-CA 3.39Å; L455-V458 WeakPolarHBondContact O-CB 3.3Å; L455-V458 PolarHBondContact O-N 2.89Å; L455-F459 HydrophobicContact CB-CD2 4.23Å; L455-F459 HydrophobicContact CB-CE2 4.07Å; L455-F459 HydrophobicContact CD2-CE2 4.35Å; L455-F459 WeakPolarHBondContact O-CD2 3.26Å; L455-F459 PolarHBondContact O-N 3.31Å
456	I	95.8	Very high	94.3	Very high	34 Å²	34	32.8 Å²	32.8	17%	0.174	17%	0.167	C	C	.	.	H	α-helix	trans	-60.4	-40	175.9	-73.7	163.8	0	0	0	111.1	M452 Y454 V458 F459 M460 I465 V569 L572	M452-I456 HydrophobicContact CG-CD1 4.11Å; M452-I456 WeakPolarHBondContact O-CB 3.27Å; M452-I456 WeakPolarHBondContact O-CD1 3.3Å; M452-I456 VanDerWaalsContact O-CG1 3.27Å; M452-I456 WeakPolarHBondContact O-CG1 3.25Å; M452-I456 PolarHBondContact O-N 3.26Å; Y454-I456 PolarHBondContact O-N 3.07Å; I456-V458 VanDerWaalsContact C-N 3.32Å; I456-V458 PolarHBondContact O-N 2.87Å; I456-F459 PolarHBondContact O-N 2.87Å; I456-M460 HydrophobicContact CG2-CG 4.19Å; I456-M460 HydrophobicContact CG2-SD 3.72Å; I456-M460 WeakPolarHBondContact O-CB 3.41Å; I456-M460 WeakPolarHBondContact O-CG 3.4Å; I456-M460 PolarHBondContact O-N 3.32Å; I456-I465 HydrophobicContact CG2-CD1 3.89Å; I456-V569 HydrophobicContact CB-CG2 4.28Å; I456-V569 HydrophobicContact CG2-CG2 3.74Å; I456-L572 HydrophobicContact CD1-CD1 3.47Å; I456-L572 VanDerWaalsContact CD1-CD1 3.47Å
457	R	94.2	Very high	93.9	Very high	4 Å²	4	33 Å²	33	2%	0.015	17%	0.169	C	C	.	.	H	α-helix	trans	-66.8	-28.4	172.5	172.1	-86	115.5	128.3	-6.2	113.5	T405 G453 Y454 L455 G461 I465 S638 G639 L640	T405-R457 PolarHBondContact OG1-NH2 3.48Å; G453-R457 PolarHBondContact O-N 3.11Å; Y454-R457 PolarHBondContact O-N 2.95Å; L455-R457 VanDerWaalsContact C-N 3.3Å; L455-R457 PolarHBondContact O-N 3.02Å; R457-G461 CarbonylContact O-C 3.55Å; R457-G461 WeakPolarHBondContact O-CA 3.24Å; R457-G461 PolarHBondContact O-N 3.38Å; R457-I465 HydrophobicContact CB-CD1 4.11Å; R457-S638 VanDerWaalsContact CD-O 3.25Å; R457-S638 WeakPolarHBondContact CD-O 3.23Å; R457-S638 PolarHBondContact NH1-O 2.92Å; R457-G639 VanDerWaalsContact CG-O 3.27Å; R457-G639 WeakPolarHBondContact CG-O 3.33Å; R457-L640 HydrophobicContact CB-CD2 3.52Å; R457-L640 HydrophobicContact CG-CD2 3.55Å; R457-L640 HydrophobicContact CG-CG 4.22Å
458	V	94.8	Very high	93.1	Very high	42 Å²	42	34.8 Å²	34.8	26%	0.255	18%	0.178	S	C	.	.	H	α-helix	trans	-74.8	-45.8	172.4	174.5	0	0	0	0	110.9	T405 Y454 L455 I456	T405-V458 HydrophobicContact CG2-CG1 4.37Å; Y454-V458 PolarHBondContact O-N 2.86Å; L455-V458 CarbonylContact O-C 3.47Å; L455-V458 WeakPolarHBondContact O-CA 3.39Å; L455-V458 WeakPolarHBondContact O-CB 3.3Å; L455-V458 PolarHBondContact O-N 2.89Å; I456-V458 VanDerWaalsContact C-N 3.32Å; I456-V458 PolarHBondContact O-N 2.87Å
459	F	93.6	Very high	91.7	Very high	166 Å²	166	35.2 Å²	35.2	73%	0.728	19%	0.188	S	C	*	.	H	α-helix	trans	-73.1	-42.8	-177.6	-71.3	-59.1	0	0	0	114.4	L455 I456 G461	L455-F459 HydrophobicContact CB-CD2 4.23Å; L455-F459 HydrophobicContact CB-CE2 4.07Å; L455-F459 HydrophobicContact CD2-CE2 4.35Å; L455-F459 WeakPolarHBondContact O-CD2 3.26Å; L455-F459 PolarHBondContact O-N 3.31Å; I456-F459 PolarHBondContact O-N 2.87Å; F459-G461 VanDerWaalsContact C-N 3.34Å
460	M	91.9	Very high	90	Very high	104 Å²	104	33.1 Å²	33.1	51%	0.512	18%	0.178	S	C	.	.	S	Bend	trans	-82.7	-14.9	177.8	-56.2	-173.8	76.3	0	0	112.7	I456 A464 I465	I456-M460 HydrophobicContact CG2-CG 4.19Å; I456-M460 HydrophobicContact CG2-SD 3.72Å; I456-M460 WeakPolarHBondContact O-CB 3.41Å; I456-M460 WeakPolarHBondContact O-CG 3.4Å; I456-M460 PolarHBondContact O-N 3.32Å; M460-A464 HydrophobicContact CB-CB 3.97Å; M460-A464 VanDerWaalsContact O-CB 3.23Å; M460-A464 WeakPolarHBondContact O-CB 3.43Å; M460-I465 HydrophobicContact CB-CD1 4.14Å; M460-I465 HydrophobicContact CB-CG1 4.26Å; M460-I465 HydrophobicContact SD-CD1 4.23Å
461	G	90.1	Very high	87.9	Confident	24 Å²	24	35.1 Å²	35.1	25%	0.247	19%	0.191	C	C	.	.			trans	74.6	161.4	-176	0	0	0	0	0	114.3	R457 F459 Q463 A464	R457-G461 CarbonylContact O-C 3.55Å; R457-G461 WeakPolarHBondContact O-CA 3.24Å; R457-G461 PolarHBondContact O-N 3.38Å; F459-G461 VanDerWaalsContact C-N 3.34Å; G461-Q463 VanDerWaalsContact C-N 3.3Å; G461-Q463 PolarHBondContact O-N 3.37Å; G461-A464 PolarHBondContact O-N 2.9Å
462	H	90.5	Very high	85.5	Confident	10 Å²	10	40.6 Å²	40.6	5%	0.046	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-51.3	-45.7	-178	-169.8	110.9	0	0	0	112.7	C390 Y391 A464 I465 A466 G639	C390-H462 PolarHBondContact O-NE2 3.4Å; Y391-H462 AromaticContact CD1-CD2 3.98Å; Y391-H462 AromaticContact CD1-NE2 3.81Å; Y391-H462 HydrophobicContact CE1-CB 4.17Å; Y391-H462 AromaticContact CE1-CD2 3.63Å; Y391-H462 AromaticContact CE1-CG 3.77Å; Y391-H462 AromaticContact CE1-NE2 3.95Å; H462-A464 VanDerWaalsContact C-N 3.33Å; H462-A464 PolarHBondContact O-N 2.73Å; H462-I465 PolarHBondContact O-N 3.22Å; H462-A466 PolarHBondContact O-N 3.29Å; H462-G639 VanDerWaalsContact CE1-CA 3.47Å; H462-G639 WeakPolarHBondContact CE1-CA 3.42Å; H462-G639 WeakPolarHBondContact ND1-CA 3.24Å; H462-G639 PolarHBondContact ND1-N 2.92Å
463	Q	87.4	Confident	83.1	Confident	59 Å²	59	43.2 Å²	43.2	28%	0.276	23%	0.231	S	C	.	.	G	3₁₀ helix	trans	-72.4	-20.7	-171.5	-55.1	-170.3	15	0	0	114.9	Y391 G461 I465 C467	Y391-Q463 HydrophobicContact CE2-CG 3.99Å; Y391-Q463 WeakPolarHBondContact OH-CG 3.3Å; Y391-Q463 PolarHBondContact OH-NE2 3.46Å; G461-Q463 VanDerWaalsContact C-N 3.3Å; G461-Q463 PolarHBondContact O-N 3.37Å; Q463-I465 VanDerWaalsContact C-N 3.31Å; Q463-C467 VanDerWaalsContact CA-SG 3.57Å
464	A	87.2	Confident	80.7	Confident	22 Å²	22	48.5 Å²	48.5	18%	0.182	25%	0.252	C	S	.	.	G	3₁₀ helix	trans	-84.4	-8.3	179.5	0	0	0	0	0	113.2	M460 G461 H462 S565	M460-A464 HydrophobicContact CB-CB 3.97Å; M460-A464 VanDerWaalsContact O-CB 3.23Å; M460-A464 WeakPolarHBondContact O-CB 3.43Å; G461-A464 PolarHBondContact O-N 2.9Å; H462-A464 VanDerWaalsContact C-N 3.33Å; H462-A464 PolarHBondContact O-N 2.73Å; A464-S565 PolarHBondContact O-OG 2.66Å
465	I	91.6	Very high	78.4	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-125	-52.1	-171.9	-49.5	-159	0	0	0	111.6	I456 R457 M460 H462 Q463 R557 C566 V569 C641	I456-I465 HydrophobicContact CG2-CD1 3.89Å; R457-I465 HydrophobicContact CB-CD1 4.11Å; M460-I465 HydrophobicContact CB-CD1 4.14Å; M460-I465 HydrophobicContact CB-CG1 4.26Å; M460-I465 HydrophobicContact SD-CD1 4.23Å; H462-I465 PolarHBondContact O-N 3.22Å; Q463-I465 VanDerWaalsContact C-N 3.31Å; I465-R557 WeakPolarHBondContact O-CD 3.4Å; I465-C566 WeakPolarHBondContact O-CB 3.33Å; I465-V569 HydrophobicContact CD1-CG2 3.62Å; I465-V569 HydrophobicContact CG2-CB 4.09Å; I465-V569 HydrophobicContact CG2-CG1 4.45Å; I465-V569 HydrophobicContact CG2-CG2 3.98Å; I465-C641 PolarHBondContact O-SG 2.7Å
466	A	90.1	Very high	75.9	Confident	0 Å²	0	55.6 Å²	55.6	0%	0	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-14	-173.1	0	0	0	0	0	115.2	H462 R557	H462-A466 PolarHBondContact O-N 3.29Å; A466-R557 WeakPolarHBondContact O-CB 3.24Å; A466-R557 PolarHBondContact O-N 3.27Å
467	C	87.9	Confident	73.5	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.041	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	161	174.3	-57.1	0	0	0	0	112.2	C390 Q463 K554 I555 R557	C390-C467 HydrophobicContact CB-CB 3.83Å; C390-C467 WeakPolarHBondContact CB-SG 3.09Å; C390-C467 WeakPolarHBondContact SG-CA 3.25Å; C390-C467 WeakPolarHBondContact SG-CB 3.42Å; C390-C467 PolarHBondContact SG-N 3.26Å; C390-C467 VanDerWaalsContact SG-N 3.37Å; C390-C467 CovalentContact SG-SG 2.02Å; C390-C467 PolarHBondContact SG-SG 2.74Å; Q463-C467 VanDerWaalsContact CA-SG 3.57Å; C467-K554 HydrophobicContact CB-CB 4.32Å; C467-K554 HydrophobicContact CB-CD 4.36Å; C467-I555 WeakPolarHBondContact CA-O 3.45Å; C467-R557 PolarHBondContact O-NE 3.44Å
468	D	80.7	Confident	71.2	Confident	37 Å²	37	62.6 Å²	62.6	20%	0.198	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	159	144.5	-123.2	-11.7	0	0	0	112	I555 R557	D468-I555 HydrophobicContact CB-CD1 4.27Å; D468-I555 HydrophobicContact CB-CG1 4.05Å; D468-I555 PolarHBondContact N-O 2.83Å; D468-I555 PolarHBondContact O-N 3.08Å; D468-R557 IonicContact OD1-CZ 3.28Å; D468-R557 IonicContact OD1-NH2 3.08Å; D468-R557 PolarHBondContact OD1-NH2 3.31Å; D468-R557 IonicContact OD2-CZ 2.65Å; D468-R557 VanDerWaalsContact OD2-CZ 3.24Å; D468-R557 IonicContact OD2-NE 3.98Å; D468-R557 IonicContact OD2-NH1 3.86Å; D468-R557 IonicContact OD2-NH2 2.8Å; D468-R557 PolarHBondContact OD2-NH2 3.37Å
469	S	68.1	Low	68.8	Low	65 Å²	65	63 Å²	63	46%	0.455	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	143.3	163.4	40.9	0	0	0	0	109.4
470	L	61.3	Low	66.4	Low	12 Å²	12	58.9 Å²	58.9	6%	0.063	31%	0.309	C	S	.	.	P	Polyproline II helix	trans	-59.7	149.2	161.6	-80.4	84.7	0	0	0	109	L370 Y474 S553 I555	L370-L470 HydrophobicContact CD1-CD2 4.32Å; L370-L470 HydrophobicContact CD2-CD2 4.04Å; L370-L470 HydrophobicContact CD2-CG 4.08Å; L470-Y474 HydrophobicContact CD2-CD1 3.83Å; L470-Y474 HydrophobicContact CD2-CD2 3.83Å; L470-Y474 HydrophobicContact CD2-CE1 4.35Å; L470-Y474 HydrophobicContact CD2-CE2 4.36Å; L470-Y474 HydrophobicContact CD2-CG 3.53Å; L470-S553 VanDerWaalsContact CD1-O 3.26Å; L470-S553 WeakPolarHBondContact CD1-O 3.3Å; L470-I555 HydrophobicContact CD1-CG2 3.99Å; L470-I555 HydrophobicContact CG-CG2 4.28Å
471	P	54.8	Low	64	Low	42 Å²	42	59.4 Å²	59.4	27%	0.273	31%	0.313	S	S	.	.	P	Polyproline II helix	trans	-52.5	147.6	173.3	-26.1	34.6	0	0	0	112	L370 Q473 Y474	L370-P471 HydrophobicContact CB-CG 4.25Å; L370-P471 HydrophobicContact CD2-CG 4.29Å; L370-P471 HydrophobicContact CG-CG 4.19Å; P471-Q473 PolarHBondContact O-N 3Å; P471-Y474 PolarHBondContact O-N 3.42Å
472	N	47	Very low	61.6	Low	115 Å²	115	60.7 Å²	60.7	62%	0.615	32%	0.316	S	S	*	.	H	α-helix	trans	-54.3	-19.7	-172.3	-61.4	19.8	0	0	0	114.4	Y474 E475 N476	N472-Y474 VanDerWaalsContact C-N 3.27Å; N472-Y474 PolarHBondContact O-N 3.36Å; N472-E475 PolarHBondContact O-N 2.98Å; N472-N476 WeakPolarHBondContact O-CB 3.44Å; N472-N476 PolarHBondContact O-N 3.32Å; N472-N476 PolarHBondContact O-OD1 2.88Å
473	Q	46.3	Very low	59.4	Low	138 Å²	138	65 Å²	65	65%	0.645	34%	0.336	S	S	*	.	H	α-helix	trans	-58.7	-34.1	171	-77.8	-179.5	-63.6	0	0	113.4	P471 L477	P471-Q473 PolarHBondContact O-N 3Å; Q473-L477 VanDerWaalsContact O-CB 3.24Å; Q473-L477 WeakPolarHBondContact O-CB 3.47Å; Q473-L477 PolarHBondContact O-N 3.39Å
474	Y	47.4	Very low	57.1	Low	111 Å²	111	65.6 Å²	65.6	44%	0.435	34%	0.344	S	S	.	.	H	α-helix	trans	-81.1	-37.8	178.9	-153.3	-84.3	0	0	0	112.1	L470 P471 N472 N476 L477 Q478	L470-Y474 HydrophobicContact CD2-CD1 3.83Å; L470-Y474 HydrophobicContact CD2-CD2 3.83Å; L470-Y474 HydrophobicContact CD2-CE1 4.35Å; L470-Y474 HydrophobicContact CD2-CE2 4.36Å; L470-Y474 HydrophobicContact CD2-CG 3.53Å; P471-Y474 PolarHBondContact O-N 3.42Å; N472-Y474 VanDerWaalsContact C-N 3.27Å; N472-Y474 PolarHBondContact O-N 3.36Å; Y474-N476 VanDerWaalsContact C-N 3.33Å; Y474-L477 PolarHBondContact O-N 3.39Å; Y474-Q478 WeakPolarHBondContact O-CB 3.25Å; Y474-Q478 PolarHBondContact O-N 3.43Å
475	E	47.5	Very low	54.6	Low	90 Å²	90	69.4 Å²	69.4	42%	0.421	37%	0.366	S	S	.	.	H	α-helix	trans	-66.8	-37	172	-172.1	159.3	-151.8	0	0	110.8	N472 N479 K545	N472-E475 PolarHBondContact O-N 2.98Å; E475-N479 VanDerWaalsContact O-CB 3.25Å; E475-N479 WeakPolarHBondContact O-CB 3.3Å; E475-N479 PolarHBondContact O-N 2.81Å; E475-N479 PolarHBondContact O-ND2 3.3Å; E475-K545 IonicContact OE1-NZ 2.74Å
476	N	45.8	Very low	51.8	Low	87 Å²	87	73.9 Å²	73.9	47%	0.465	39%	0.387	S	S	.	.	H	α-helix	trans	-66.5	-47.6	171.1	-73.8	4.1	0	0	0	111.9	N472 Y474 Q478 N479 D480	N472-N476 WeakPolarHBondContact O-CB 3.44Å; N472-N476 PolarHBondContact O-N 3.32Å; N472-N476 PolarHBondContact O-OD1 2.88Å; Y474-N476 VanDerWaalsContact C-N 3.33Å; N476-Q478 PolarHBondContact O-N 3Å; N476-N479 CarbonylContact O-C 3.44Å; N476-N479 WeakPolarHBondContact O-CA 3.41Å; N476-N479 PolarHBondContact O-N 3.32Å; N476-N479 VanDerWaalsContact O-N 3.08Å; N476-D480 WeakPolarHBondContact O-CB 3.25Å; N476-D480 VanDerWaalsContact O-CG 3.22Å; N476-D480 PolarHBondContact O-N 2.87Å
477	L	44.7	Very low	49.4	Very low	98 Å²	98	79.3 Å²	79.3	51%	0.513	42%	0.416	S	S	.	.	H	α-helix	trans	-59.7	-37.6	177.9	-170.2	70.9	0	0	0	111.8	Q473 Y474 D480 L481	Q473-L477 VanDerWaalsContact O-CB 3.24Å; Q473-L477 WeakPolarHBondContact O-CB 3.47Å; Q473-L477 PolarHBondContact O-N 3.39Å; Y474-L477 PolarHBondContact O-N 3.39Å; L477-D480 PolarHBondContact O-N 3.42Å; L477-L481 HydrophobicContact CG-CD1 4.38Å; L477-L481 VanDerWaalsContact O-CD1 3.27Å; L477-L481 WeakPolarHBondContact O-CD1 3.42Å; L477-L481 PolarHBondContact O-N 3.44Å
478	Q	47.3	Very low	46.8	Very low	87 Å²	87	84.9 Å²	84.9	41%	0.407	45%	0.446	S	S	.	.	H	α-helix	trans	-75.8	-32.4	176.5	-162.5	161.3	-0.2	0	0	112.4	Y474 N476 T482	Y474-Q478 WeakPolarHBondContact O-CB 3.25Å; Y474-Q478 PolarHBondContact O-N 3.43Å; N476-Q478 PolarHBondContact O-N 3Å; Q478-T482 PolarHBondContact O-N 3.09Å; Q478-T482 PolarHBondContact O-OG1 3.36Å
479	N	43.6	Very low	44.6	Very low	49 Å²	49	89.2 Å²	89.2	26%	0.262	47%	0.469	S	S	.	.	H	α-helix	trans	-67.8	-38.6	168.4	-70.9	-30.3	0	0	0	111.3	E475 N476 T482 Q483	E475-N479 VanDerWaalsContact O-CB 3.25Å; E475-N479 WeakPolarHBondContact O-CB 3.3Å; E475-N479 PolarHBondContact O-N 2.81Å; E475-N479 PolarHBondContact O-ND2 3.3Å; N476-N479 CarbonylContact O-C 3.44Å; N476-N479 WeakPolarHBondContact O-CA 3.41Å; N476-N479 PolarHBondContact O-N 3.32Å; N476-N479 VanDerWaalsContact O-N 3.08Å; N479-T482 WeakPolarHBondContact CA-OG1 3.35Å; N479-T482 CarbonylContact O-C 3.09Å; N479-T482 WeakPolarHBondContact O-CA 3.02Å; N479-T482 PolarHBondContact O-N 2.93Å; N479-T482 PolarHBondContact O-OG1 3.37Å; N479-Q483 WeakPolarHBondContact O-CB 3.5Å; N479-Q483 WeakPolarHBondContact O-CG 3.49Å; N479-Q483 PolarHBondContact O-N 2.8Å
480	D	43.1	Very low	43	Very low	80 Å²	80	94 Å²	94	43%	0.428	48%	0.484	S	S	.	.	H	α-helix	trans	-68.8	-38.3	178.8	-74.2	-33.2	0	0	0	111.1	N476 L477 T482 Q483 T484	N476-D480 WeakPolarHBondContact O-CB 3.25Å; N476-D480 VanDerWaalsContact O-CG 3.22Å; N476-D480 PolarHBondContact O-N 2.87Å; L477-D480 PolarHBondContact O-N 3.42Å; D480-T482 PolarHBondContact O-N 3.02Å; D480-Q483 PolarHBondContact O-N 3.17Å; D480-T484 WeakPolarHBondContact O-CB 3.37Å; D480-T484 WeakPolarHBondContact O-CG2 3.35Å; D480-T484 PolarHBondContact O-N 3.07Å; D480-T484 PolarHBondContact O-OG1 3.18Å
481	L	42.1	Very low	41.6	Very low	115 Å²	115	100.4 Å²	100.4	60%	0.602	52%	0.518	S	S	*	.	H	α-helix	trans	-60.5	-33.5	167.7	-99.7	76.5	0	0	0	111.9	L477 T485	L477-L481 HydrophobicContact CG-CD1 4.38Å; L477-L481 VanDerWaalsContact O-CD1 3.27Å; L477-L481 WeakPolarHBondContact O-CD1 3.42Å; L477-L481 PolarHBondContact O-N 3.44Å; L481-T485 WeakPolarHBondContact O-CG2 3.34Å; L481-T485 PolarHBondContact O-OG1 3.47Å; L481-T485 VanDerWaalsContact O-OG1 3.04Å
482	T	40.2	Very low	40.6	Very low	52 Å²	52	107.3 Å²	107.3	32%	0.319	55%	0.547	S	S	.	.	H	α-helix	trans	-84.5	-22.4	174.6	60	0	0	0	0	114.6	Q478 N479 D480 T485 M486	Q478-T482 PolarHBondContact O-N 3.09Å; Q478-T482 PolarHBondContact O-OG1 3.36Å; N479-T482 WeakPolarHBondContact CA-OG1 3.35Å; N479-T482 CarbonylContact O-C 3.09Å; N479-T482 WeakPolarHBondContact O-CA 3.02Å; N479-T482 PolarHBondContact O-N 2.93Å; N479-T482 PolarHBondContact O-OG1 3.37Å; D480-T482 PolarHBondContact O-N 3.02Å; T482-T485 VanDerWaalsContact C-OG1 3.26Å; T482-T485 WeakPolarHBondContact CA-OG1 3.39Å; T482-T485 PolarHBondContact O-OG1 3.02Å; T482-M486 WeakPolarHBondContact O-CE 3.38Å
483	Q	42.7	Very low	39.7	Very low	99 Å²	99	109 Å²	109	46%	0.463	56%	0.555	S	S	.	*	H	α-helix	trans	-89.6	-34.3	178.6	-76.8	-168.7	5.4	0	0	112.4	N479 D480 T485 M486 N487	N479-Q483 WeakPolarHBondContact O-CB 3.5Å; N479-Q483 WeakPolarHBondContact O-CG 3.49Å; N479-Q483 PolarHBondContact O-N 2.8Å; D480-Q483 PolarHBondContact O-N 3.17Å; Q483-T485 PolarHBondContact O-N 3.18Å; Q483-M486 CarbonylContact O-C 3.48Å; Q483-M486 PolarHBondContact O-N 3.48Å; Q483-N487 WeakPolarHBondContact O-CB 3.45Å; Q483-N487 PolarHBondContact O-N 3.34Å
484	T	39	Very low	38.9	Very low	73 Å²	73	113 Å²	113	45%	0.448	57%	0.565	S	S	.	*	H	α-helix	trans	-63.7	-32.6	170.1	50.4	0	0	0	0	111.5	D480 M486 N488	D480-T484 WeakPolarHBondContact O-CB 3.37Å; D480-T484 WeakPolarHBondContact O-CG2 3.35Å; D480-T484 PolarHBondContact O-N 3.07Å; D480-T484 PolarHBondContact O-OG1 3.18Å; T484-M486 PolarHBondContact O-N 3.3Å; T484-N488 WeakPolarHBondContact O-CB 3.4Å; T484-N488 PolarHBondContact O-N 3.34Å; T484-N488 PolarHBondContact O-ND2 3.42Å
485	T	35.6	Very low	38	Very low	102 Å²	102	116 Å²	116	63%	0.626	58%	0.581	S	S	*	*	H	α-helix	trans	-73.9	-3.9	169.2	50.8	0	0	0	0	115	L481 T482 Q483	L481-T485 WeakPolarHBondContact O-CG2 3.34Å; L481-T485 PolarHBondContact O-OG1 3.47Å; L481-T485 VanDerWaalsContact O-OG1 3.04Å; T482-T485 VanDerWaalsContact C-OG1 3.26Å; T482-T485 WeakPolarHBondContact CA-OG1 3.39Å; T482-T485 PolarHBondContact O-OG1 3.02Å; Q483-T485 PolarHBondContact O-N 3.18Å
486	M	33.5	Very low	37	Very low	93 Å²	93	115.4 Å²	115.4	46%	0.458	60%	0.598	S	S	.	*	H	α-helix	trans	-117.7	-33	176.4	-73.8	-168.3	-87.5	0	0	113.9	T482 Q483 T484 N489 L544	T482-M486 WeakPolarHBondContact O-CE 3.38Å; Q483-M486 CarbonylContact O-C 3.48Å; Q483-M486 PolarHBondContact O-N 3.48Å; T484-M486 PolarHBondContact O-N 3.3Å; M486-N489 PolarHBondContact O-ND2 3Å; M486-L544 HydrophobicContact CE-CD1 3.78Å; M486-L544 HydrophobicContact SD-CD1 3.94Å
487	N	39.3	Very low	36.3	Very low	114 Å²	114	122.5 Å²	122.5	61%	0.61	62%	0.62	S	S	*	*	H	α-helix	trans	-88.9	-18.9	-176.8	-74.1	-16	0	0	0	114.2	Q483 N489	Q483-N487 WeakPolarHBondContact O-CB 3.45Å; Q483-N487 PolarHBondContact O-N 3.34Å; N487-N489 PolarHBondContact O-N 2.66Å
488	N	34	Very low	35.5	Very low	124 Å²	124	123.3 Å²	123.3	66%	0.663	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	8.4	176.3	-70.1	-4.3	0	0	0	113.5	T484 H490	T484-N488 WeakPolarHBondContact O-CB 3.4Å; T484-N488 PolarHBondContact O-N 3.34Å; T484-N488 PolarHBondContact O-ND2 3.42Å; N488-H490 PolarHBondContact O-N 3.23Å
489	N	34.2	Very low	34.8	Very low	128 Å²	128	124.4 Å²	124.4	68%	0.684	64%	0.639	S	S	*	*			trans	-83.1	18.8	178.2	-71.1	-37.9	0	0	0	114.2	M486 N487	M486-N489 PolarHBondContact O-ND2 3Å; N487-N489 PolarHBondContact O-N 2.66Å
490	H	34.4	Very low	34.4	Very low	164 Å²	164	126.6 Å²	126.6	76%	0.759	66%	0.655	S	S	*	*	S	Bend	trans	-128.7	129.2	164.8	-77	-57.7	0	0	0	109.9	N488	N488-H490 PolarHBondContact O-N 3.23Å
491	N	31.1	Very low	34	Very low	148 Å²	148	128.9 Å²	128.9	79%	0.791	67%	0.667	S	S	*	*	S	Bend	trans	72.1	62.6	175.9	-49.2	-18.3	0	0	0	116.2
492	H	33.8	Very low	33.6	Very low	187 Å²	187	129.6 Å²	129.6	87%	0.866	67%	0.67	S	S	*	*				-162.5	134.6	109.8	-104	-69.3	0	0	0	111.3
493	D	28.4	Very low	33.4	Very low	149 Å²	149	135.7 Å²	135.7	80%	0.797	69%	0.694	S	S	*	*			trans	-72.2	129.5	-179.2	-56.6	-85.6	0	0	0	112.6
494	W	29.3	Very low	33.1	Very low	224 Å²	224	138.4 Å²	138.4	85%	0.848	71%	0.707	S	S	*	*				-165	131.1	124.8	-110.7	34.1	0	0	0	112.4
495	F	29.5	Very low	32.7	Very low	174 Å²	174	141.9 Å²	141.9	76%	0.763	72%	0.723	S	S	*	*			trans	47.5	92.4	168.4	-61	-65.8	0	0	0	119
496	G	26.8	Very low	32.7	Very low	76 Å²	76	144.3 Å²	144.3	78%	0.784	73%	0.731	S	S	*	*			trans	-90.8	171.1	169	0	0	0	0	0	114.8
497	Y	30	Very low	32.5	Very low	236 Å²	236	147.9 Å²	147.9	93%	0.925	74%	0.744	S	S	*	*			trans	-133.6	151.1	161.5	-135.8	-97.9	0	0	0	110.2
498	N	27.9	Very low	32	Very low	115 Å²	115	145.6 Å²	145.6	62%	0.615	74%	0.737	S	S	*	*			trans	-79.5	124	-160.5	-166.4	-3.5	0	0	0	113.1	T500	N498-T500 VanDerWaalsContact C-N 3.25Å; N498-T500 PolarHBondContact O-N 3.43Å
499	P	32.8	Very low	31.8	Very low	110 Å²	110	145.8 Å²	145.8	71%	0.714	74%	0.742	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	59.7	-175.6	34.1	-38.4	0	0	0	113.4
500	T	35.4	Very low	31.4	Very low	95 Å²	95	144 Å²	144	58%	0.583	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.3	-14.7	-176.4	44.6	0	0	0	0	115.8	N498	N498-T500 VanDerWaalsContact C-N 3.25Å; N498-T500 PolarHBondContact O-N 3.43Å
501	N	33.3	Very low	31.2	Very low	128 Å²	128	142.6 Å²	142.6	68%	0.684	73%	0.733	S	S	*	*			trans	-107.5	17.1	-174.1	-75.2	-1.8	0	0	0	115.5	H503	N501-H503 PolarHBondContact O-N 2.68Å; N501-H503 VanDerWaalsContact O-N 3.14Å
502	I	34.4	Very low	31	Very low	130 Å²	130	146.1 Å²	146.1	67%	0.667	74%	0.737	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	-11.5	-174.7	-65.3	173.9	0	0	0	113	E504	I502-E504 PolarHBondContact O-N 3.32Å
503	H	35.8	Very low	30.9	Very low	180 Å²	180	142.1 Å²	142.1	83%	0.833	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	-5.1	-169.2	-138.7	-54.9	0	0	0	116.2	N501	N501-H503 PolarHBondContact O-N 2.68Å; N501-H503 VanDerWaalsContact O-N 3.14Å
504	E	36	Very low	31	Very low	157 Å²	157	142.1 Å²	142.1	73%	0.734	73%	0.728	S	S	*	*	S	Bend	trans	-111.3	-27.5	-174.7	-63.3	-164.5	116.7	0	0	115.3	I502 L506	I502-E504 PolarHBondContact O-N 3.32Å; E504-L506 PolarHBondContact O-N 3.13Å; E504-L506 VanDerWaalsContact O-N 3.15Å
505	N	32.2	Very low	31	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	72%	0.719	S	S	*	*	S	Bend	trans	-81.3	11.5	-173.7	-73.7	-22.6	0	0	0	115.1	K507	N505-K507 VanDerWaalsContact C-N 3.28Å; N505-K507 PolarHBondContact O-N 2.89Å
506	L	33.9	Very low	31.1	Very low	153 Å²	153	135.2 Å²	135.2	80%	0.801	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	27.3	-173.5	-119.9	149	0	0	0	113.7	E504	E504-L506 PolarHBondContact O-N 3.13Å; E504-L506 VanDerWaalsContact O-N 3.15Å
507	K	29.9	Very low	31.2	Very low	169 Å²	169	137.8 Å²	137.8	74%	0.735	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120	-4.1	-165.6	-82.5	-178.1	174.8	174.3	0	117.3	N505	N505-K507 VanDerWaalsContact C-N 3.28Å; N505-K507 PolarHBondContact O-N 2.89Å
508	S	28.8	Very low	31.3	Very low	65 Å²	65	132.3 Å²	132.3	46%	0.455	71%	0.71	S	S	.	*			trans	-113.5	13.3	-170.3	61.5	0	0	0	0	115.7
509	V	29.2	Very low	31.4	Very low	128 Å²	128	132.8 Å²	132.8	78%	0.776	72%	0.717	S	S	*	*	S	Bend	trans	-97.4	105.4	169.9	178.9	0	0	0	0	108.4	I511	V509-I511 PolarHBondContact O-N 3.39Å
510	T	27.4	Very low	31.4	Very low	91 Å²	91	133.7 Å²	133.7	56%	0.558	72%	0.721	S	S	*	*			trans	-73.5	87.9	-172.8	-36.7	0	0	0	0	111.5	Y512 N984	T510-Y512 PolarHBondContact O-N 3.45Å; T510-N984 PolarHBondContact OG1-O 3.45Å
511	I	30.3	Very low	31.5	Very low	135 Å²	135	135.1 Å²	135.1	69%	0.692	73%	0.729	S	S	*	*			trans	-64.5	118.4	167.1	-59.8	169.5	0	0	0	107.8	V509 P513	V509-I511 PolarHBondContact O-N 3.39Å; I511-P513 HydrophobicContact CG2-CB 4.38Å; I511-P513 WeakPolarHBondContact O-CD 3.04Å; I511-P513 WeakPolarHBondContact O-CG 3.45Å
512	Y	26.3	Very low	31.3	Very low	222 Å²	222	136 Å²	136	87%	0.871	74%	0.739	S	S	*	*			trans	-68.1	113.3	164.8	-94.7	-87.9	0	0	0	108.7	T510	T510-Y512 PolarHBondContact O-N 3.45Å
513	P	32	Very low	31.2	Very low	102 Å²	102	134.5 Å²	134.5	66%	0.662	75%	0.746	S	S	*	*			trans	-120.3	91.9	-162.2	36.8	-19.7	0	0	0	113.2	I511	I511-P513 HydrophobicContact CG2-CB 4.38Å; I511-P513 WeakPolarHBondContact O-CD 3.04Å; I511-P513 WeakPolarHBondContact O-CG 3.45Å
514	D	29.7	Very low	30.8	Very low	150 Å²	150	136.1 Å²	136.1	80%	0.802	75%	0.751	S	S	*	*			trans	-111.3	130	161.5	-73	-55.1	0	0	0	108.5
515	T	29.8	Very low	30.7	Very low	110 Å²	110	133.4 Å²	133.4	68%	0.675	76%	0.755	S	S	*	*			cis	-158.2	175.2	2.6	0.9	0	0	0	0	110.4
516	I	31.6	Very low	30.8	Very low	143 Å²	143	133.5 Å²	133.5	73%	0.733	76%	0.761	S	S	*	*			trans	71.7	110.1	169.1	-55.8	138.5	0	0	0	113.6
517	T	27.9	Very low	30.6	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	76%	0.76	S	S	*	*			cis	67	87.8	31.2	44.5	0	0	0	0	119.1
518	T	32.3	Very low	31.2	Very low	122 Å²	122	130.8 Å²	130.8	75%	0.748	76%	0.756	S	S	*	*			trans	179.1	110.4	133.4	39.2	0	0	0	0	109.4
519	T	29.3	Very low	32	Very low	125 Å²	125	133.4 Å²	133.4	77%	0.767	77%	0.77	S	S	*	*				71.3	88.6	74.9	62.7	0	0	0	0	118
520	T	34.3	Very low	32.5	Very low	129 Å²	129	133.7 Å²	133.7	79%	0.791	77%	0.767	S	S	*	*			trans	-168.7	97.7	144.3	24.1	0	0	0	0	109.7
521	T	36.8	Very low	32.9	Very low	124 Å²	124	134.9 Å²	134.9	76%	0.761	77%	0.766	S	S	*	*				72.5	98.2	94.4	58.4	0	0	0	0	118.2
522	V	29.4	Very low	33.2	Very low	146 Å²	146	134.3 Å²	134.3	89%	0.885	76%	0.764	S	S	*	*			trans	54.8	110.3	135.1	-171.5	0	0	0	0	120.1
523	A	32.7	Very low	33.7	Very low	99 Å²	99	127.8 Å²	127.8	82%	0.818	75%	0.751	S	S	*	*				-155.5	134.8	128.2	0	0	0	0	0	110.6
524	K	27.5	Very low	33.6	Very low	214 Å²	214	130.2 Å²	130.2	93%	0.93	76%	0.755	S	S	*	*			trans	-99.5	127.6	164.9	-82.5	-176.3	175.1	-179.4	0	108.5
525	A	33.9	Very low	34	Very low	100 Å²	100	127.7 Å²	127.7	83%	0.826	74%	0.741	S	S	*	*			trans	-137.3	129.1	164.9	0	0	0	0	0	108.9
526	T	33.2	Very low	34.5	Very low	147 Å²	147	126.3 Å²	126.3	90%	0.902	73%	0.732	S	S	*	*			trans	-89.1	121.8	179.1	44.7	0	0	0	0	110.6
527	M	31.3	Very low	34.7	Very low	157 Å²	157	123 Å²	123	77%	0.773	72%	0.721	S	S	*	*			trans	-124.4	167.1	163.3	-76.3	-171.1	66.5	0	0	110.8
528	T	41.9	Very low	35	Very low	108 Å²	108	123.1 Å²	123.1	66%	0.663	71%	0.711	S	S	*	*			trans	-94	168.1	-147.3	46.2	0	0	0	0	114.5	N530 E531	T528-N530 PolarHBondContact O-N 2.96Å; T528-E531 PolarHBondContact O-N 3.45Å
529	T	44.2	Very low	35.2	Very low	121 Å²	121	120.6 Å²	120.6	74%	0.742	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	-7.9	-170.2	46.4	0	0	0	0	117
530	N	40	Very low	35.6	Very low	133 Å²	133	119 Å²	119	71%	0.711	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-10.3	-173.6	-68.1	9	0	0	0	114.1	T528 S533	T528-N530 PolarHBondContact O-N 2.96Å; N530-S533 PolarHBondContact O-OG 3.08Å
531	E	36	Very low	35.7	Very low	116 Å²	116	116.2 Å²	116.2	54%	0.542	67%	0.672	S	S	.	*	S	Bend	trans	-90.7	-18.3	172.5	-62.8	-165.1	145.4	0	0	113	T528 S533 M534 I535	T528-E531 PolarHBondContact O-N 3.45Å; E531-S533 PolarHBondContact O-N 2.79Å; E531-M534 PolarHBondContact O-N 2.75Å; E531-I535 PolarHBondContact O-N 2.85Å
532	L	37.3	Very low	35.8	Very low	123 Å²	123	116.3 Å²	116.3	64%	0.644	67%	0.668	S	S	*	*	H	α-helix	trans	-66.1	-24.5	-174.7	-155.9	70.9	0	0	0	113.1	T536	L532-T536 WeakPolarHBondContact O-CG2 3.22Å; L532-T536 PolarHBondContact O-N 3.31Å; L532-T536 PolarHBondContact O-OG1 3.49Å
533	S	36	Very low	36.1	Very low	86 Å²	86	116.4 Å²	116.4	60%	0.601	66%	0.662	S	S	*	*	H	α-helix	trans	-76.8	-19.1	174.6	54	0	0	0	0	114.1	N530 E531 T536	N530-S533 PolarHBondContact O-OG 3.08Å; E531-S533 PolarHBondContact O-N 2.79Å; S533-T536 PolarHBondContact O-OG1 3.06Å
534	M	31.5	Very low	36.2	Very low	153 Å²	153	116.6 Å²	116.6	75%	0.754	65%	0.649	S	S	*	*	H	α-helix	trans	-92.9	-23.3	178.6	-136.6	177.9	-162.2	0	0	112.4	E531 S537	E531-M534 PolarHBondContact O-N 2.75Å; M534-S537 PolarHBondContact O-OG 3.04Å
535	I	37.9	Very low	36.4	Very low	97 Å²	97	111.2 Å²	111.2	50%	0.497	63%	0.626	S	S	.	*	H	α-helix	trans	-82.2	-38.8	177	-63	172.5	0	0	0	110.9	E531 S537 K538 T539	E531-I535 PolarHBondContact O-N 2.85Å; I535-S537 PolarHBondContact O-N 3.44Å; I535-K538 PolarHBondContact O-N 2.94Å; I535-T539 PolarHBondContact O-N 3.42Å; I535-T539 VanDerWaalsContact O-N 3.12Å; I535-T539 PolarHBondContact O-OG1 2.97Å; I535-T539 VanDerWaalsContact O-OG1 3.12Å
536	T	39.1	Very low	36.2	Very low	80 Å²	80	109.7 Å²	109.7	49%	0.491	61%	0.609	S	S	.	*	H	α-helix	trans	-61.2	-25.4	-179.5	40.8	0	0	0	0	114.5	L532 S533 T540	L532-T536 WeakPolarHBondContact O-CG2 3.22Å; L532-T536 PolarHBondContact O-N 3.31Å; L532-T536 PolarHBondContact O-OG1 3.49Å; S533-T536 PolarHBondContact O-OG1 3.06Å; T536-T540 WeakPolarHBondContact O-CG2 3.31Å; T536-T540 PolarHBondContact O-N 3.35Å; T536-T540 PolarHBondContact O-OG1 3.32Å
537	S	35.9	Very low	36.4	Very low	73 Å²	73	106.7 Å²	106.7	51%	0.51	59%	0.592	S	S	.	*	H	α-helix	trans	-80.9	-35.1	175.5	61.9	0	0	0	0	113.7	M534 I535 T540	M534-S537 PolarHBondContact O-OG 3.04Å; I535-S537 PolarHBondContact O-N 3.44Å; S537-T540 PolarHBondContact O-OG1 2.96Å
538	K	35.1	Very low	36.6	Very low	132 Å²	132	105 Å²	105	57%	0.574	59%	0.586	S	S	*	*	H	α-helix	trans	-78.7	-14.8	174.7	-93.5	-172.6	170	-174.3	0	113.6	I535 S541 N542 D947	I535-K538 PolarHBondContact O-N 2.94Å; K538-S541 PolarHBondContact O-OG 3.35Å; K538-N542 PolarHBondContact O-ND2 3.41Å; K538-D947 IonicContact NZ-OD2 2.66Å; K538-D947 PolarHBondContact NZ-OD2 2.89Å
539	T	36.2	Very low	36.4	Very low	70 Å²	70	105.2 Å²	105.2	43%	0.429	58%	0.579	S	S	.	*	H	α-helix	trans	-94	-36.4	177.6	-51.9	0	0	0	0	113.4	I535 S541 N542 L543	I535-T539 PolarHBondContact O-N 3.42Å; I535-T539 VanDerWaalsContact O-N 3.12Å; I535-T539 PolarHBondContact O-OG1 2.97Å; I535-T539 VanDerWaalsContact O-OG1 3.12Å; T539-S541 VanDerWaalsContact C-N 3.35Å; T539-S541 PolarHBondContact O-N 3.3Å; T539-N542 PolarHBondContact O-N 3.44Å; T539-L543 HydrophobicContact CG2-CD1 4.19Å
540	T	36.6	Very low	36.2	Very low	90 Å²	90	102.7 Å²	102.7	55%	0.552	56%	0.561	S	S	*	*	H	α-helix	trans	-66	-33.4	179.4	41.1	0	0	0	0	113.1	T536 S537 N542	T536-T540 WeakPolarHBondContact O-CG2 3.31Å; T536-T540 PolarHBondContact O-N 3.35Å; T536-T540 PolarHBondContact O-OG1 3.32Å; S537-T540 PolarHBondContact O-OG1 2.96Å; T540-N542 PolarHBondContact O-N 3.5Å
541	S	37.7	Very low	36.5	Very low	71 Å²	71	98.9 Å²	98.9	50%	0.497	54%	0.54	S	S	.	.	H	α-helix	trans	-60.8	-26.1	174.3	61.8	0	0	0	0	114.2	K538 T539	K538-S541 PolarHBondContact O-OG 3.35Å; T539-S541 VanDerWaalsContact C-N 3.35Å; T539-S541 PolarHBondContact O-N 3.3Å
542	N	38.9	Very low	37.1	Very low	127 Å²	127	101.7 Å²	101.7	68%	0.679	55%	0.546	S	S	*	.	H	α-helix	trans	-100.4	-11.3	-168.4	-62.1	-8.8	0	0	0	113.4	K538 T539 T540	K538-N542 PolarHBondContact O-ND2 3.41Å; T539-N542 PolarHBondContact O-N 3.44Å; T540-N542 PolarHBondContact O-N 3.5Å
543	L	35.5	Very low	37.9	Very low	147 Å²	147	97.3 Å²	97.3	77%	0.77	53%	0.526	S	S	*	.	H	α-helix	trans	-94.2	-10.4	177.1	-76.1	164.3	0	0	0	113.5	T539	T539-L543 HydrophobicContact CG2-CD1 4.19Å
544	L	34.4	Very low	39.8	Very low	103 Å²	103	96 Å²	96	54%	0.539	51%	0.509	S	S	.	.	S	Bend	trans	-105.4	4.4	-171.4	-110.8	157.4	0	0	0	115.2	M486	M486-L544 HydrophobicContact CE-CD1 3.78Å; M486-L544 HydrophobicContact SD-CD1 3.94Å
545	K	30.9	Very low	42.2	Very low	102 Å²	102	89.5 Å²	89.5	44%	0.443	48%	0.477	S	S	.	.			trans	-129.3	92.5	172.5	-75.9	-173.6	174.2	-176.5	0	111.4	E475 P547 L550	E475-K545 IonicContact OE1-NZ 2.74Å; K545-P547 WeakPolarHBondContact O-CD 3.21Å; K545-L550 HydrophobicContact CD-CD1 4.05Å; K545-L550 HydrophobicContact CD-CD2 4.27Å
546	S	30.1	Very low	44.4	Very low	67 Å²	67	84.9 Å²	84.9	47%	0.469	45%	0.453	S	S	.	.			trans	-60	120.1	157.5	175.2	0	0	0	0	108.2	N548 Q549	S546-N548 PolarHBondContact O-N 2.72Å; S546-N548 VanDerWaalsContact O-N 3.08Å; S546-Q549 PolarHBondContact O-N 2.73Å; S546-Q549 VanDerWaalsContact O-N 3.11Å
547	P	37	Very low	46.6	Very low	84 Å²	84	81.2 Å²	81.2	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-60.9	-26.5	-173.5	23.1	-33.3	0	0	0	112.1	K545 Q549 L550 I551	K545-P547 WeakPolarHBondContact O-CD 3.21Å; P547-Q549 VanDerWaalsContact C-N 3.29Å; P547-Q549 PolarHBondContact O-N 3.37Å; P547-L550 PolarHBondContact O-N 2.75Å; P547-I551 WeakPolarHBondContact O-CD1 3.32Å; P547-I551 VanDerWaalsContact O-CG1 3.25Å; P547-I551 WeakPolarHBondContact O-CG1 3.39Å; P547-I551 PolarHBondContact O-N 3.27Å
548	N	37	Very low	48.6	Very low	121 Å²	121	78.8 Å²	78.8	65%	0.647	41%	0.41	S	S	*	.	H	α-helix	trans	-65	-28.7	-179.8	-60.8	-13	0	0	0	113.2	S546	S546-N548 PolarHBondContact O-N 2.72Å; S546-N548 VanDerWaalsContact O-N 3.08Å
549	Q	38.1	Very low	50.4	Low	113 Å²	113	73.1 Å²	73.1	53%	0.528	39%	0.389	S	S	.	.	H	α-helix	trans	-73.7	-46.1	172.3	-73.4	-75.6	2.1	0	0	110.8	S546 P547 I551 R552	S546-Q549 PolarHBondContact O-N 2.73Å; S546-Q549 VanDerWaalsContact O-N 3.11Å; P547-Q549 VanDerWaalsContact C-N 3.29Å; P547-Q549 PolarHBondContact O-N 3.37Å; Q549-I551 PolarHBondContact O-N 3.04Å; Q549-R552 WeakPolarHBondContact O-CB 3.33Å; Q549-R552 PolarHBondContact O-N 2.68Å
550	L	38.4	Very low	51.8	Low	69 Å²	69	72.6 Å²	72.6	36%	0.361	38%	0.383	S	S	.	.	H	α-helix	trans	-70.1	-17.5	-177.9	-146.5	80.1	0	0	0	113.8	K545 P547 R552 S553	K545-L550 HydrophobicContact CD-CD1 4.05Å; K545-L550 HydrophobicContact CD-CD2 4.27Å; P547-L550 PolarHBondContact O-N 2.75Å; L550-R552 VanDerWaalsContact C-N 3.33Å; L550-S553 PolarHBondContact O-OG 3.46Å
551	I	46	Very low	52.9	Low	53 Å²	53	72.6 Å²	72.6	27%	0.272	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73	-26.1	171.1	-74.4	163.8	0	0	0	111.7	Y391 P547 Q549	Y391-I551 HydrophobicContact CD2-CG2 4.09Å; Y391-I551 HydrophobicContact CE2-CG2 4.02Å; P547-I551 WeakPolarHBondContact O-CD1 3.32Å; P547-I551 VanDerWaalsContact O-CG1 3.25Å; P547-I551 WeakPolarHBondContact O-CG1 3.39Å; P547-I551 PolarHBondContact O-N 3.27Å; Q549-I551 PolarHBondContact O-N 3.04Å
552	R	50	Low	54.2	Low	174 Å²	174	72.3 Å²	72.3	66%	0.657	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.3	-22.5	-177.2	-145.5	178.5	-159	-172.6	6.8	113.3	Q549 L550 K554	Q549-R552 WeakPolarHBondContact O-CB 3.33Å; Q549-R552 PolarHBondContact O-N 2.68Å; L550-R552 VanDerWaalsContact C-N 3.33Å; R552-K554 PolarHBondContact O-N 3.04Å
553	S	54.7	Low	55.7	Low	32 Å²	32	72.8 Å²	72.8	22%	0.224	38%	0.38	C	S	.	.	S	Bend	trans	-96.1	44.4	-173	62.9	0	0	0	0	113.9	L470 L550	L470-S553 VanDerWaalsContact CD1-O 3.26Å; L470-S553 WeakPolarHBondContact CD1-O 3.3Å; L550-S553 PolarHBondContact O-OG 3.46Å
554	K	74.7	Confident	58.1	Low	59 Å²	59	69.1 Å²	69.1	26%	0.257	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	125.1	174.5	-67.1	-173.7	-174.8	-179.7	0	111.4	C390 C467 R552	C390-K554 HydrophobicContact CB-CB 4.19Å; C390-K554 WeakPolarHBondContact CB-O 3.5Å; C390-K554 PolarHBondContact N-O 3.44Å; C467-K554 HydrophobicContact CB-CB 4.32Å; C467-K554 HydrophobicContact CB-CD 4.36Å; R552-K554 PolarHBondContact O-N 3.04Å
555	I	81.8	Confident	60.7	Low	15 Å²	15	65.1 Å²	65.1	8%	0.077	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	152.4	174.9	53.3	172.3	0	0	0	110.8	I365 C467 D468 L470	I365-I555 HydrophobicContact CB-CG2 4.31Å; I365-I555 HydrophobicContact CD1-CG2 3.91Å; I365-I555 HydrophobicContact CG2-CG2 3.9Å; C467-I555 WeakPolarHBondContact CA-O 3.45Å; D468-I555 HydrophobicContact CB-CD1 4.27Å; D468-I555 HydrophobicContact CB-CG1 4.05Å; D468-I555 PolarHBondContact N-O 2.83Å; D468-I555 PolarHBondContact O-N 3.08Å; L470-I555 HydrophobicContact CD1-CG2 3.99Å; L470-I555 HydrophobicContact CG-CG2 4.28Å
556	L	85.1	Confident	63.6	Low	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	142.7	163.1	-166	63.9	0	0	0	109.7	M388 Y558 G634 P636	M388-L556 HydrophobicContact CB-CD2 4.14Å; M388-L556 HydrophobicContact CE-CD2 3.97Å; M388-L556 WeakPolarHBondContact O-CB 3.27Å; M388-L556 PolarHBondContact O-N 2.85Å; M388-L556 VanDerWaalsContact O-N 3.08Å; L556-Y558 HydrophobicContact CB-CE2 3.95Å; L556-Y558 WeakPolarHBondContact O-CD2 3.12Å; L556-Y558 WeakPolarHBondContact O-CE2 3.31Å; L556-Y558 PolarHBondContact O-N 2.88Å; L556-G634 WeakPolarHBondContact CD1-O 3.43Å; L556-G634 WeakPolarHBondContact CD2-O 3.44Å; L556-G634 WeakPolarHBondContact CG-O 3.33Å; L556-P636 HydrophobicContact CD1-CB 3.91Å; L556-P636 HydrophobicContact CD1-CG 4.5Å; L556-P636 HydrophobicContact CD2-CB 4.27Å; L556-P636 HydrophobicContact CD2-CG 4.14Å
557	R	85	Confident	66.5	Low	3 Å²	3	58 Å²	58	1%	0.011	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-76.6	121.7	-179.4	173.1	164.9	-86.6	-75.8	-3	110.9	I465 A466 C467 D468 N561 C566 E633 G634	I465-R557 WeakPolarHBondContact O-CD 3.4Å; A466-R557 WeakPolarHBondContact O-CB 3.24Å; A466-R557 PolarHBondContact O-N 3.27Å; C467-R557 PolarHBondContact O-NE 3.44Å; D468-R557 IonicContact OD1-CZ 3.28Å; D468-R557 IonicContact OD1-NH2 3.08Å; D468-R557 PolarHBondContact OD1-NH2 3.31Å; D468-R557 IonicContact OD2-CZ 2.65Å; D468-R557 VanDerWaalsContact OD2-CZ 3.24Å; D468-R557 IonicContact OD2-NE 3.98Å; D468-R557 IonicContact OD2-NH1 3.86Å; D468-R557 IonicContact OD2-NH2 2.8Å; D468-R557 PolarHBondContact OD2-NH2 3.37Å; R557-N561 PolarHBondContact NH1-O 3.41Å; R557-N561 PolarHBondContact NH2-O 2.86Å; R557-C566 VanDerWaalsContact CD-SG 3.56Å; R557-E633 CarbonylContact O-C 3.55Å; R557-E633 VanDerWaalsContact O-CA 3.31Å; R557-E633 WeakPolarHBondContact O-CA 3.42Å; R557-G634 PolarHBondContact O-N 2.78Å
558	Y	77.6	Confident	69.2	Low	22 Å²	22	57.2 Å²	57.2	9%	0.086	31%	0.309	C	S	.	.	B	Isolated β-bridge	trans	-117.4	131.8	173.6	-62.6	-84.5	0	0	0	110.2	I378 S387 M388 L556 E633	I378-Y558 HydrophobicContact CD1-CD2 4.17Å; I378-Y558 HydrophobicContact CD1-CG 4.31Å; I378-Y558 HydrophobicContact CG2-CD2 4.25Å; I378-Y558 HydrophobicContact CG2-CE1 4.4Å; I378-Y558 HydrophobicContact CG2-CE2 4.11Å; I378-Y558 HydrophobicContact CG2-CG 4.46Å; S387-Y558 WeakPolarHBondContact OG-CE2 3.25Å; M388-Y558 PolarHBondContact N-OH 3.26Å; L556-Y558 HydrophobicContact CB-CE2 3.95Å; L556-Y558 WeakPolarHBondContact O-CD2 3.12Å; L556-Y558 WeakPolarHBondContact O-CE2 3.31Å; L556-Y558 PolarHBondContact O-N 2.88Å; Y558-E633 HydrophobicContact CD1-CB 4.03Å; Y558-E633 HydrophobicContact CE1-CB 4.38Å; Y558-E633 WeakPolarHBondContact CE1-OE2 3.48Å
559	A	72.9	Confident	72	Confident	14 Å²	14	51.5 Å²	51.5	12%	0.116	28%	0.278	C	S	.	.	S	Bend	trans	61.2	177.7	-171.9	0	0	0	0	0	114.7	N561 V632	A559-N561 VanDerWaalsContact C-N 3.31Å; A559-N561 PolarHBondContact O-N 2.9Å; A559-V632 WeakPolarHBondContact CA-O 3.24Å; A559-V632 PolarHBondContact N-O 3.49Å
560	L	66	Low	74.7	Confident	59 Å²	59	46.1 Å²	46.1	31%	0.309	25%	0.253	S	S	.	.	S	Bend	trans	-82.6	1.1	-174	-83.7	88.7	0	0	0	114.8	G562 A567 L627 V632	L560-G562 PolarHBondContact O-N 3.37Å; L560-G562 VanDerWaalsContact O-N 3.09Å; L560-A567 HydrophobicContact CD2-CB 3.7Å; L560-A567 HydrophobicContact CG-CB 4.43Å; L560-L627 HydrophobicContact CD1-CD2 3.78Å; L560-L627 HydrophobicContact CD2-CD2 3.72Å; L560-L627 HydrophobicContact CG-CD2 4.37Å; L560-V632 HydrophobicContact CD1-CB 4Å; L560-V632 HydrophobicContact CD1-CG2 3.95Å
561	N	60	Low	77.4	Confident	89 Å²	89	46.2 Å²	46.2	48%	0.476	25%	0.254	S	S	.	.	S	Bend	trans	-67.6	111.1	-173.9	-70.6	-3.7	0	0	0	110.8	H375 R557 A559	H375-N561 PolarHBondContact CE1-ND2 2.78Å; H375-N561 VanDerWaalsContact CE1-ND2 3.35Å; H375-N561 PolarHBondContact NE2-ND2 2.59Å; R557-N561 PolarHBondContact NH1-O 3.41Å; R557-N561 PolarHBondContact NH2-O 2.86Å; A559-N561 VanDerWaalsContact C-N 3.31Å; A559-N561 PolarHBondContact O-N 2.9Å
562	G	64.5	Low	79.8	Confident	65 Å²	65	44.6 Å²	44.6	67%	0.67	25%	0.245	S	C	*	.	S	Bend	trans	119.4	-128.9	-177.2	0	0	0	0	0	113.4	L560	L560-G562 PolarHBondContact O-N 3.37Å; L560-G562 VanDerWaalsContact O-N 3.09Å
563	R	69.5	Low	82	Confident	138 Å²	138	37.1 Å²	37.1	52%	0.521	22%	0.218	S	C	.	.			trans	-76.3	128.9	-166.1	-55.1	-177.4	-160.2	-170.7	3.3	112.7	S565 C566	R563-S565 WeakPolarHBondContact CB-OG 3.48Å; R563-S565 PolarHBondContact O-N 3.08Å; R563-C566 PolarHBondContact O-N 2.72Å
564	A	85.8	Confident	84	Confident	69 Å²	69	36.4 Å²	36.4	57%	0.57	21%	0.211	S	C	*	.	H	α-helix	trans	-61.5	-12.6	173.7	0	0	0	0	0	114.6	C566 A567 V568	A564-C566 VanDerWaalsContact C-N 3.32Å; A564-C566 PolarHBondContact O-N 3.09Å; A564-A567 PolarHBondContact O-N 3.11Å; A564-V568 WeakPolarHBondContact O-CG2 3.43Å; A564-V568 PolarHBondContact O-N 3.36Å
565	S	88.9	Confident	85.1	Confident	20 Å²	20	35.5 Å²	35.5	14%	0.14	21%	0.207	C	C	.	.	H	α-helix	trans	-55.4	-43.9	176	48.4	0	0	0	0	112.7	A464 R563 V568 V569	A464-S565 PolarHBondContact O-OG 2.66Å; R563-S565 WeakPolarHBondContact CB-OG 3.48Å; R563-S565 PolarHBondContact O-N 3.08Å; S565-V568 PolarHBondContact O-N 3.29Å; S565-V569 PolarHBondContact O-N 3.34Å
566	C	91.8	Very high	85.9	Confident	2 Å²	2	36.4 Å²	36.4	1%	0.014	21%	0.211	C	C	.	.	H	α-helix	trans	-62.9	-46	176.2	179.1	0	0	0	0	111.7	I465 R557 R563 A564 V568 V569 F570 C641	I465-C566 WeakPolarHBondContact O-CB 3.33Å; R557-C566 VanDerWaalsContact CD-SG 3.56Å; R563-C566 PolarHBondContact O-N 2.72Å; A564-C566 VanDerWaalsContact C-N 3.32Å; A564-C566 PolarHBondContact O-N 3.09Å; C566-V568 PolarHBondContact O-N 3.22Å; C566-V569 PolarHBondContact O-N 2.71Å; C566-F570 WeakPolarHBondContact O-CB 3.23Å; C566-F570 PolarHBondContact O-N 3.27Å; C566-C641 WeakPolarHBondContact CA-SG 3.42Å; C566-C641 HydrophobicContact CB-CB 4.16Å; C566-C641 WeakPolarHBondContact CB-SG 3.45Å; C566-C641 WeakPolarHBondContact O-CB 3.47Å; C566-C641 WeakPolarHBondContact SG-CB 3.38Å; C566-C641 CovalentContact SG-SG 2.04Å; C566-C641 PolarHBondContact SG-SG 3.17Å
567	A	92.1	Very high	86.4	Confident	18 Å²	18	37.7 Å²	37.7	15%	0.149	22%	0.217	C	C	.	.	H	α-helix	trans	-63	-39.4	177.3	0	0	0	0	0	112.4	L560 A564 F570 L571	L560-A567 HydrophobicContact CD2-CB 3.7Å; L560-A567 HydrophobicContact CG-CB 4.43Å; A564-A567 PolarHBondContact O-N 3.11Å; A567-F570 PolarHBondContact O-N 3.04Å; A567-L571 WeakPolarHBondContact O-CB 3.3Å; A567-L571 VanDerWaalsContact O-CG 3.24Å; A567-L571 WeakPolarHBondContact O-CG 3.35Å; A567-L571 PolarHBondContact O-N 3.14Å
568	V	93.7	Very high	87	Confident	67 Å²	67	37.6 Å²	37.6	41%	0.406	22%	0.217	S	C	.	.	H	α-helix	trans	-65.4	-44.9	176.6	169	0	0	0	0	111.6	A564 S565 C566 L571 L572	A564-V568 WeakPolarHBondContact O-CG2 3.43Å; A564-V568 PolarHBondContact O-N 3.36Å; S565-V568 PolarHBondContact O-N 3.29Å; C566-V568 PolarHBondContact O-N 3.22Å; V568-L571 PolarHBondContact O-N 2.95Å; V568-L572 HydrophobicContact CG1-CD1 3.88Å; V568-L572 HydrophobicContact CG1-CG 4.45Å; V568-L572 WeakPolarHBondContact O-CB 3.41Å; V568-L572 VanDerWaalsContact O-CG 3.28Å; V568-L572 WeakPolarHBondContact O-CG 3.27Å; V568-L572 PolarHBondContact O-N 3.43Å
569	V	94.9	Very high	88	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-65.4	-41.9	175.7	169.3	0	0	0	0	111.5	I456 I465 S565 C566 L571 L572 I573 L640	I456-V569 HydrophobicContact CB-CG2 4.28Å; I456-V569 HydrophobicContact CG2-CG2 3.74Å; I465-V569 HydrophobicContact CD1-CG2 3.62Å; I465-V569 HydrophobicContact CG2-CB 4.09Å; I465-V569 HydrophobicContact CG2-CG1 4.45Å; I465-V569 HydrophobicContact CG2-CG2 3.98Å; S565-V569 PolarHBondContact O-N 3.34Å; C566-V569 PolarHBondContact O-N 2.71Å; V569-L571 PolarHBondContact O-N 2.88Å; V569-L572 PolarHBondContact O-N 3.09Å; V569-I573 HydrophobicContact CG1-CD1 3.87Å; V569-I573 WeakPolarHBondContact O-CG1 3.05Å; V569-I573 PolarHBondContact O-N 3.36Å; V569-L640 HydrophobicContact CG1-CB 4.39Å; V569-L640 HydrophobicContact CG1-CD2 3.92Å
570	F	95.3	Very high	89.1	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-57.2	-49.6	174	172.4	-106	0	0	0	111.5	C566 A567 L572 I573 Y574 T623 A626 L627 V632 C641 I643	C566-F570 WeakPolarHBondContact O-CB 3.23Å; C566-F570 PolarHBondContact O-N 3.27Å; A567-F570 PolarHBondContact O-N 3.04Å; F570-L572 PolarHBondContact O-N 3.13Å; F570-I573 PolarHBondContact O-N 3.1Å; F570-Y574 HydrophobicContact CE1-CD1 4.24Å; F570-Y574 AromaticContact CE2-CD1 3.98Å; F570-Y574 HydrophobicContact CE2-CD1 3.98Å; F570-Y574 HydrophobicContact CE2-CD2 4.29Å; F570-Y574 AromaticContact CE2-CG 3.72Å; F570-Y574 HydrophobicContact CE2-CG 3.72Å; F570-Y574 AromaticContact CZ-CD1 3.56Å; F570-Y574 HydrophobicContact CZ-CD1 3.56Å; F570-Y574 HydrophobicContact CZ-CE1 4.1Å; F570-Y574 AromaticContact CZ-CG 3.82Å; F570-Y574 HydrophobicContact CZ-CG 3.82Å; F570-Y574 VanDerWaalsContact O-CB 3.22Å; F570-Y574 WeakPolarHBondContact O-CB 3.31Å; F570-Y574 PolarHBondContact O-N 3.5Å; F570-T623 HydrophobicContact CE1-CG2 3.97Å; F570-A626 HydrophobicContact CZ-CB 4.23Å; F570-L627 HydrophobicContact CD1-CD2 3.81Å; F570-L627 HydrophobicContact CE1-CD2 3.67Å; F570-L627 HydrophobicContact CE1-CG 4.04Å; F570-V632 HydrophobicContact CB-CG1 4.2Å; F570-V632 HydrophobicContact CD1-CG2 4.04Å; F570-V632 HydrophobicContact CD2-CG1 4.02Å; F570-V632 HydrophobicContact CD2-CG2 4.13Å; F570-V632 HydrophobicContact CE1-CG2 3.9Å; F570-V632 HydrophobicContact CE2-CG2 4.01Å; F570-V632 HydrophobicContact CG-CG1 4Å; F570-V632 HydrophobicContact CG-CG2 4.15Å; F570-V632 HydrophobicContact CZ-CG2 3.89Å; F570-C641 HydrophobicContact CB-CB 4.13Å; F570-I643 HydrophobicContact CE2-CG1 4.15Å
571	L	95.5	Very high	90.5	Very high	71 Å²	71	33.3 Å²	33.3	37%	0.372	19%	0.194	S	C	.	.	I	π-helix	trans	-60	-46	176.7	-74.2	171.5	0	0	0	112.3	A567 V568 V569 I573 F575 T623 L627	A567-L571 WeakPolarHBondContact O-CB 3.3Å; A567-L571 VanDerWaalsContact O-CG 3.24Å; A567-L571 WeakPolarHBondContact O-CG 3.35Å; A567-L571 PolarHBondContact O-N 3.14Å; V568-L571 PolarHBondContact O-N 2.95Å; V569-L571 PolarHBondContact O-N 2.88Å; L571-I573 VanDerWaalsContact C-N 3.29Å; L571-I573 PolarHBondContact O-N 3.39Å; L571-F575 WeakPolarHBondContact O-CB 3.47Å; L571-F575 PolarHBondContact O-N 3Å; L571-T623 HydrophobicContact CD2-CG2 3.66Å; L571-L627 HydrophobicContact CD2-CD1 4.21Å
572	L	97	Very high	92.3	Very high	19 Å²	19	29.4 Å²	29.4	10%	0.099	17%	0.173	C	C	.	.	I	π-helix	trans	-63.6	-33	-178.9	-75	171.7	0	0	0	113.2	M449 I450 I456 V568 V569 F570 F576	M449-L572 HydrophobicContact CB-CD2 4.38Å; M449-L572 HydrophobicContact CE-CD2 3.62Å; I450-L572 WeakPolarHBondContact CA-O 3.47Å; I456-L572 HydrophobicContact CD1-CD1 3.47Å; I456-L572 VanDerWaalsContact CD1-CD1 3.47Å; V568-L572 HydrophobicContact CG1-CD1 3.88Å; V568-L572 HydrophobicContact CG1-CG 4.45Å; V568-L572 WeakPolarHBondContact O-CB 3.41Å; V568-L572 VanDerWaalsContact O-CG 3.28Å; V568-L572 WeakPolarHBondContact O-CG 3.27Å; V568-L572 PolarHBondContact O-N 3.43Å; V569-L572 PolarHBondContact O-N 3.09Å; F570-L572 PolarHBondContact O-N 3.13Å; L572-F576 HydrophobicContact CD2-CE2 4.25Å; L572-F576 WeakPolarHBondContact O-CD2 3.21Å
573	I	96.2	Very high	93.8	Very high	18 Å²	18	26.3 Å²	26.3	9%	0.092	14%	0.141	C	C	.	.	I	π-helix	trans	-92.2	-52.3	-178.1	-65.1	179.2	0	0	0	111.4	Y454 V569 F570 L571 N577 L640	Y454-I573 HydrophobicContact CD2-CD1 4.06Å; Y454-I573 HydrophobicContact CD2-CG1 4.44Å; Y454-I573 HydrophobicContact CE2-CD1 4.03Å; Y454-I573 HydrophobicContact CE2-CG1 4.4Å; V569-I573 HydrophobicContact CG1-CD1 3.87Å; V569-I573 WeakPolarHBondContact O-CG1 3.05Å; V569-I573 PolarHBondContact O-N 3.36Å; F570-I573 PolarHBondContact O-N 3.1Å; L571-I573 VanDerWaalsContact C-N 3.29Å; L571-I573 PolarHBondContact O-N 3.39Å; I573-N577 WeakPolarHBondContact O-CB 3.37Å; I573-N577 PolarHBondContact O-N 3.04Å; I573-N577 VanDerWaalsContact O-N 3.08Å; I573-L640 HydrophobicContact CD1-CD1 4.04Å; I573-L640 HydrophobicContact CD1-CD2 3.69Å; I573-L640 HydrophobicContact CD1-CG 4.3Å
574	Y	96.6	Very high	95.1	Very high	17 Å²	17	19.9 Å²	19.9	7%	0.067	12%	0.117	C	C	.	.	I	π-helix	trans	-73.4	-55	-170.3	178	-103.2	0	0	0	113.2	F570 F576 N577 M578 Q622 T623 I643 F654	F570-Y574 HydrophobicContact CE1-CD1 4.24Å; F570-Y574 AromaticContact CE2-CD1 3.98Å; F570-Y574 HydrophobicContact CE2-CD1 3.98Å; F570-Y574 HydrophobicContact CE2-CD2 4.29Å; F570-Y574 AromaticContact CE2-CG 3.72Å; F570-Y574 HydrophobicContact CE2-CG 3.72Å; F570-Y574 AromaticContact CZ-CD1 3.56Å; F570-Y574 HydrophobicContact CZ-CD1 3.56Å; F570-Y574 HydrophobicContact CZ-CE1 4.1Å; F570-Y574 AromaticContact CZ-CG 3.82Å; F570-Y574 HydrophobicContact CZ-CG 3.82Å; F570-Y574 VanDerWaalsContact O-CB 3.22Å; F570-Y574 WeakPolarHBondContact O-CB 3.31Å; F570-Y574 PolarHBondContact O-N 3.5Å; Y574-F576 VanDerWaalsContact C-N 3.34Å; Y574-F576 PolarHBondContact O-N 3.39Å; Y574-N577 PolarHBondContact O-N 3.49Å; Y574-M578 HydrophobicContact CD2-CE 4.2Å; Y574-M578 HydrophobicContact CD2-CG 4.47Å; Y574-M578 HydrophobicContact CE2-CE 3.55Å; Y574-M578 HydrophobicContact CE2-CG 4.15Å; Y574-M578 WeakPolarHBondContact O-CG 3.48Å; Y574-M578 PolarHBondContact O-N 2.93Å; Y574-Q622 WeakPolarHBondContact OH-CG 3.48Å; Y574-Q622 PolarHBondContact OH-NE2 2.03Å; Y574-T623 HydrophobicContact CD1-CG2 4.07Å; Y574-T623 WeakPolarHBondContact CD1-OG1 3.41Å; Y574-T623 HydrophobicContact CE1-CG2 4.41Å; Y574-T623 WeakPolarHBondContact CE1-OG1 3.12Å; Y574-I643 HydrophobicContact CD2-CD1 3.82Å; Y574-I643 HydrophobicContact CE1-CD1 4.44Å; Y574-I643 HydrophobicContact CE2-CD1 3.17Å; Y574-I643 HydrophobicContact CE2-CG1 4.44Å; Y574-F654 PolarHBondContact OH-O 3.37Å
575	F	97.4	Very high	95.6	Very high	39 Å²	39	17.4 Å²	17.4	17%	0.171	10%	0.095	C	C	.	.	I	π-helix	trans	-59.5	-45.5	-178.2	166.7	-93.2	0	0	0	111.1	L571 M578 A579 W616 P619 A620 T623	L571-F575 WeakPolarHBondContact O-CB 3.47Å; L571-F575 PolarHBondContact O-N 3Å; F575-M578 PolarHBondContact O-N 3.35Å; F575-A579 WeakPolarHBondContact O-CB 3.33Å; F575-A579 PolarHBondContact O-N 3.2Å; F575-W616 HydrophobicContact CE1-CE3 4.31Å; F575-W616 HydrophobicContact CE1-CZ3 4.4Å; F575-W616 AromaticContact CZ-CE3 3.98Å; F575-W616 HydrophobicContact CZ-CE3 3.98Å; F575-P619 HydrophobicContact CD2-CB 3.67Å; F575-P619 HydrophobicContact CE2-CB 3.77Å; F575-P619 HydrophobicContact CG-CB 4.46Å; F575-A620 HydrophobicContact CE2-CB 4.04Å; F575-T623 HydrophobicContact CB-CG2 4.37Å
576	F	97.9	Very high	95.9	Very high	35 Å²	35	16.9 Å²	16.9	15%	0.154	9%	0.091	C	C	.	.	H	α-helix	trans	-72.7	-27.9	-179.4	-69.2	-80.4	0	0	0	113.4	C446 M449 I450 L572 Y574 A580	C446-F576 HydrophobicContact CB-CB 4.3Å; C446-F576 HydrophobicContact CB-CD1 4.39Å; M449-F576 HydrophobicContact CB-CB 4.35Å; M449-F576 HydrophobicContact CB-CD1 3.78Å; M449-F576 HydrophobicContact CB-CD2 3.68Å; M449-F576 HydrophobicContact CB-CE1 3.91Å; M449-F576 HydrophobicContact CB-CE2 3.82Å; M449-F576 HydrophobicContact CB-CG 3.65Å; M449-F576 HydrophobicContact CB-CZ 3.93Å; M449-F576 HydrophobicContact CE-CE2 3.94Å; M449-F576 HydrophobicContact CE-CZ 3.73Å; M449-F576 HydrophobicContact CG-CD1 4.05Å; M449-F576 HydrophobicContact CG-CD2 4.48Å; M449-F576 HydrophobicContact CG-CE1 3.74Å; M449-F576 HydrophobicContact CG-CE2 4.2Å; M449-F576 HydrophobicContact CG-CG 4.41Å; M449-F576 HydrophobicContact CG-CZ 3.82Å; I450-F576 HydrophobicContact CD1-CB 4.3Å; I450-F576 HydrophobicContact CG1-CB 3.72Å; L572-F576 HydrophobicContact CD2-CE2 4.25Å; L572-F576 WeakPolarHBondContact O-CD2 3.21Å; Y574-F576 VanDerWaalsContact C-N 3.34Å; Y574-F576 PolarHBondContact O-N 3.39Å; F576-A580 VanDerWaalsContact O-CB 3.25Å; F576-A580 WeakPolarHBondContact O-CB 3.5Å; F576-A580 PolarHBondContact O-N 2.93Å
577	N	96.7	Very high	96	Very high	26 Å²	26	16.9 Å²	16.9	14%	0.139	9%	0.091	C	C	.	.	H	α-helix	trans	-72.2	-38.8	173.3	-171.4	47.9	0	0	0	112.1	I450 I573 Y574 A580 S581	I450-N577 HydrophobicContact CD1-CB 3.98Å; I573-N577 WeakPolarHBondContact O-CB 3.37Å; I573-N577 PolarHBondContact O-N 3.04Å; I573-N577 VanDerWaalsContact O-N 3.08Å; Y574-N577 PolarHBondContact O-N 3.49Å; N577-A580 PolarHBondContact O-N 3.48Å; N577-S581 PolarHBondContact O-N 3.45Å; N577-S581 PolarHBondContact O-OG 3.14Å
578	M	97.1	Very high	96.2	Very high	1 Å²	1	16 Å²	16	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-66.6	-41.1	171.8	-66.3	-59.5	170.8	0	0	111.2	Y574 F575 S581 I582 P619 Q622 F654 P658 L659 Y662	Y574-M578 HydrophobicContact CD2-CE 4.2Å; Y574-M578 HydrophobicContact CD2-CG 4.47Å; Y574-M578 HydrophobicContact CE2-CE 3.55Å; Y574-M578 HydrophobicContact CE2-CG 4.15Å; Y574-M578 WeakPolarHBondContact O-CG 3.48Å; Y574-M578 PolarHBondContact O-N 2.93Å; F575-M578 PolarHBondContact O-N 3.35Å; M578-S581 WeakPolarHBondContact O-CB 3.48Å; M578-S581 PolarHBondContact O-N 2.73Å; M578-I582 WeakPolarHBondContact O-CG1 3.38Å; M578-I582 PolarHBondContact O-N 2.78Å; M578-P619 HydrophobicContact CB-CB 3.96Å; M578-P619 HydrophobicContact CB-CG 4.21Å; M578-Q622 PolarHBondContact SD-NE2 3.3Å; M578-Q622 VanDerWaalsContact SD-NE2 3.44Å; M578-F654 WeakPolarHBondContact CE-O 3.42Å; M578-P658 HydrophobicContact SD-CB 4.27Å; M578-L659 HydrophobicContact CE-CD1 4.48Å; M578-L659 HydrophobicContact CE-CD2 4.27Å; M578-L659 HydrophobicContact CE-CG 4.07Å; M578-L659 HydrophobicContact SD-CD2 4.06Å; M578-L659 HydrophobicContact SD-CG 4.35Å; M578-Y662 HydrophobicContact SD-CE2 4.35Å
579	A	97.7	Very high	96.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-63.9	-41.8	173.4	0	0	0	0	0	112.9	F575 S581 I582 W583 W616 P619	F575-A579 WeakPolarHBondContact O-CB 3.33Å; F575-A579 PolarHBondContact O-N 3.2Å; A579-S581 VanDerWaalsContact C-N 3.3Å; A579-S581 PolarHBondContact O-N 2.89Å; A579-I582 PolarHBondContact O-N 2.91Å; A579-W583 WeakPolarHBondContact O-CB 3.41Å; A579-W583 PolarHBondContact O-N 3.3Å; A579-W616 HydrophobicContact CB-CE3 3.93Å; A579-W616 HydrophobicContact CB-CZ3 3.6Å; A579-P619 HydrophobicContact CB-CB 4.32Å; A579-P619 HydrophobicContact CB-CG 3.9Å
580	A	96.6	Very high	96.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-59.6	-42	175.3	0	0	0	0	0	111.7	L443 C446 Y447 F576 N577 I582 W583 W584 Y711	L443-A580 HydrophobicContact CD1-CB 4.13Å; L443-A580 VanDerWaalsContact CD1-O 3.24Å; L443-A580 WeakPolarHBondContact CD1-O 3.33Å; C446-A580 HydrophobicContact CB-CB 3.84Å; Y447-A580 HydrophobicContact CD2-CB 4.46Å; Y447-A580 HydrophobicContact CE2-CB 3.74Å; F576-A580 VanDerWaalsContact O-CB 3.25Å; F576-A580 WeakPolarHBondContact O-CB 3.5Å; F576-A580 PolarHBondContact O-N 2.93Å; N577-A580 PolarHBondContact O-N 3.48Å; A580-I582 PolarHBondContact O-N 3.44Å; A580-W583 PolarHBondContact O-N 3.05Å; A580-W584 PolarHBondContact O-N 3.2Å; A580-Y711 PolarHBondContact O-OH 2.9Å
581	S	96.1	Very high	96.1	Very high	5 Å²	5	15.1 Å²	15.1	4%	0.035	8%	0.076	C	C	.	.	H	α-helix	trans	-58.8	-44.6	176.2	-58.5	0	0	0	0	112	N577 M578 A579 W584 V585 L659	N577-S581 PolarHBondContact O-N 3.45Å; N577-S581 PolarHBondContact O-OG 3.14Å; M578-S581 WeakPolarHBondContact O-CB 3.48Å; M578-S581 PolarHBondContact O-N 2.73Å; A579-S581 VanDerWaalsContact C-N 3.3Å; A579-S581 PolarHBondContact O-N 2.89Å; S581-W584 PolarHBondContact O-N 2.69Å; S581-V585 PolarHBondContact O-N 2.94Å; S581-V585 VanDerWaalsContact O-N 3.12Å; S581-L659 WeakPolarHBondContact OG-CD2 3.49Å
582	I	97	Very high	96	Very high	7 Å²	7	12.9 Å²	12.9	4%	0.036	6%	0.064	C	C	.	.	H	α-helix	trans	-71.9	-38.1	176.7	-58.4	170.9	0	0	0	111.5	M578 A579 A580 W584 V585 I586 I614 A615 L618 P619 Y662	M578-I582 WeakPolarHBondContact O-CG1 3.38Å; M578-I582 PolarHBondContact O-N 2.78Å; A579-I582 PolarHBondContact O-N 2.91Å; A580-I582 PolarHBondContact O-N 3.44Å; I582-W584 VanDerWaalsContact C-N 3.25Å; I582-W584 PolarHBondContact O-N 3.45Å; I582-V585 PolarHBondContact O-N 2.85Å; I582-V585 VanDerWaalsContact O-N 3.09Å; I582-I586 HydrophobicContact CG2-CD1 3.97Å; I582-I586 HydrophobicContact CG2-CG1 4.45Å; I582-I586 WeakPolarHBondContact O-CG1 3.36Å; I582-I586 PolarHBondContact O-N 2.85Å; I582-I614 HydrophobicContact CG2-CG2 4.2Å; I582-A615 HydrophobicContact CG2-CB 4.25Å; I582-L618 HydrophobicContact CD1-CB 3.77Å; I582-L618 HydrophobicContact CD1-CD1 4.23Å; I582-P619 HydrophobicContact CD1-CG 3.7Å; I582-Y662 HydrophobicContact CD1-CE1 4.15Å; I582-Y662 HydrophobicContact CD1-CE2 4.32Å; I582-Y662 HydrophobicContact CG1-CD1 4.12Å; I582-Y662 HydrophobicContact CG1-CD2 4.31Å; I582-Y662 HydrophobicContact CG1-CE1 3.76Å; I582-Y662 HydrophobicContact CG1-CE2 3.96Å; I582-Y662 HydrophobicContact CG1-CG 4.4Å
583	W	96.5	Very high	95.8	Very high	0 Å²	0	13 Å²	13	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-61.2	-33.7	174	-83.9	119.5	0	0	0	112.6	P439 Y442 L443 A579 A580 I586 L587 H612 A615 W616	P439-W583 HydrophobicContact CB-CE3 4.09Å; Y442-W583 HydrophobicContact CD2-CD2 4.32Å; Y442-W583 HydrophobicContact CD2-CE3 4.01Å; Y442-W583 AromaticContact CD2-CH2 3.49Å; Y442-W583 HydrophobicContact CD2-CH2 3.49Å; Y442-W583 VanDerWaalsContact CD2-CH2 3.49Å; Y442-W583 AromaticContact CD2-CZ2 3.8Å; Y442-W583 HydrophobicContact CD2-CZ2 3.8Å; Y442-W583 AromaticContact CD2-CZ3 3.59Å; Y442-W583 HydrophobicContact CD2-CZ3 3.59Å; Y442-W583 AromaticContact CE2-CH2 3.98Å; Y442-W583 HydrophobicContact CE2-CH2 3.98Å; Y442-W583 HydrophobicContact CE2-CZ2 4.48Å; Y442-W583 HydrophobicContact CE2-CZ3 4.28Å; Y442-W583 HydrophobicContact CG-CD2 4.35Å; Y442-W583 HydrophobicContact CG-CE3 4.48Å; Y442-W583 HydrophobicContact CG-CH2 4.13Å; Y442-W583 AromaticContact CG-CZ2 3.95Å; Y442-W583 HydrophobicContact CG-CZ2 3.95Å; Y442-W583 HydrophobicContact CG-CZ3 4.38Å; L443-W583 HydrophobicContact CD1-CB 4.2Å; A579-W583 WeakPolarHBondContact O-CB 3.41Å; A579-W583 PolarHBondContact O-N 3.3Å; A580-W583 PolarHBondContact O-N 3.05Å; W583-I586 HydrophobicContact CD2-CD1 4.46Å; W583-I586 HydrophobicContact CE3-CB 4.23Å; W583-I586 HydrophobicContact CE3-CD1 3.92Å; W583-I586 HydrophobicContact CE3-CG2 4.14Å; W583-I586 HydrophobicContact CZ3-CD1 4Å; W583-I586 HydrophobicContact CZ3-CG2 4.04Å; W583-I586 PolarHBondContact O-N 2.79Å; W583-L587 WeakPolarHBondContact O-CB 3.35Å; W583-L587 PolarHBondContact O-N 2.89Å; W583-H612 AromaticContact CH2-CE1 3.44Å; W583-H612 VanDerWaalsContact CH2-CE1 3.44Å; W583-H612 WeakPolarHBondContact CH2-CE1 3.5Å; W583-H612 AromaticContact CH2-ND1 3.43Å; W583-H612 WeakPolarHBondContact CH2-ND1 3.26Å; W583-H612 AromaticContact CZ2-CE1 3.68Å; W583-H612 AromaticContact CZ2-ND1 3.47Å; W583-H612 WeakPolarHBondContact CZ2-ND1 3.44Å; W583-A615 HydrophobicContact CD2-CB 3.95Å; W583-A615 VanDerWaalsContact CE2-CB 3.44Å; W583-A615 HydrophobicContact CE3-CB 4.47Å; W583-A615 HydrophobicContact CG-CB 4.43Å; W583-A615 HydrophobicContact CH2-CB 4.09Å; W583-A615 HydrophobicContact CZ2-CB 3.53Å; W583-W616 AromaticContact CE2-CZ2 3.93Å; W583-W616 AromaticContact CZ2-CE2 4Å; W583-W616 AromaticContact CZ2-CZ2 3.93Å; W583-W616 HydrophobicContact CZ2-CZ2 3.93Å; W583-W616 AromaticContact NE1-CE2 3.88Å; W583-W616 AromaticContact NE1-CH2 3.25Å; W583-W616 AromaticContact NE1-CZ2 3.36Å; W583-W616 AromaticContact NE1-CZ3 3.68Å
584	W	95.8	Very high	95.5	Very high	3 Å²	3	12.8 Å²	12.8	1%	0.011	7%	0.065	C	C	.	.	H	α-helix	trans	-71.2	-37.7	171	173.1	79.3	0	0	0	113	L443 A580 S581 I582 I586 L587 A588 L663 G666 I667 M670 G708 Y711 T712	L443-W584 HydrophobicContact CD1-CB 4.16Å; A580-W584 PolarHBondContact O-N 3.2Å; S581-W584 PolarHBondContact O-N 2.69Å; I582-W584 VanDerWaalsContact C-N 3.25Å; I582-W584 PolarHBondContact O-N 3.45Å; W584-I586 VanDerWaalsContact C-N 3.3Å; W584-I586 PolarHBondContact O-N 3.47Å; W584-L587 WeakPolarHBondContact O-CB 3.33Å; W584-L587 PolarHBondContact O-N 2.71Å; W584-A588 PolarHBondContact O-N 2.79Å; W584-L663 HydrophobicContact CH2-CD1 4.08Å; W584-L663 HydrophobicContact CZ3-CD1 4.21Å; W584-G666 VanDerWaalsContact CH2-C 3.43Å; W584-G666 VanDerWaalsContact CH2-CA 3.46Å; W584-I667 HydrophobicContact CH2-CG1 4.21Å; W584-M670 HydrophobicContact CZ2-CG 4.3Å; W584-G708 PolarHBondContact NE1-O 2.97Å; W584-Y711 HydrophobicContact CB-CD1 3.97Å; W584-Y711 HydrophobicContact CB-CE1 3.51Å; W584-Y711 HydrophobicContact CB-CE2 4.14Å; W584-Y711 HydrophobicContact CB-CG 4.48Å; W584-Y711 AromaticContact CD1-CD1 3.21Å; W584-Y711 AromaticContact CD1-CD2 3.9Å; W584-Y711 AromaticContact CD1-CE1 3.74Å; W584-Y711 AromaticContact CD1-CG 3.32Å; W584-Y711 AromaticContact CD2-CD1 3.51Å; W584-Y711 HydrophobicContact CD2-CD1 3.51Å; W584-Y711 AromaticContact CD2-CE1 3.66Å; W584-Y711 HydrophobicContact CD2-CE1 3.66Å; W584-Y711 HydrophobicContact CD2-CG 4.39Å; W584-Y711 AromaticContact CE2-CD1 3.64Å; W584-Y711 HydrophobicContact CE3-CD1 4.32Å; W584-Y711 HydrophobicContact CE3-CE1 4.18Å; W584-Y711 AromaticContact CG-CD1 3.27Å; W584-Y711 HydrophobicContact CG-CD1 3.27Å; W584-Y711 HydrophobicContact CG-CD2 4.32Å; W584-Y711 AromaticContact CG-CE1 3.32Å; W584-Y711 HydrophobicContact CG-CE1 3.32Å; W584-Y711 HydrophobicContact CG-CE2 4.34Å; W584-Y711 AromaticContact CG-CG 3.82Å; W584-Y711 HydrophobicContact CG-CG 3.82Å; W584-Y711 AromaticContact CG-CZ 3.89Å; W584-Y711 AromaticContact NE1-CD1 3.42Å; W584-Y711 AromaticContact NE1-CG 3.63Å; W584-T712 HydrophobicContact CH2-CG2 4Å; W584-T712 HydrophobicContact CZ2-CG2 3.47Å; W584-T712 VanDerWaalsContact CZ2-CG2 3.47Å
585	V	96.6	Very high	95	Very high	18 Å²	18	12.2 Å²	12.2	11%	0.109	6%	0.064	C	C	.	.	H	α-helix	trans	-61.6	-39.2	170.5	174.2	0	0	0	0	111.3	S581 I582 A588 L589 Y662 I665 F669	S581-V585 PolarHBondContact O-N 2.94Å; S581-V585 VanDerWaalsContact O-N 3.12Å; I582-V585 PolarHBondContact O-N 2.85Å; I582-V585 VanDerWaalsContact O-N 3.09Å; V585-A588 PolarHBondContact O-N 2.89Å; V585-L589 WeakPolarHBondContact O-CB 3.17Å; V585-L589 PolarHBondContact O-N 3.26Å; V585-Y662 VanDerWaalsContact CG2-O 3.24Å; V585-Y662 WeakPolarHBondContact CG2-O 3.44Å; V585-I665 HydrophobicContact CG1-CG2 3.75Å; V585-F669 HydrophobicContact CG1-CD2 4.23Å; V585-F669 HydrophobicContact CG1-CE2 3.97Å
586	I	96.3	Very high	94.4	Very high	9 Å²	9	11.1 Å²	11.1	5%	0.046	6%	0.064	C	C	.	.	H	α-helix	trans	-67.6	-37.3	174.4	-67.7	162.5	0	0	0	111.2	P439 I582 W583 W584 L589 T590 F611 A615	P439-I586 HydrophobicContact CB-CG2 4.39Å; P439-I586 HydrophobicContact CG-CG2 4.01Å; I582-I586 HydrophobicContact CG2-CD1 3.97Å; I582-I586 HydrophobicContact CG2-CG1 4.45Å; I582-I586 WeakPolarHBondContact O-CG1 3.36Å; I582-I586 PolarHBondContact O-N 2.85Å; W583-I586 HydrophobicContact CD2-CD1 4.46Å; W583-I586 HydrophobicContact CE3-CB 4.23Å; W583-I586 HydrophobicContact CE3-CD1 3.92Å; W583-I586 HydrophobicContact CE3-CG2 4.14Å; W583-I586 HydrophobicContact CZ3-CD1 4Å; W583-I586 HydrophobicContact CZ3-CG2 4.04Å; W583-I586 PolarHBondContact O-N 2.79Å; W584-I586 VanDerWaalsContact C-N 3.3Å; W584-I586 PolarHBondContact O-N 3.47Å; I586-L589 PolarHBondContact O-N 3.18Å; I586-T590 HydrophobicContact CG2-CG2 4.16Å; I586-T590 WeakPolarHBondContact O-CB 3.42Å; I586-T590 WeakPolarHBondContact O-CG2 3.42Å; I586-T590 PolarHBondContact O-N 3.11Å; I586-T590 PolarHBondContact O-OG1 3.14Å; I586-F611 HydrophobicContact CD1-CB 4.18Å; I586-F611 WeakPolarHBondContact CD1-O 3.38Å; I586-F611 HydrophobicContact CG2-CB 4.1Å; I586-F611 HydrophobicContact CG2-CD1 4.28Å; I586-F611 HydrophobicContact CG2-CD2 4.48Å; I586-F611 HydrophobicContact CG2-CG 4.05Å; I586-A615 HydrophobicContact CD1-CB 3.73Å
587	L	93.9	Very high	93.8	Very high	2 Å²	2	14.7 Å²	14.7	1%	0.01	8%	0.084	C	C	.	.	H	α-helix	trans	-60.6	-47.4	171.6	-177.2	64.7	0	0	0	110.8	P439 W583 W584 T590 W591 I704 Y707	P439-L587 HydrophobicContact CB-CB 4.02Å; P439-L587 HydrophobicContact CB-CD1 4.16Å; W583-L587 WeakPolarHBondContact O-CB 3.35Å; W583-L587 PolarHBondContact O-N 2.89Å; W584-L587 WeakPolarHBondContact O-CB 3.33Å; W584-L587 PolarHBondContact O-N 2.71Å; L587-T590 PolarHBondContact O-OG1 2.81Å; L587-W591 WeakPolarHBondContact O-CB 3.42Å; L587-W591 PolarHBondContact O-N 3.48Å; L587-I704 HydrophobicContact CD1-CG2 4.03Å; L587-Y707 HydrophobicContact CD2-CD1 4.17Å; L587-Y707 HydrophobicContact CD2-CE1 4.25Å
588	A	94.8	Very high	93.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-62.3	-42.6	177.4	0	0	0	0	0	112.5	W584 V585 L592 F669 M670	W584-A588 PolarHBondContact O-N 2.79Å; V585-A588 PolarHBondContact O-N 2.89Å; A588-L592 WeakPolarHBondContact O-CB 3.37Å; A588-L592 PolarHBondContact O-N 3.47Å; A588-F669 HydrophobicContact CB-CB 3.91Å; A588-M670 HydrophobicContact CB-CG 3.78Å; A588-M670 HydrophobicContact CB-SD 3.63Å
589	L	95.1	Very high	92.9	Very high	47 Å²	47	25 Å²	25	25%	0.246	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-52.8	176.5	176.6	60.3	0	0	0	112.1	V585 I586 W591 L592 L593 F611 F669	V585-L589 WeakPolarHBondContact O-CB 3.17Å; V585-L589 PolarHBondContact O-N 3.26Å; I586-L589 PolarHBondContact O-N 3.18Å; L589-W591 VanDerWaalsContact C-N 3.27Å; L589-W591 PolarHBondContact O-N 3.43Å; L589-L592 WeakPolarHBondContact O-CB 3.25Å; L589-L592 PolarHBondContact O-N 3.47Å; L589-L592 VanDerWaalsContact O-N 3.12Å; L589-L593 HydrophobicContact CD1-CD1 4.47Å; L589-L593 HydrophobicContact CD1-CG 4.33Å; L589-L593 HydrophobicContact CG-CD1 4.37Å; L589-L593 WeakPolarHBondContact O-CG 3.4Å; L589-L593 PolarHBondContact O-N 3.01Å; L589-F611 HydrophobicContact CD2-CE1 4.05Å; L589-F669 HydrophobicContact CB-CD2 3.86Å; L589-F669 HydrophobicContact CB-CE2 3.93Å; L589-F669 HydrophobicContact CD1-CD2 4.44Å; L589-F669 HydrophobicContact CD1-CE2 4.14Å; L589-F669 HydrophobicContact CD1-CZ 4.19Å; L589-F669 HydrophobicContact CG-CE2 4.44Å
590	T	94.3	Very high	92.4	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-66	-32.8	-178.6	55.1	0	0	0	0	111.9	Y435 I586 L587 A594 I604 F611	Y435-T590 HydrophobicContact CD1-CG2 4.19Å; Y435-T590 HydrophobicContact CE1-CG2 4.48Å; I586-T590 HydrophobicContact CG2-CG2 4.16Å; I586-T590 WeakPolarHBondContact O-CB 3.42Å; I586-T590 WeakPolarHBondContact O-CG2 3.42Å; I586-T590 PolarHBondContact O-N 3.11Å; I586-T590 PolarHBondContact O-OG1 3.14Å; L587-T590 PolarHBondContact O-OG1 2.81Å; T590-A594 WeakPolarHBondContact O-CB 3.49Å; T590-A594 PolarHBondContact O-N 2.87Å; T590-A594 VanDerWaalsContact O-N 3.07Å; T590-I604 HydrophobicContact CG2-CG2 3.66Å; T590-F611 HydrophobicContact CG2-CD2 4.36Å; T590-F611 HydrophobicContact CG2-CE2 3.79Å; T590-F611 HydrophobicContact CG2-CZ 3.91Å
591	W	93.6	Very high	92	Very high	1 Å²	1	29.2 Å²	29.2	0%	0.004	16%	0.162	C	C	.	.	H	α-helix	trans	-64.1	-46.8	168.7	179.4	78.8	0	0	0	112.1	L587 L589 L593 A594 A595 M670 G673 F674 L677 I701 I704 G705	L587-W591 WeakPolarHBondContact O-CB 3.42Å; L587-W591 PolarHBondContact O-N 3.48Å; L589-W591 VanDerWaalsContact C-N 3.27Å; L589-W591 PolarHBondContact O-N 3.43Å; W591-L593 PolarHBondContact O-N 3.5Å; W591-A594 PolarHBondContact O-N 3.03Å; W591-A595 HydrophobicContact CD2-CB 4.44Å; W591-A595 WeakPolarHBondContact O-CB 3.17Å; W591-A595 PolarHBondContact O-N 3.04Å; W591-M670 HydrophobicContact CD2-CE 4.39Å; W591-M670 HydrophobicContact CD2-SD 4.41Å; W591-M670 HydrophobicContact CE3-CE 4Å; W591-M670 HydrophobicContact CE3-SD 3.76Å; W591-M670 HydrophobicContact CH2-CE 4.26Å; W591-M670 HydrophobicContact CZ3-CE 3.94Å; W591-M670 WeakPolarHBondContact CZ3-O 3.21Å; W591-M670 HydrophobicContact CZ3-SD 4.07Å; W591-G673 VanDerWaalsContact CH2-C 3.48Å; W591-G673 VanDerWaalsContact CZ3-CA 3.49Å; W591-F674 HydrophobicContact CH2-CB 4.29Å; W591-F674 HydrophobicContact CH2-CD1 4.29Å; W591-F674 AromaticContact CH2-CD2 3.39Å; W591-F674 HydrophobicContact CH2-CD2 3.39Å; W591-F674 AromaticContact CH2-CE2 3.63Å; W591-F674 HydrophobicContact CH2-CE2 3.63Å; W591-F674 AromaticContact CH2-CG 3.75Å; W591-F674 HydrophobicContact CH2-CG 3.75Å; W591-F674 HydrophobicContact CH2-CZ 4.21Å; W591-F674 HydrophobicContact CZ2-CD2 4.21Å; W591-F674 HydrophobicContact CZ2-CE2 4.04Å; W591-F674 HydrophobicContact CZ2-CZ 4.23Å; W591-F674 HydrophobicContact CZ3-CD2 4.11Å; W591-F674 HydrophobicContact CZ3-CE2 4.46Å; W591-L677 HydrophobicContact CH2-CD1 3.93Å; W591-L677 HydrophobicContact CZ2-CD1 3.37Å; W591-I701 PolarHBondContact NE1-O 3.32Å; W591-I704 HydrophobicContact CB-CG2 4.35Å; W591-I704 HydrophobicContact CG-CG2 4.19Å; W591-G705 VanDerWaalsContact CZ2-CA 3.43Å
592	L	93.4	Very high	91.7	Very high	23 Å²	23	35.2 Å²	35.2	12%	0.12	19%	0.189	C	C	.	.	H	α-helix	trans	-57.6	-44.5	174	165.7	60.9	0	0	0	112.3	A588 L589 A595 G596 F669 I672	A588-L592 WeakPolarHBondContact O-CB 3.37Å; A588-L592 PolarHBondContact O-N 3.47Å; L589-L592 WeakPolarHBondContact O-CB 3.25Å; L589-L592 PolarHBondContact O-N 3.47Å; L589-L592 VanDerWaalsContact O-N 3.12Å; L592-A595 PolarHBondContact O-N 2.96Å; L592-G596 WeakPolarHBondContact O-CA 3.37Å; L592-G596 PolarHBondContact O-N 3.08Å; L592-F669 HydrophobicContact CD2-CB 4.12Å; L592-F669 HydrophobicContact CD2-CD1 3.83Å; L592-F669 HydrophobicContact CD2-CG 4.21Å; L592-I672 HydrophobicContact CD1-CB 4.26Å; L592-I672 HydrophobicContact CD1-CG2 3.77Å; L592-I672 HydrophobicContact CD2-CG2 4.42Å
593	L	93.1	Very high	91.5	Very high	23 Å²	23	36.6 Å²	36.6	12%	0.12	20%	0.202	C	C	.	.	H	α-helix	trans	-61.1	-46.1	177.1	-66.2	175.5	0	0	0	111.7	L589 W591 L597 K598 W599 I604	L589-L593 HydrophobicContact CD1-CD1 4.47Å; L589-L593 HydrophobicContact CD1-CG 4.33Å; L589-L593 HydrophobicContact CG-CD1 4.37Å; L589-L593 WeakPolarHBondContact O-CG 3.4Å; L589-L593 PolarHBondContact O-N 3.01Å; W591-L593 PolarHBondContact O-N 3.5Å; L593-L597 HydrophobicContact CD2-CD1 3.8Å; L593-L597 CarbonylContact O-C 3.39Å; L593-L597 WeakPolarHBondContact O-CA 3.46Å; L593-L597 WeakPolarHBondContact O-CB 3.46Å; L593-L597 PolarHBondContact O-N 3.12Å; L593-K598 PolarHBondContact O-N 3.06Å; L593-K598 VanDerWaalsContact O-N 3.11Å; L593-W599 HydrophobicContact CB-CB 4.29Å; L593-W599 HydrophobicContact CB-CD2 4.34Å; L593-W599 HydrophobicContact CB-CE3 4.4Å; L593-W599 HydrophobicContact CB-CG 4.3Å; L593-W599 HydrophobicContact CD1-CE3 4.06Å; L593-W599 HydrophobicContact CD1-CZ3 4.17Å; L593-W599 HydrophobicContact CD2-CD2 4.38Å; L593-W599 HydrophobicContact CD2-CE3 4.5Å; L593-W599 PolarHBondContact O-N 3Å; L593-I604 HydrophobicContact CB-CD1 4.28Å; L593-I604 HydrophobicContact CB-CG1 4.42Å
594	A	90	Very high	91.4	Very high	12 Å²	12	36.6 Å²	36.6	10%	0.099	20%	0.202	C	C	.	.	H	α-helix	trans	-69.3	-37.9	177.8	0	0	0	0	0	113.1	P436 T590 W591 K598 I604	P436-A594 HydrophobicContact CB-CB 4.32Å; P436-A594 HydrophobicContact CG-CB 3.88Å; T590-A594 WeakPolarHBondContact O-CB 3.49Å; T590-A594 PolarHBondContact O-N 2.87Å; T590-A594 VanDerWaalsContact O-N 3.07Å; W591-A594 PolarHBondContact O-N 3.03Å; A594-K598 WeakPolarHBondContact O-CA 3.32Å; A594-I604 HydrophobicContact CB-CD1 4.03Å
595	A	86.2	Confident	91.3	Very high	5 Å²	5	39 Å²	39	4%	0.041	22%	0.219	C	C	.	.	H	α-helix	trans	-88	-40.9	-170.1	0	0	0	0	0	113.8	W591 L592 L677 I701	W591-A595 HydrophobicContact CD2-CB 4.44Å; W591-A595 WeakPolarHBondContact O-CB 3.17Å; W591-A595 PolarHBondContact O-N 3.04Å; L592-A595 PolarHBondContact O-N 2.96Å; A595-L677 HydrophobicContact CB-CD1 3.99Å; A595-L677 HydrophobicContact CB-CD2 3.9Å; A595-L677 HydrophobicContact CB-CG 3.82Å; A595-I701 HydrophobicContact CB-CG2 3.64Å
596	G	83.7	Confident	91.2	Very high	17 Å²	17	45 Å²	45	18%	0.175	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-47.6	-178.3	0	0	0	0	0	113.3	L592	L592-G596 WeakPolarHBondContact O-CA 3.37Å; L592-G596 PolarHBondContact O-N 3.08Å
597	L	85.6	Confident	91.1	Very high	109 Å²	109	50 Å²	50	57%	0.571	26%	0.263	S	S	*	.	S	Bend	trans	-89.9	-1.2	-180	-55.9	-172.3	0	0	0	113.8	L593 W599	L593-L597 HydrophobicContact CD2-CD1 3.8Å; L593-L597 CarbonylContact O-C 3.39Å; L593-L597 WeakPolarHBondContact O-CA 3.46Å; L593-L597 WeakPolarHBondContact O-CB 3.46Å; L593-L597 PolarHBondContact O-N 3.12Å; L597-W599 HydrophobicContact CB-CG 4.5Å; L597-W599 PolarHBondContact O-N 3.31Å
598	K	85.7	Confident	91.1	Very high	154 Å²	154	51.4 Å²	51.4	67%	0.67	27%	0.272	S	S	*	.			trans	59.3	26.7	179.2	-53.3	174.6	-177	169.7	0	114.4	L593 A594 G600	L593-K598 PolarHBondContact O-N 3.06Å; L593-K598 VanDerWaalsContact O-N 3.11Å; A594-K598 WeakPolarHBondContact O-CA 3.32Å; K598-G600 PolarHBondContact O-N 3.32Å
599	W	89.6	Confident	91.2	Very high	90 Å²	90	59.1 Å²	59.1	34%	0.341	31%	0.309	S	S	.	.			trans	-65	132.6	179.2	-77.4	27	0	0	0	111.6	L593 L597 A603 I604 Y607	L593-W599 HydrophobicContact CB-CB 4.29Å; L593-W599 HydrophobicContact CB-CD2 4.34Å; L593-W599 HydrophobicContact CB-CE3 4.4Å; L593-W599 HydrophobicContact CB-CG 4.3Å; L593-W599 HydrophobicContact CD1-CE3 4.06Å; L593-W599 HydrophobicContact CD1-CZ3 4.17Å; L593-W599 HydrophobicContact CD2-CD2 4.38Å; L593-W599 HydrophobicContact CD2-CE3 4.5Å; L593-W599 PolarHBondContact O-N 3Å; L597-W599 HydrophobicContact CB-CG 4.5Å; L597-W599 PolarHBondContact O-N 3.31Å; W599-A603 HydrophobicContact CB-CB 4.45Å; W599-A603 HydrophobicContact CD2-CB 4.47Å; W599-A603 HydrophobicContact CE3-CB 4.21Å; W599-I604 HydrophobicContact CB-CD1 4.23Å; W599-I604 HydrophobicContact CB-CG1 3.95Å; W599-I604 HydrophobicContact CE3-CG1 4.01Å; W599-Y607 HydrophobicContact CH2-CD2 4.5Å; W599-Y607 AromaticContact CH2-CE2 3.81Å; W599-Y607 HydrophobicContact CH2-CE2 3.81Å; W599-Y607 AromaticContact CZ3-CD2 3.87Å; W599-Y607 HydrophobicContact CZ3-CD2 3.87Å; W599-Y607 AromaticContact CZ3-CE2 3.56Å; W599-Y607 HydrophobicContact CZ3-CE2 3.56Å
600	G	86.3	Confident	91.3	Very high	44 Å²	44	60.6 Å²	60.6	45%	0.454	32%	0.319	S	S	.	.			trans	-73.8	162.4	173.1	0	0	0	0	0	113	K598 E602 A603 I604	K598-G600 PolarHBondContact O-N 3.32Å; G600-E602 VanDerWaalsContact C-N 3.27Å; G600-E602 PolarHBondContact O-N 3.43Å; G600-A603 PolarHBondContact O-N 3.39Å; G600-I604 PolarHBondContact O-N 2.94Å
601	S	88.1	Confident	91.4	Very high	44 Å²	44	61.4 Å²	61.4	31%	0.308	32%	0.323	S	S	.	.	H	α-helix	trans	-57	-39.1	-179.3	58.3	0	0	0	0	112.7	Q434 Y435 I604 S605	Q434-S601 PolarHBondContact OE1-OG 3.17Å; Q434-S601 VanDerWaalsContact OE1-OG 3.06Å; Y435-S601 WeakPolarHBondContact O-CB 3.45Å; S601-I604 PolarHBondContact O-N 3.33Å; S601-S605 WeakPolarHBondContact O-CB 3.33Å; S601-S605 PolarHBondContact O-N 3.38Å
602	E	91	Very high	91.6	Very high	132 Å²	132	63.6 Å²	63.6	62%	0.617	33%	0.333	S	S	*	.	H	α-helix	trans	-62.8	-41.3	175.7	-164.4	-156.8	124.1	0	0	112.7	G600 S605 K606	G600-E602 VanDerWaalsContact C-N 3.27Å; G600-E602 PolarHBondContact O-N 3.43Å; E602-S605 PolarHBondContact O-N 3.48Å; E602-K606 WeakPolarHBondContact O-CG 3.48Å; E602-K606 PolarHBondContact O-N 3.17Å; E602-K606 WeakPolarHBondContact OE1-CE 3.35Å; E602-K606 IonicContact OE1-NZ 2.78Å; E602-K606 PolarHBondContact OE1-NZ 3.46Å
603	A	92.7	Very high	91.8	Very high	35 Å²	35	69.2 Å²	69.2	29%	0.289	36%	0.357	S	S	.	.	H	α-helix	trans	-65.5	-43.3	179.8	0	0	0	0	0	111.4	W599 G600 Y607	W599-A603 HydrophobicContact CB-CB 4.45Å; W599-A603 HydrophobicContact CD2-CB 4.47Å; W599-A603 HydrophobicContact CE3-CB 4.21Å; G600-A603 PolarHBondContact O-N 3.39Å; A603-Y607 WeakPolarHBondContact O-CD2 3.26Å
604	I	94	Very high	91.9	Very high	0 Å²	0	71.6 Å²	71.6	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-67	-40	174.6	-59.4	172	0	0	0	110.5	Y435 T590 L593 A594 W599 G600 S601 K606 Y607 F611	Y435-I604 HydrophobicContact CD1-CG2 3.71Å; Y435-I604 HydrophobicContact CD2-CG2 4.48Å; Y435-I604 HydrophobicContact CE1-CG2 4.46Å; Y435-I604 HydrophobicContact CG-CB 4.37Å; Y435-I604 HydrophobicContact CG-CG2 3.72Å; T590-I604 HydrophobicContact CG2-CG2 3.66Å; L593-I604 HydrophobicContact CB-CD1 4.28Å; L593-I604 HydrophobicContact CB-CG1 4.42Å; A594-I604 HydrophobicContact CB-CD1 4.03Å; W599-I604 HydrophobicContact CB-CD1 4.23Å; W599-I604 HydrophobicContact CB-CG1 3.95Å; W599-I604 HydrophobicContact CE3-CG1 4.01Å; G600-I604 PolarHBondContact O-N 2.94Å; S601-I604 PolarHBondContact O-N 3.33Å; I604-K606 PolarHBondContact O-N 3.25Å; I604-Y607 PolarHBondContact O-N 3.3Å; I604-F611 HydrophobicContact CG2-CE2 3.88Å; I604-F611 HydrophobicContact CG2-CZ 4.44Å
605	S	92.7	Very high	92.3	Very high	55 Å²	55	71 Å²	71	39%	0.385	36%	0.364	S	S	.	.	H	α-helix	trans	-63.9	-20.8	-178.1	-168.1	0	0	0	0	114.2	S601 E602 Y607 S608	S601-S605 WeakPolarHBondContact O-CB 3.33Å; S601-S605 PolarHBondContact O-N 3.38Å; E602-S605 PolarHBondContact O-N 3.48Å; S605-Y607 PolarHBondContact O-N 2.97Å; S605-S608 VanDerWaalsContact O-CB 3.32Å; S605-S608 WeakPolarHBondContact O-CB 3.27Å; S605-S608 PolarHBondContact O-N 2.81Å; S605-S608 PolarHBondContact O-OG 3.35Å
606	K	94.9	Very high	92.8	Very high	143 Å²	143	74.4 Å²	74.4	62%	0.622	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	-21.9	173.5	-72.2	166	-171.6	172.7	0	112.8	E602 I604	E602-K606 WeakPolarHBondContact O-CG 3.48Å; E602-K606 PolarHBondContact O-N 3.17Å; E602-K606 WeakPolarHBondContact OE1-CE 3.35Å; E602-K606 IonicContact OE1-NZ 2.78Å; E602-K606 PolarHBondContact OE1-NZ 3.46Å; I604-K606 PolarHBondContact O-N 3.25Å
607	Y	95.3	Very high	93.4	Very high	115 Å²	115	75.9 Å²	75.9	45%	0.451	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	5.3	177.8	-62.8	-86	0	0	0	113.7	W599 A603 I604 S605 Q609 V610 F611	W599-Y607 HydrophobicContact CH2-CD2 4.5Å; W599-Y607 AromaticContact CH2-CE2 3.81Å; W599-Y607 HydrophobicContact CH2-CE2 3.81Å; W599-Y607 AromaticContact CZ3-CD2 3.87Å; W599-Y607 HydrophobicContact CZ3-CD2 3.87Å; W599-Y607 AromaticContact CZ3-CE2 3.56Å; W599-Y607 HydrophobicContact CZ3-CE2 3.56Å; A603-Y607 WeakPolarHBondContact O-CD2 3.26Å; I604-Y607 PolarHBondContact O-N 3.3Å; S605-Y607 PolarHBondContact O-N 2.97Å; Y607-Q609 VanDerWaalsContact C-N 3.29Å; Y607-Q609 PolarHBondContact O-N 3.15Å; Y607-V610 WeakPolarHBondContact O-CB 3.47Å; Y607-V610 PolarHBondContact O-N 3.18Å; Y607-F611 WeakPolarHBondContact O-CD2 3.11Å; Y607-F611 PolarHBondContact O-N 2.76Å; Y607-F611 VanDerWaalsContact O-N 3.14Å
608	S	93.9	Very high	93.9	Very high	30 Å²	30	74.5 Å²	74.5	21%	0.21	38%	0.376	C	S	.	.	H	α-helix	trans	-52.7	-42.2	-176.5	59.3	0	0	0	0	113.9	Y435 S605 V610 F611 H612	Y435-S608 VanDerWaalsContact OH-CB 3.26Å; Y435-S608 WeakPolarHBondContact OH-CB 3.44Å; S605-S608 VanDerWaalsContact O-CB 3.32Å; S605-S608 WeakPolarHBondContact O-CB 3.27Å; S605-S608 PolarHBondContact O-N 2.81Å; S605-S608 PolarHBondContact O-OG 3.35Å; S608-V610 VanDerWaalsContact C-N 3.32Å; S608-V610 PolarHBondContact O-N 3.43Å; S608-F611 PolarHBondContact O-N 2.97Å; S608-H612 PolarHBondContact O-CD2 2.85Å; S608-H612 VanDerWaalsContact O-CD2 3.24Å; S608-H612 PolarHBondContact O-N 3.3Å
609	Q	95.8	Very high	94.5	Very high	163 Å²	163	67.1 Å²	67.1	76%	0.762	34%	0.344	S	S	*	.	H	α-helix	trans	-60.6	-39.6	177.4	-64.6	179.2	-5.4	0	0	112.3	Y607 H612 F613	Y607-Q609 VanDerWaalsContact C-N 3.29Å; Y607-Q609 PolarHBondContact O-N 3.15Å; Q609-H612 PolarHBondContact O-N 3.36Å; Q609-F613 WeakPolarHBondContact O-CB 3.14Å; Q609-F613 PolarHBondContact O-N 3.42Å
610	V	97	Very high	94.9	Very high	77 Å²	77	65 Å²	65	47%	0.467	35%	0.346	S	S	.	.	H	α-helix	trans	-69.2	-43.3	178.7	-175.9	0	0	0	0	110.6	Y607 S608 H612 F613 I614	Y607-V610 WeakPolarHBondContact O-CB 3.47Å; Y607-V610 PolarHBondContact O-N 3.18Å; S608-V610 VanDerWaalsContact C-N 3.32Å; S608-V610 PolarHBondContact O-N 3.43Å; V610-H612 VanDerWaalsContact C-N 3.34Å; V610-H612 PolarHBondContact O-N 3.12Å; V610-F613 PolarHBondContact O-N 2.9Å; V610-I614 HydrophobicContact CG1-CD1 3.92Å; V610-I614 WeakPolarHBondContact O-CG1 3.32Å; V610-I614 PolarHBondContact O-N 2.03Å
611	F	97	Very high	95.4	Very high	17 Å²	17	66.2 Å²	66.2	8%	0.075	35%	0.347	C	S	.	.	H	α-helix	trans	-59.7	-44.3	175	-58.6	-38.9	0	0	0	111.7	Y435 I586 L589 T590 I604 Y607 S608 I614 A615	Y435-F611 HydrophobicContact CE1-CD2 4.06Å; Y435-F611 HydrophobicContact CE1-CE2 4.41Å; I586-F611 HydrophobicContact CD1-CB 4.18Å; I586-F611 WeakPolarHBondContact CD1-O 3.38Å; I586-F611 HydrophobicContact CG2-CB 4.1Å; I586-F611 HydrophobicContact CG2-CD1 4.28Å; I586-F611 HydrophobicContact CG2-CD2 4.48Å; I586-F611 HydrophobicContact CG2-CG 4.05Å; L589-F611 HydrophobicContact CD2-CE1 4.05Å; T590-F611 HydrophobicContact CG2-CD2 4.36Å; T590-F611 HydrophobicContact CG2-CE2 3.79Å; T590-F611 HydrophobicContact CG2-CZ 3.91Å; I604-F611 HydrophobicContact CG2-CE2 3.88Å; I604-F611 HydrophobicContact CG2-CZ 4.44Å; Y607-F611 WeakPolarHBondContact O-CD2 3.11Å; Y607-F611 PolarHBondContact O-N 2.76Å; Y607-F611 VanDerWaalsContact O-N 3.14Å; S608-F611 PolarHBondContact O-N 2.97Å; F611-I614 PolarHBondContact O-N 2.8Å; F611-A615 VanDerWaalsContact O-CB 3.29Å; F611-A615 WeakPolarHBondContact O-CB 3.47Å; F611-A615 PolarHBondContact O-N 2.84Å
612	H	96.8	Very high	95.7	Very high	47 Å²	47	65.3 Å²	65.3	22%	0.218	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-41.3	176.3	-85	-65.1	0	0	0	113.5	Y442 W583 S608 Q609 V610 W616	Y442-H612 AromaticContact CD2-CE1 3.93Å; Y442-H612 AromaticContact CE1-CE1 3.89Å; Y442-H612 AromaticContact CE2-CE1 3.32Å; Y442-H612 WeakPolarHBondContact CE2-CE1 3.47Å; Y442-H612 AromaticContact CE2-NE2 3.46Å; Y442-H612 WeakPolarHBondContact CE2-NE2 3.23Å; Y442-H612 AromaticContact CZ-CE1 3.31Å; Y442-H612 AromaticContact CZ-NE2 3.54Å; Y442-H612 PolarHBondContact OH-CE1 2.87Å; Y442-H612 PolarHBondContact OH-NE2 3.16Å; W583-H612 AromaticContact CH2-CE1 3.44Å; W583-H612 VanDerWaalsContact CH2-CE1 3.44Å; W583-H612 WeakPolarHBondContact CH2-CE1 3.5Å; W583-H612 AromaticContact CH2-ND1 3.43Å; W583-H612 WeakPolarHBondContact CH2-ND1 3.26Å; W583-H612 AromaticContact CZ2-CE1 3.68Å; W583-H612 AromaticContact CZ2-ND1 3.47Å; W583-H612 WeakPolarHBondContact CZ2-ND1 3.44Å; S608-H612 PolarHBondContact O-CD2 2.85Å; S608-H612 VanDerWaalsContact O-CD2 3.24Å; S608-H612 PolarHBondContact O-N 3.3Å; Q609-H612 PolarHBondContact O-N 3.36Å; V610-H612 VanDerWaalsContact C-N 3.34Å; V610-H612 PolarHBondContact O-N 3.12Å; H612-W616 AromaticContact ND1-NE1 3.51Å; H612-W616 PolarHBondContact O-N 3.2Å
613	F	97.7	Very high	96	Very high	141 Å²	141	59.2 Å²	59.2	62%	0.618	31%	0.31	S	S	*	.	H	α-helix	trans	-60.7	-48.3	176.4	-179.6	-100.8	0	0	0	111.2	Q609 V610 S617	Q609-F613 WeakPolarHBondContact O-CB 3.14Å; Q609-F613 PolarHBondContact O-N 3.42Å; V610-F613 PolarHBondContact O-N 2.9Å; F613-S617 WeakPolarHBondContact CE2-OG 3.39Å; F613-S617 WeakPolarHBondContact O-CB 3.37Å; F613-S617 PolarHBondContact O-N 2.8Å; F613-S617 PolarHBondContact O-OG 3.26Å
614	I	96.9	Very high	96.1	Very high	73 Å²	73	59.8 Å²	59.8	37%	0.374	32%	0.315	S	S	.	.	H	α-helix	trans	-65.4	-45.6	-179.6	-64.8	169.7	0	0	0	111.5	I582 V610 F611 W616 L618	I582-I614 HydrophobicContact CG2-CG2 4.2Å; V610-I614 HydrophobicContact CG1-CD1 3.92Å; V610-I614 WeakPolarHBondContact O-CG1 3.32Å; V610-I614 PolarHBondContact O-N 2.03Å; F611-I614 PolarHBondContact O-N 2.8Å; I614-W616 VanDerWaalsContact C-N 3.3Å; I614-W616 PolarHBondContact O-N 3.1Å; I614-L618 HydrophobicContact CG2-CD1 3.85Å; I614-L618 PolarHBondContact O-N 3.37Å
615	A	96.9	Very high	96.1	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-64.5	-26.8	-177.3	0	0	0	0	0	115	I582 W583 I586 F611 P619	I582-A615 HydrophobicContact CG2-CB 4.25Å; W583-A615 HydrophobicContact CD2-CB 3.95Å; W583-A615 VanDerWaalsContact CE2-CB 3.44Å; W583-A615 HydrophobicContact CE3-CB 4.47Å; W583-A615 HydrophobicContact CG-CB 4.43Å; W583-A615 HydrophobicContact CH2-CB 4.09Å; W583-A615 HydrophobicContact CZ2-CB 3.53Å; I586-A615 HydrophobicContact CD1-CB 3.73Å; F611-A615 VanDerWaalsContact O-CB 3.29Å; F611-A615 WeakPolarHBondContact O-CB 3.47Å; F611-A615 PolarHBondContact O-N 2.84Å; A615-P619 VanDerWaalsContact O-CD 3.28Å; A615-P619 WeakPolarHBondContact O-CD 3.48Å; A615-P619 VanDerWaalsContact O-CG 3.3Å; A615-P619 WeakPolarHBondContact O-CG 3.33Å
616	W	97.4	Very high	96.1	Very high	76 Å²	76	61.2 Å²	61.2	29%	0.288	32%	0.318	S	S	.	.	H	α-helix	trans	-104.7	-35.8	-179.4	-57.7	133.2	0	0	0	113.4	F575 A579 W583 H612 I614 A620	F575-W616 HydrophobicContact CE1-CE3 4.31Å; F575-W616 HydrophobicContact CE1-CZ3 4.4Å; F575-W616 AromaticContact CZ-CE3 3.98Å; F575-W616 HydrophobicContact CZ-CE3 3.98Å; A579-W616 HydrophobicContact CB-CE3 3.93Å; A579-W616 HydrophobicContact CB-CZ3 3.6Å; W583-W616 AromaticContact CE2-CZ2 3.93Å; W583-W616 AromaticContact CZ2-CE2 4Å; W583-W616 AromaticContact CZ2-CZ2 3.93Å; W583-W616 HydrophobicContact CZ2-CZ2 3.93Å; W583-W616 AromaticContact NE1-CE2 3.88Å; W583-W616 AromaticContact NE1-CH2 3.25Å; W583-W616 AromaticContact NE1-CZ2 3.36Å; W583-W616 AromaticContact NE1-CZ3 3.68Å; H612-W616 AromaticContact ND1-NE1 3.51Å; H612-W616 PolarHBondContact O-N 3.2Å; I614-W616 VanDerWaalsContact C-N 3.3Å; I614-W616 PolarHBondContact O-N 3.1Å; W616-A620 WeakPolarHBondContact O-CB 3.23Å; W616-A620 PolarHBondContact O-N 2.04Å; W616-A620 VanDerWaalsContact O-N 3.12Å
617	S	96.8	Very high	95.9	Very high	48 Å²	48	56.7 Å²	56.7	34%	0.336	30%	0.3	S	S	.	.	H	α-helix	trans	-71.4	-37.2	-177.3	-62.8	0	0	0	0	113.5	F613 A620 S621	F613-S617 WeakPolarHBondContact CE2-OG 3.39Å; F613-S617 WeakPolarHBondContact O-CB 3.37Å; F613-S617 PolarHBondContact O-N 2.8Å; F613-S617 PolarHBondContact O-OG 3.26Å; S617-A620 PolarHBondContact O-N 2.97Å; S617-S621 PolarHBondContact O-N 2.98Å; S617-S621 PolarHBondContact O-OG 3.06Å
618	L	96.5	Very high	95.7	Very high	80 Å²	80	58 Å²	58	42%	0.419	31%	0.314	S	S	.	.	H	α-helix	trans	-69.5	-46.7	179.7	-66.1	177.9	0	0	0	112.7	I582 I614 A620 S621 Q622	I582-L618 HydrophobicContact CD1-CB 3.77Å; I582-L618 HydrophobicContact CD1-CD1 4.23Å; I614-L618 HydrophobicContact CG2-CD1 3.85Å; I614-L618 PolarHBondContact O-N 3.37Å; L618-A620 VanDerWaalsContact C-N 3.29Å; L618-A620 PolarHBondContact O-N 3.43Å; L618-S621 PolarHBondContact O-N 3.27Å; L618-S621 PolarHBondContact O-OG 3.3Å; L618-S621 VanDerWaalsContact O-OG 3.12Å; L618-Q622 VanDerWaalsContact O-CB 3.26Å; L618-Q622 WeakPolarHBondContact O-CB 3.46Å; L618-Q622 PolarHBondContact O-N 3.06Å
619	P	97.3	Very high	95.5	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-64.8	-34.4	173.1	-23.6	37.2	0	0	0	112.2	F575 M578 A579 I582 A615 T623	F575-P619 HydrophobicContact CD2-CB 3.67Å; F575-P619 HydrophobicContact CE2-CB 3.77Å; F575-P619 HydrophobicContact CG-CB 4.46Å; M578-P619 HydrophobicContact CB-CB 3.96Å; M578-P619 HydrophobicContact CB-CG 4.21Å; A579-P619 HydrophobicContact CB-CB 4.32Å; A579-P619 HydrophobicContact CB-CG 3.9Å; I582-P619 HydrophobicContact CD1-CG 3.7Å; A615-P619 VanDerWaalsContact O-CD 3.28Å; A615-P619 WeakPolarHBondContact O-CD 3.48Å; A615-P619 VanDerWaalsContact O-CG 3.3Å; A615-P619 WeakPolarHBondContact O-CG 3.33Å; P619-T623 WeakPolarHBondContact O-CB 3.37Å; P619-T623 PolarHBondContact O-N 3.1Å; P619-T623 PolarHBondContact O-OG1 3.38Å
620	A	97.2	Very high	95.1	Very high	45 Å²	45	55.9 Å²	55.9	37%	0.372	31%	0.31	S	S	.	.	H	α-helix	trans	-64.2	-47.8	178	0	0	0	0	0	111.9	F575 W616 S617 L618 T623 A624	F575-A620 HydrophobicContact CE2-CB 4.04Å; W616-A620 WeakPolarHBondContact O-CB 3.23Å; W616-A620 PolarHBondContact O-N 2.04Å; W616-A620 VanDerWaalsContact O-N 3.12Å; S617-A620 PolarHBondContact O-N 2.97Å; L618-A620 VanDerWaalsContact C-N 3.29Å; L618-A620 PolarHBondContact O-N 3.43Å; A620-T623 PolarHBondContact O-N 3.4Å; A620-A624 VanDerWaalsContact O-CB 3.27Å; A620-A624 WeakPolarHBondContact O-CB 3.47Å; A620-A624 PolarHBondContact O-N 2.88Å
621	S	96.8	Very high	94.7	Very high	69 Å²	69	52.9 Å²	52.9	48%	0.483	29%	0.291	S	S	.	.	H	α-helix	trans	-67.4	-42	178.3	63	0	0	0	0	112.1	S617 L618 T623 A624 L625	S617-S621 PolarHBondContact O-N 2.98Å; S617-S621 PolarHBondContact O-OG 3.06Å; L618-S621 PolarHBondContact O-N 3.27Å; L618-S621 PolarHBondContact O-OG 3.3Å; L618-S621 VanDerWaalsContact O-OG 3.12Å; S621-T623 VanDerWaalsContact C-N 3.29Å; S621-T623 PolarHBondContact O-N 3.39Å; S621-A624 PolarHBondContact O-N 2.92Å; S621-L625 WeakPolarHBondContact O-CB 3.44Å; S621-L625 PolarHBondContact O-N 2.91Å
622	Q	95.7	Very high	94.3	Very high	25 Å²	25	52.1 Å²	52.1	12%	0.117	29%	0.288	C	S	.	.	H	α-helix	trans	-63.2	-34	176.5	-166.8	-170.7	-32.2	0	0	112.4	Y574 M578 L618 A626 F654	Y574-Q622 WeakPolarHBondContact OH-CG 3.48Å; Y574-Q622 PolarHBondContact OH-NE2 2.03Å; M578-Q622 PolarHBondContact SD-NE2 3.3Å; M578-Q622 VanDerWaalsContact SD-NE2 3.44Å; L618-Q622 VanDerWaalsContact O-CB 3.26Å; L618-Q622 WeakPolarHBondContact O-CB 3.46Å; L618-Q622 PolarHBondContact O-N 3.06Å; Q622-A626 PolarHBondContact O-N 2.92Å; Q622-F654 HydrophobicContact CG-CD1 4.41Å; Q622-F654 PolarHBondContact NE2-O 2.84Å
623	T	96	Very high	93.9	Very high	4 Å²	4	50 Å²	50	3%	0.025	28%	0.278	C	S	.	.	H	α-helix	trans	-77.7	-44.8	175.4	-55	0	0	0	0	111.9	F570 L571 Y574 F575 P619 A620 S621 L625 A626 L627	F570-T623 HydrophobicContact CE1-CG2 3.97Å; L571-T623 HydrophobicContact CD2-CG2 3.66Å; Y574-T623 HydrophobicContact CD1-CG2 4.07Å; Y574-T623 WeakPolarHBondContact CD1-OG1 3.41Å; Y574-T623 HydrophobicContact CE1-CG2 4.41Å; Y574-T623 WeakPolarHBondContact CE1-OG1 3.12Å; F575-T623 HydrophobicContact CB-CG2 4.37Å; P619-T623 WeakPolarHBondContact O-CB 3.37Å; P619-T623 PolarHBondContact O-N 3.1Å; P619-T623 PolarHBondContact O-OG1 3.38Å; A620-T623 PolarHBondContact O-N 3.4Å; S621-T623 VanDerWaalsContact C-N 3.29Å; S621-T623 PolarHBondContact O-N 3.39Å; T623-L625 VanDerWaalsContact C-N 3.29Å; T623-L625 PolarHBondContact O-N 3.05Å; T623-A626 PolarHBondContact O-N 3.36Å; T623-L627 HydrophobicContact CG2-CD1 4.31Å; T623-L627 WeakPolarHBondContact O-CG 3.36Å; T623-L627 PolarHBondContact O-N 3.46Å
624	A	95.4	Very high	93.5	Very high	48 Å²	48	43.3 Å²	43.3	40%	0.397	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-41.6	176.4	0	0	0	0	0	111.4	A620 S621 L627 L628	A620-A624 VanDerWaalsContact O-CB 3.27Å; A620-A624 WeakPolarHBondContact O-CB 3.47Å; A620-A624 PolarHBondContact O-N 2.88Å; S621-A624 PolarHBondContact O-N 2.92Å; A624-L627 PolarHBondContact O-N 3.09Å; A624-L628 WeakPolarHBondContact O-CB 3.27Å; A624-L628 VanDerWaalsContact O-CG 3.24Å; A624-L628 WeakPolarHBondContact O-CG 3.43Å; A624-L628 PolarHBondContact O-N 2.72Å
625	L	94.4	Very high	93.2	Very high	85 Å²	85	40.7 Å²	40.7	45%	0.445	24%	0.235	S	C	.	.	H	α-helix	trans	-65.5	-41.4	176.2	-176.1	60.9	0	0	0	112.4	S621 T623 L627 L628 L629 F654	S621-L625 WeakPolarHBondContact O-CB 3.44Å; S621-L625 PolarHBondContact O-N 2.91Å; T623-L625 VanDerWaalsContact C-N 3.29Å; T623-L625 PolarHBondContact O-N 3.05Å; L625-L627 VanDerWaalsContact C-N 3.3Å; L625-L627 PolarHBondContact O-N 3.05Å; L625-L628 PolarHBondContact O-N 3.06Å; L625-L629 HydrophobicContact CD1-CD1 4.08Å; L625-L629 HydrophobicContact CD1-CG 4.22Å; L625-L629 HydrophobicContact CG-CD1 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.45Å; L625-L629 VanDerWaalsContact O-CG 3.3Å; L625-L629 WeakPolarHBondContact O-CG 3.39Å; L625-L629 PolarHBondContact O-N 2.96Å; L625-F654 HydrophobicContact CB-CE1 4.09Å; L625-F654 HydrophobicContact CD2-CE1 3.83Å; L625-F654 HydrophobicContact CD2-CZ 3.81Å; L625-F654 HydrophobicContact CG-CE1 3.79Å; L625-F654 HydrophobicContact CG-CZ 3.84Å
626	A	92.2	Very high	92.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-63.1	-35.9	175	0	0	0	0	0	112.6	F570 Q622 T623 S630 I631 F654	F570-A626 HydrophobicContact CZ-CB 4.23Å; Q622-A626 PolarHBondContact O-N 2.92Å; T623-A626 PolarHBondContact O-N 3.36Å; A626-S630 PolarHBondContact O-N 3.22Å; A626-I631 HydrophobicContact CB-CD1 4.07Å; A626-I631 HydrophobicContact CB-CG1 4.13Å; A626-I631 VanDerWaalsContact O-CG1 3.32Å; A626-I631 WeakPolarHBondContact O-CG1 3.35Å; A626-I631 PolarHBondContact O-N 3.21Å; A626-F654 HydrophobicContact CB-CD1 4.01Å; A626-F654 HydrophobicContact CB-CE1 4.24Å
627	L	91.5	Very high	92.4	Very high	48 Å²	48	38 Å²	38	25%	0.251	23%	0.227	S	C	.	.	H	α-helix	trans	-71	-43.9	174.4	-68.2	176.2	0	0	0	112.4	L560 F570 L571 T623 A624 L625 L629 S630 V632	L560-L627 HydrophobicContact CD1-CD2 3.78Å; L560-L627 HydrophobicContact CD2-CD2 3.72Å; L560-L627 HydrophobicContact CG-CD2 4.37Å; F570-L627 HydrophobicContact CD1-CD2 3.81Å; F570-L627 HydrophobicContact CE1-CD2 3.67Å; F570-L627 HydrophobicContact CE1-CG 4.04Å; L571-L627 HydrophobicContact CD2-CD1 4.21Å; T623-L627 HydrophobicContact CG2-CD1 4.31Å; T623-L627 WeakPolarHBondContact O-CG 3.36Å; T623-L627 PolarHBondContact O-N 3.46Å; A624-L627 PolarHBondContact O-N 3.09Å; L625-L627 VanDerWaalsContact C-N 3.3Å; L625-L627 PolarHBondContact O-N 3.05Å; L627-L629 VanDerWaalsContact C-N 3.28Å; L627-L629 PolarHBondContact O-N 3.33Å; L627-S630 PolarHBondContact O-N 3.03Å; L627-V632 HydrophobicContact CD2-CG2 4.24Å
628	L	91.7	Very high	92.1	Very high	141 Å²	141	35.8 Å²	35.8	74%	0.738	21%	0.212	S	C	*	.	H	α-helix	trans	-61.8	-35.5	177.1	-74.7	166.6	0	0	0	112.3	A624 L625 S630	A624-L628 WeakPolarHBondContact O-CB 3.27Å; A624-L628 VanDerWaalsContact O-CG 3.24Å; A624-L628 WeakPolarHBondContact O-CG 3.43Å; A624-L628 PolarHBondContact O-N 2.72Å; L625-L628 PolarHBondContact O-N 3.06Å; L628-S630 VanDerWaalsContact C-N 3.27Å; L628-S630 PolarHBondContact O-N 2.92Å
629	L	89.3	Confident	91.9	Very high	91 Å²	91	32 Å²	32	48%	0.476	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-3.2	174.6	-64.7	173.3	0	0	0	113.5	L625 L627 I631 F654	L625-L629 HydrophobicContact CD1-CD1 4.08Å; L625-L629 HydrophobicContact CD1-CG 4.22Å; L625-L629 HydrophobicContact CG-CD1 4.07Å; L625-L629 WeakPolarHBondContact O-CB 3.45Å; L625-L629 VanDerWaalsContact O-CG 3.3Å; L625-L629 WeakPolarHBondContact O-CG 3.39Å; L625-L629 PolarHBondContact O-N 2.96Å; L627-L629 VanDerWaalsContact C-N 3.28Å; L627-L629 PolarHBondContact O-N 3.33Å; L629-I631 HydrophobicContact CB-CG1 4.28Å; L629-I631 HydrophobicContact CB-CG2 4.02Å; L629-I631 PolarHBondContact O-N 3.31Å; L629-F654 HydrophobicContact CD1-CE2 4.02Å; L629-F654 HydrophobicContact CD1-CZ 3.58Å
630	S	86.3	Confident	91.7	Very high	58 Å²	58	32 Å²	32	41%	0.406	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	56.6	17.1	-179.3	-63.8	0	0	0	0	116.2	A626 L627 L628 V632	A626-S630 PolarHBondContact O-N 3.22Å; L627-S630 PolarHBondContact O-N 3.03Å; L628-S630 VanDerWaalsContact C-N 3.27Å; L628-S630 PolarHBondContact O-N 2.92Å; S630-V632 PolarHBondContact O-N 2.84Å
631	I	88.5	Confident	91.5	Very high	14 Å²	14	29.9 Å²	29.9	7%	0.072	18%	0.175	C	C	.	.			trans	-75	30.8	-174.4	56.7	164.1	0	0	0	114.6	A626 L629 I643 Q644 P650 F654	A626-I631 HydrophobicContact CB-CD1 4.07Å; A626-I631 HydrophobicContact CB-CG1 4.13Å; A626-I631 VanDerWaalsContact O-CG1 3.32Å; A626-I631 WeakPolarHBondContact O-CG1 3.35Å; A626-I631 PolarHBondContact O-N 3.21Å; L629-I631 HydrophobicContact CB-CG1 4.28Å; L629-I631 HydrophobicContact CB-CG2 4.02Å; L629-I631 PolarHBondContact O-N 3.31Å; I631-I643 HydrophobicContact CD1-CG1 4.38Å; I631-I643 HydrophobicContact CD1-CG2 4.22Å; I631-I643 CarbonylContact O-C 3.58Å; I631-I643 WeakPolarHBondContact O-CA 3.42Å; I631-Q644 PolarHBondContact O-N 3.31Å; I631-P650 HydrophobicContact CB-CB 4.29Å; I631-P650 HydrophobicContact CD1-CB 3.97Å; I631-P650 HydrophobicContact CG2-CB 4.24Å; I631-P650 HydrophobicContact CG2-CG 4.19Å; I631-F654 HydrophobicContact CD1-CB 4.46Å; I631-F654 HydrophobicContact CD1-CD1 4.29Å; I631-F654 HydrophobicContact CD1-CD2 3.56Å; I631-F654 HydrophobicContact CD1-CE1 4.48Å; I631-F654 HydrophobicContact CD1-CE2 3.79Å; I631-F654 HydrophobicContact CD1-CG 3.85Å; I631-F654 HydrophobicContact CD1-CZ 4.26Å
632	V	89.6	Confident	91.3	Very high	2 Å²	2	28.7 Å²	28.7	1%	0.012	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	129.5	179.9	-178	0	0	0	0	109.7	A559 L560 F570 L627 S630 C641 T642	A559-V632 WeakPolarHBondContact CA-O 3.24Å; A559-V632 PolarHBondContact N-O 3.49Å; L560-V632 HydrophobicContact CD1-CB 4Å; L560-V632 HydrophobicContact CD1-CG2 3.95Å; F570-V632 HydrophobicContact CB-CG1 4.2Å; F570-V632 HydrophobicContact CD1-CG2 4.04Å; F570-V632 HydrophobicContact CD2-CG1 4.02Å; F570-V632 HydrophobicContact CD2-CG2 4.13Å; F570-V632 HydrophobicContact CE1-CG2 3.9Å; F570-V632 HydrophobicContact CE2-CG2 4.01Å; F570-V632 HydrophobicContact CG-CG1 4Å; F570-V632 HydrophobicContact CG-CG2 4.15Å; F570-V632 HydrophobicContact CZ-CG2 3.89Å; L627-V632 HydrophobicContact CD2-CG2 4.24Å; S630-V632 PolarHBondContact O-N 2.84Å; V632-C641 HydrophobicContact CG1-CB 4.13Å; V632-T642 CarbonylContact C-O 3.59Å; V632-T642 WeakPolarHBondContact CA-O 3Å
633	E	88.7	Confident	91.1	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.009	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	157.4	173.7	78.5	-171.4	178	0	0	111.5	R557 Y558 C641 T642 Q644 S645 N646	R557-E633 CarbonylContact O-C 3.55Å; R557-E633 VanDerWaalsContact O-CA 3.31Å; R557-E633 WeakPolarHBondContact O-CA 3.42Å; Y558-E633 HydrophobicContact CD1-CB 4.03Å; Y558-E633 HydrophobicContact CE1-CB 4.38Å; Y558-E633 WeakPolarHBondContact CE1-OE2 3.48Å; E633-C641 WeakPolarHBondContact O-CA 3.2Å; E633-T642 PolarHBondContact N-O 3Å; E633-T642 PolarHBondContact O-N 3.18Å; E633-Q644 VanDerWaalsContact CD-CA 3.45Å; E633-Q644 HydrophobicContact CG-CB 4.41Å; E633-Q644 WeakPolarHBondContact OE1-CA 3.37Å; E633-Q644 WeakPolarHBondContact OE2-CG 3.47Å; E633-Q644 PolarHBondContact OE2-NE2 3.25Å; E633-S645 WeakPolarHBondContact OE1-CB 3.01Å; E633-S645 PolarHBondContact OE1-N 3.41Å; E633-S645 PolarHBondContact OE1-OG 3.29Å; E633-N646 PolarHBondContact OE1-N 3.17Å
634	G	89.6	Confident	90.5	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	144.5	166.3	0	0	0	0	0	111.3	L556 R557 L640	L556-G634 WeakPolarHBondContact CD1-O 3.43Å; L556-G634 WeakPolarHBondContact CD2-O 3.44Å; L556-G634 WeakPolarHBondContact CG-O 3.33Å; R557-G634 PolarHBondContact O-N 2.78Å; G634-L640 CarbonylContact C-O 3.46Å; G634-L640 WeakPolarHBondContact CA-O 3.32Å
635	D	90.2	Very high	89.7	Confident	18 Å²	18	27.6 Å²	27.6	10%	0.096	16%	0.155	C	C	.	.			trans	-90.3	117.6	172	175.7	-5.8	0	0	0	110.1	I637 S638 G639 L640	D635-I637 PolarHBondContact O-N 3.38Å; D635-I637 WeakPolarHBondContact OD1-CG2 3.41Å; D635-I637 PolarHBondContact OD1-N 2.95Å; D635-S638 WeakPolarHBondContact CB-OG 3.22Å; D635-S638 PolarHBondContact OD1-N 3.11Å; D635-S638 WeakPolarHBondContact OD2-CB 3.31Å; D635-S638 PolarHBondContact OD2-OG 3.21Å; D635-G639 WeakPolarHBondContact O-CA 3.37Å; D635-G639 PolarHBondContact O-N 3.35Å; D635-L640 PolarHBondContact N-O 3.17Å
636	P	88	Confident	88.7	Confident	13 Å²	13	24.5 Å²	24.5	8%	0.084	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-9.6	-176.2	31.6	-36	0	0	0	114.1	M388 C390 T392 L556	M388-P636 HydrophobicContact CE-CG 4.27Å; C390-P636 WeakPolarHBondContact O-CA 3.36Å; T392-P636 PolarHBondContact N-O 3.04Å; T392-P636 VanDerWaalsContact N-O 3.09Å; L556-P636 HydrophobicContact CD1-CB 3.91Å; L556-P636 HydrophobicContact CD1-CG 4.5Å; L556-P636 HydrophobicContact CD2-CB 4.27Å; L556-P636 HydrophobicContact CD2-CG 4.14Å
637	I	88.6	Confident	88	Confident	7 Å²	7	26.8 Å²	26.8	4%	0.036	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	-42.2	173.9	-146.8	175.6	0	0	0	112.3	T392 Y395 D635 Y769 Y772	T392-I637 HydrophobicContact CG2-CB 4.26Å; T392-I637 HydrophobicContact CG2-CG1 4Å; Y395-I637 HydrophobicContact CD2-CD1 4.3Å; Y395-I637 HydrophobicContact CE2-CD1 3.5Å; Y395-I637 HydrophobicContact CE2-CG1 4.22Å; D635-I637 PolarHBondContact O-N 3.38Å; D635-I637 WeakPolarHBondContact OD1-CG2 3.41Å; D635-I637 PolarHBondContact OD1-N 2.95Å; I637-Y769 HydrophobicContact CD1-CD2 3.86Å; I637-Y769 HydrophobicContact CD1-CE2 4.14Å; I637-Y769 HydrophobicContact CG1-CD2 4.49Å; I637-Y769 HydrophobicContact CG1-CE2 4.33Å; I637-Y772 HydrophobicContact CD1-CD1 4.34Å; I637-Y772 HydrophobicContact CD1-CG 4.11Å; I637-Y772 HydrophobicContact CG2-CD1 3.73Å; I637-Y772 HydrophobicContact CG2-CE1 4.42Å; I637-Y772 HydrophobicContact CG2-CG 4.37Å
638	S	91.6	Very high	87.6	Confident	1 Å²	1	27.7 Å²	27.7	1%	0.007	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.4	-15.8	-172.6	78	0	0	0	0	114.7	R457 D635 L640	R457-S638 VanDerWaalsContact CD-O 3.25Å; R457-S638 WeakPolarHBondContact CD-O 3.23Å; R457-S638 PolarHBondContact NH1-O 2.92Å; D635-S638 WeakPolarHBondContact CB-OG 3.22Å; D635-S638 PolarHBondContact OD1-N 3.11Å; D635-S638 WeakPolarHBondContact OD2-CB 3.31Å; D635-S638 PolarHBondContact OD2-OG 3.21Å; S638-L640 PolarHBondContact O-N 2.92Å; S638-L640 WeakPolarHBondContact OG-CD1 3.36Å; S638-L640 WeakPolarHBondContact OG-CG 3.11Å
639	G	91.1	Very high	87.5	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.152	C	C	.	.			trans	71.2	13.4	-180	0	0	0	0	0	114.5	R457 H462 D635	R457-G639 VanDerWaalsContact CG-O 3.27Å; R457-G639 WeakPolarHBondContact CG-O 3.33Å; H462-G639 VanDerWaalsContact CE1-CA 3.47Å; H462-G639 WeakPolarHBondContact CE1-CA 3.42Å; H462-G639 WeakPolarHBondContact ND1-CA 3.24Å; H462-G639 PolarHBondContact ND1-N 2.92Å; D635-G639 WeakPolarHBondContact O-CA 3.37Å; D635-G639 PolarHBondContact O-N 3.35Å
640	L	93.5	Very high	87.5	Confident	1 Å²	1	23 Å²	23	1%	0.005	14%	0.135	C	C	.	.			trans	-90.9	171.5	176.1	-58.1	170	0	0	0	110.1	Y454 R457 V569 I573 G634 D635 S638	Y454-L640 HydrophobicContact CD1-CD1 3.96Å; Y454-L640 HydrophobicContact CD1-CD2 4.34Å; Y454-L640 HydrophobicContact CE1-CD1 3.49Å; Y454-L640 VanDerWaalsContact CE1-CD1 3.49Å; R457-L640 HydrophobicContact CB-CD2 3.52Å; R457-L640 HydrophobicContact CG-CD2 3.55Å; R457-L640 HydrophobicContact CG-CG 4.22Å; V569-L640 HydrophobicContact CG1-CB 4.39Å; V569-L640 HydrophobicContact CG1-CD2 3.92Å; I573-L640 HydrophobicContact CD1-CD1 4.04Å; I573-L640 HydrophobicContact CD1-CD2 3.69Å; I573-L640 HydrophobicContact CD1-CG 4.3Å; G634-L640 CarbonylContact C-O 3.46Å; G634-L640 WeakPolarHBondContact CA-O 3.32Å; D635-L640 PolarHBondContact N-O 3.17Å; S638-L640 PolarHBondContact O-N 2.92Å; S638-L640 WeakPolarHBondContact OG-CD1 3.36Å; S638-L640 WeakPolarHBondContact OG-CG 3.11Å
641	C	93.4	Very high	87.8	Confident	1 Å²	1	21 Å²	21	1%	0.007	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	129	167.8	-74.2	0	0	0	0	110.6	I465 C566 F570 V632 E633	I465-C641 PolarHBondContact O-SG 2.7Å; C566-C641 WeakPolarHBondContact CA-SG 3.42Å; C566-C641 HydrophobicContact CB-CB 4.16Å; C566-C641 WeakPolarHBondContact CB-SG 3.45Å; C566-C641 WeakPolarHBondContact O-CB 3.47Å; C566-C641 WeakPolarHBondContact SG-CB 3.38Å; C566-C641 CovalentContact SG-SG 2.04Å; C566-C641 PolarHBondContact SG-SG 3.17Å; F570-C641 HydrophobicContact CB-CB 4.13Å; V632-C641 HydrophobicContact CG1-CB 4.13Å; E633-C641 WeakPolarHBondContact O-CA 3.2Å
642	T	92.6	Very high	88	Confident	43 Å²	43	22.9 Å²	22.9	26%	0.264	13%	0.129	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	178.4	-173.8	51.9	0	0	0	0	110.7	V632 E633	V632-T642 CarbonylContact C-O 3.59Å; V632-T642 WeakPolarHBondContact CA-O 3Å; E633-T642 PolarHBondContact N-O 3Å; E633-T642 PolarHBondContact O-N 3.18Å
643	I	92.2	Very high	88.2	Confident	3 Å²	3	27.2 Å²	27.2	2%	0.015	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.6	146.5	169.2	-75.1	146.9	0	0	0	110.4	F570 Y574 I631 S645 P650 F651 F654 T655	F570-I643 HydrophobicContact CE2-CG1 4.15Å; Y574-I643 HydrophobicContact CD2-CD1 3.82Å; Y574-I643 HydrophobicContact CE1-CD1 4.44Å; Y574-I643 HydrophobicContact CE2-CD1 3.17Å; Y574-I643 HydrophobicContact CE2-CG1 4.44Å; I631-I643 HydrophobicContact CD1-CG1 4.38Å; I631-I643 HydrophobicContact CD1-CG2 4.22Å; I631-I643 CarbonylContact O-C 3.58Å; I631-I643 WeakPolarHBondContact O-CA 3.42Å; I643-S645 PolarHBondContact O-N 2.86Å; I643-S645 VanDerWaalsContact O-N 3.13Å; I643-P650 HydrophobicContact CG2-CB 4.08Å; I643-F651 HydrophobicContact CG2-CD2 4.33Å; I643-F654 HydrophobicContact CD1-CB 3.51Å; I643-F654 HydrophobicContact CG1-CB 4.38Å; I643-T655 WeakPolarHBondContact CD1-OG1 3.2Å
644	Q	83.3	Confident	88.5	Confident	15 Å²	15	28.2 Å²	28.2	7%	0.07	16%	0.156	C	C	.	.			trans	-53.1	111.6	177	173.4	146.6	89.4	0	0	112.9	I631 E633 N646 K647	I631-Q644 PolarHBondContact O-N 3.31Å; E633-Q644 VanDerWaalsContact CD-CA 3.45Å; E633-Q644 HydrophobicContact CG-CB 4.41Å; E633-Q644 WeakPolarHBondContact OE1-CA 3.37Å; E633-Q644 WeakPolarHBondContact OE2-CG 3.47Å; E633-Q644 PolarHBondContact OE2-NE2 3.25Å; Q644-N646 HydrophobicContact CG-CB 3.86Å; Q644-K647 HydrophobicContact CG-CB 4.15Å; Q644-K647 HydrophobicContact CG-CG 4.22Å; Q644-K647 VanDerWaalsContact OE1-CE 3.22Å
645	S	77.7	Confident	88.7	Confident	36 Å²	36	29 Å²	29	25%	0.252	16%	0.161	S	C	.	.	S	Bend	trans	-80.3	-30.6	173.3	65.8	0	0	0	0	112.4	E633 I643 K647	E633-S645 WeakPolarHBondContact OE1-CB 3.01Å; E633-S645 PolarHBondContact OE1-N 3.41Å; E633-S645 PolarHBondContact OE1-OG 3.29Å; I643-S645 PolarHBondContact O-N 2.86Å; I643-S645 VanDerWaalsContact O-N 3.13Å; S645-K647 PolarHBondContact O-N 3.47Å; S645-K647 VanDerWaalsContact O-N 3.13Å
646	N	72.4	Confident	88.9	Confident	20 Å²	20	29.4 Å²	29.4	11%	0.107	16%	0.162	C	C	.	.	S	Bend	trans	-56.3	-26.3	177.6	-178.1	57.3	0	0	0	113.6	T379 E633 Q644 Q733	T379-N646 PolarHBondContact O-ND2 3.37Å; T379-N646 PolarHBondContact O-OD1 2.86Å; E633-N646 PolarHBondContact OE1-N 3.17Å; Q644-N646 HydrophobicContact CG-CB 3.86Å; N646-Q733 PolarHBondContact OD1-NE2 2.88Å; N646-Q733 PolarHBondContact OD1-OE1 3.36Å; N646-Q733 VanDerWaalsContact OD1-OE1 3.14Å
647	K	78.6	Confident	89.3	Confident	48 Å²	48	31.6 Å²	31.6	21%	0.209	17%	0.172	C	C	.	.	S	Bend	trans	-114.9	120.2	174.3	-62.8	-178.8	-171.4	163.8	0	109	E376 Q644 S645 I649 P650	E376-K647 IonicContact OE1-NZ 2.7Å; E376-K647 PolarHBondContact OE1-NZ 3.09Å; E376-K647 IonicContact OE2-NZ 3.24Å; E376-K647 PolarHBondContact OE2-NZ 2.97Å; Q644-K647 HydrophobicContact CG-CB 4.15Å; Q644-K647 HydrophobicContact CG-CG 4.22Å; Q644-K647 VanDerWaalsContact OE1-CE 3.22Å; S645-K647 PolarHBondContact O-N 3.47Å; S645-K647 VanDerWaalsContact O-N 3.13Å; K647-I649 VanDerWaalsContact C-N 3.3Å; K647-I649 PolarHBondContact O-N 3.43Å; K647-P650 HydrophobicContact CB-CG 4.03Å; K647-P650 WeakPolarHBondContact O-CD 3.36Å
648	S	82.4	Confident	89.7	Confident	68 Å²	68	32 Å²	32	48%	0.476	18%	0.175	S	C	.	.	H	α-helix	trans	-60.2	-37.4	-177.9	56.5	0	0	0	0	113.1	L652	S648-L652 WeakPolarHBondContact O-CB 3.46Å; S648-L652 PolarHBondContact O-N 3.31Å
649	I	89.6	Confident	89.9	Confident	113 Å²	113	32.7 Å²	32.7	58%	0.579	18%	0.179	S	C	*	.	H	α-helix	trans	-66.5	-53	-174.3	-62.2	172.3	0	0	0	112.7	K647 F651 L652 L653	K647-I649 VanDerWaalsContact C-N 3.3Å; K647-I649 PolarHBondContact O-N 3.43Å; I649-F651 PolarHBondContact O-N 2.94Å; I649-L652 PolarHBondContact O-N 3.39Å; I649-L653 HydrophobicContact CG2-CD1 3.64Å; I649-L653 HydrophobicContact CG2-CG 4.26Å; I649-L653 WeakPolarHBondContact O-CB 3.09Å; I649-L653 WeakPolarHBondContact O-CG 3.36Å; I649-L653 PolarHBondContact O-N 3.24Å
650	P	89.8	Confident	90.2	Very high	20 Å²	20	34.8 Å²	34.8	13%	0.13	19%	0.19	C	C	.	.	H	α-helix	trans	-55.5	-46.9	173.2	-28.2	35.4	0	0	0	113.5	I631 I643 K647 L652 L653 F654	I631-P650 HydrophobicContact CB-CB 4.29Å; I631-P650 HydrophobicContact CD1-CB 3.97Å; I631-P650 HydrophobicContact CG2-CB 4.24Å; I631-P650 HydrophobicContact CG2-CG 4.19Å; I643-P650 HydrophobicContact CG2-CB 4.08Å; K647-P650 HydrophobicContact CB-CG 4.03Å; K647-P650 WeakPolarHBondContact O-CD 3.36Å; P650-L652 PolarHBondContact O-N 3.04Å; P650-L653 PolarHBondContact O-N 3.08Å; P650-F654 WeakPolarHBondContact O-CB 3.06Å; P650-F654 WeakPolarHBondContact O-CD2 3.38Å; P650-F654 PolarHBondContact O-N 3.47Å
651	F	91.5	Very high	90.4	Very high	16 Å²	16	38.8 Å²	38.8	7%	0.07	21%	0.21	C	C	.	.	H	α-helix	trans	-65	-39.4	-178.2	-160.6	-133.9	0	0	0	112.2	I643 I649 T655 F656 I722 E725 L726	I643-F651 HydrophobicContact CG2-CD2 4.33Å; I649-F651 PolarHBondContact O-N 2.94Å; F651-T655 HydrophobicContact CE2-CG2 4.35Å; F651-T655 WeakPolarHBondContact O-CA 3.03Å; F651-T655 VanDerWaalsContact O-CB 3.25Å; F651-T655 WeakPolarHBondContact O-CB 3.3Å; F651-T655 PolarHBondContact O-N 3.08Å; F651-T655 VanDerWaalsContact O-N 3.1Å; F651-F656 PolarHBondContact O-N 3.48Å; F651-F656 VanDerWaalsContact O-N 3.15Å; F651-I722 HydrophobicContact CD1-CG2 4.48Å; F651-I722 HydrophobicContact CE1-CG2 3.82Å; F651-I722 HydrophobicContact CZ-CG2 3.95Å; F651-E725 HydrophobicContact CE1-CB 4.18Å; F651-L726 HydrophobicContact CB-CD2 4.12Å; F651-L726 HydrophobicContact CD1-CD2 3.67Å; F651-L726 HydrophobicContact CD1-CG 3.71Å; F651-L726 HydrophobicContact CE1-CG 4.22Å; F651-L726 HydrophobicContact CG-CD2 4.34Å
652	L	93.3	Very high	90.5	Very high	53 Å²	53	40.3 Å²	40.3	28%	0.277	22%	0.216	S	C	.	.	I	π-helix	trans	-64.8	-52	175.2	-178.5	70.5	0	0	0	112	S648 I649 P650 F656 I657 L726	S648-L652 WeakPolarHBondContact O-CB 3.46Å; S648-L652 PolarHBondContact O-N 3.31Å; I649-L652 PolarHBondContact O-N 3.39Å; P650-L652 PolarHBondContact O-N 3.04Å; L652-F656 HydrophobicContact CD1-CB 4.25Å; L652-F656 HydrophobicContact CD1-CD1 3.74Å; L652-F656 HydrophobicContact CD1-CE1 4.48Å; L652-F656 HydrophobicContact CD1-CG 4.29Å; L652-F656 PolarHBondContact O-N 3.46Å; L652-I657 HydrophobicContact CD1-CD1 4.21Å; L652-I657 HydrophobicContact CD1-CG1 4.13Å; L652-I657 HydrophobicContact CD2-CD1 4.33Å; L652-I657 HydrophobicContact CG-CD1 3.82Å; L652-I657 HydrophobicContact CG-CG1 4.19Å; L652-I657 WeakPolarHBondContact O-CB 3.22Å; L652-I657 WeakPolarHBondContact O-CG1 3.42Å; L652-I657 PolarHBondContact O-N 2.87Å; L652-L726 HydrophobicContact CB-CD2 4.23Å; L652-L726 HydrophobicContact CD1-CD1 4.04Å
653	L	93.7	Very high	90.7	Very high	93 Å²	93	38.9 Å²	38.9	49%	0.487	21%	0.207	S	C	.	.	I	π-helix	trans	-72	-39.7	-173.7	-69.9	176.7	0	0	0	113.3	I649 P650 I657 P658	I649-L653 HydrophobicContact CG2-CD1 3.64Å; I649-L653 HydrophobicContact CG2-CG 4.26Å; I649-L653 WeakPolarHBondContact O-CB 3.09Å; I649-L653 WeakPolarHBondContact O-CG 3.36Å; I649-L653 PolarHBondContact O-N 3.24Å; P650-L653 PolarHBondContact O-N 3.08Å; L653-I657 HydrophobicContact CD2-CD1 4.28Å; L653-P658 VanDerWaalsContact O-CD 3.25Å; L653-P658 WeakPolarHBondContact O-CD 3.2Å; L653-P658 WeakPolarHBondContact O-CG 3.49Å
654	F	95.3	Very high	90.9	Very high	24 Å²	24	42.8 Å²	42.8	11%	0.105	23%	0.227	C	C	.	.	I	π-helix	trans	-96.9	-19.7	-174	-71.6	-94.4	0	0	0	113.9	Y574 M578 Q622 L625 A626 L629 I631 I643 P650	Y574-F654 PolarHBondContact OH-O 3.37Å; M578-F654 WeakPolarHBondContact CE-O 3.42Å; Q622-F654 HydrophobicContact CG-CD1 4.41Å; Q622-F654 PolarHBondContact NE2-O 2.84Å; L625-F654 HydrophobicContact CB-CE1 4.09Å; L625-F654 HydrophobicContact CD2-CE1 3.83Å; L625-F654 HydrophobicContact CD2-CZ 3.81Å; L625-F654 HydrophobicContact CG-CE1 3.79Å; L625-F654 HydrophobicContact CG-CZ 3.84Å; A626-F654 HydrophobicContact CB-CD1 4.01Å; A626-F654 HydrophobicContact CB-CE1 4.24Å; L629-F654 HydrophobicContact CD1-CE2 4.02Å; L629-F654 HydrophobicContact CD1-CZ 3.58Å; I631-F654 HydrophobicContact CD1-CB 4.46Å; I631-F654 HydrophobicContact CD1-CD1 4.29Å; I631-F654 HydrophobicContact CD1-CD2 3.56Å; I631-F654 HydrophobicContact CD1-CE1 4.48Å; I631-F654 HydrophobicContact CD1-CE2 3.79Å; I631-F654 HydrophobicContact CD1-CG 3.85Å; I631-F654 HydrophobicContact CD1-CZ 4.26Å; I643-F654 HydrophobicContact CD1-CB 3.51Å; I643-F654 HydrophobicContact CG1-CB 4.38Å; P650-F654 WeakPolarHBondContact O-CB 3.06Å; P650-F654 WeakPolarHBondContact O-CD2 3.38Å; P650-F654 PolarHBondContact O-N 3.47Å
655	T	94.1	Very high	91.6	Very high	17 Å²	17	45.1 Å²	45.1	10%	0.104	24%	0.239	C	C	.	.	I	π-helix	trans	-115.8	-61.8	179.9	-49.6	0	0	0	0	112.6	I643 F651 L659 I722	I643-T655 WeakPolarHBondContact CD1-OG1 3.2Å; F651-T655 HydrophobicContact CE2-CG2 4.35Å; F651-T655 WeakPolarHBondContact O-CA 3.03Å; F651-T655 VanDerWaalsContact O-CB 3.25Å; F651-T655 WeakPolarHBondContact O-CB 3.3Å; F651-T655 PolarHBondContact O-N 3.08Å; F651-T655 VanDerWaalsContact O-N 3.1Å; T655-L659 HydrophobicContact CG2-CD1 3.98Å; T655-L659 WeakPolarHBondContact O-CB 3.26Å; T655-L659 WeakPolarHBondContact O-CD1 3Å; T655-L659 VanDerWaalsContact O-CG 3.24Å; T655-L659 WeakPolarHBondContact O-CG 3.39Å; T655-L659 PolarHBondContact O-N 3.27Å; T655-I722 HydrophobicContact CG2-CD1 4.08Å
656	F	95.2	Very high	92.4	Very high	25 Å²	25	43.4 Å²	43.4	11%	0.11	23%	0.227	C	C	.	.	I	π-helix	trans	-69.2	-50.1	-169.2	-177.2	-93.6	0	0	0	113.3	F651 L652 L659 L660 L719 I722 L726	F651-F656 PolarHBondContact O-N 3.48Å; F651-F656 VanDerWaalsContact O-N 3.15Å; L652-F656 HydrophobicContact CD1-CB 4.25Å; L652-F656 HydrophobicContact CD1-CD1 3.74Å; L652-F656 HydrophobicContact CD1-CE1 4.48Å; L652-F656 HydrophobicContact CD1-CG 4.29Å; L652-F656 PolarHBondContact O-N 3.46Å; F656-L659 PolarHBondContact O-N 3.21Å; F656-L660 HydrophobicContact CE1-CD2 4.05Å; F656-L660 WeakPolarHBondContact O-CB 2.98Å; F656-L660 PolarHBondContact O-N 2.04Å; F656-L719 HydrophobicContact CD2-CD1 3.52Å; F656-L719 HydrophobicContact CD2-CG 4.39Å; F656-L719 HydrophobicContact CE2-CD1 3.63Å; F656-L719 HydrophobicContact CE2-CG 4.03Å; F656-L719 HydrophobicContact CG-CD1 4.18Å; F656-L719 HydrophobicContact CZ-CD1 4.36Å; F656-I722 HydrophobicContact CB-CG2 4.08Å; F656-I722 HydrophobicContact CD2-CB 4.35Å; F656-I722 HydrophobicContact CD2-CG2 3.88Å; F656-I722 HydrophobicContact CG-CG2 4.48Å; F656-L726 HydrophobicContact CB-CD1 3.71Å; F656-L726 HydrophobicContact CD1-CD1 4.38Å; F656-L726 HydrophobicContact CD2-CD1 3.87Å; F656-L726 HydrophobicContact CG-CD1 3.74Å
657	I	95.9	Very high	93.5	Very high	60 Å²	60	45 Å²	45	31%	0.308	24%	0.235	S	C	.	.	H	α-helix	trans	-63.9	-46.7	-177	-71.5	174.1	0	0	0	112.4	L652 L653 L659 L660 I661	L652-I657 HydrophobicContact CD1-CD1 4.21Å; L652-I657 HydrophobicContact CD1-CG1 4.13Å; L652-I657 HydrophobicContact CD2-CD1 4.33Å; L652-I657 HydrophobicContact CG-CD1 3.82Å; L652-I657 HydrophobicContact CG-CG1 4.19Å; L652-I657 WeakPolarHBondContact O-CB 3.22Å; L652-I657 WeakPolarHBondContact O-CG1 3.42Å; L652-I657 PolarHBondContact O-N 2.87Å; L653-I657 HydrophobicContact CD2-CD1 4.28Å; I657-L659 PolarHBondContact O-N 2.96Å; I657-L660 PolarHBondContact O-N 3.44Å; I657-I661 HydrophobicContact CG2-CD1 3.63Å; I657-I661 HydrophobicContact CG2-CG1 4.35Å; I657-I661 WeakPolarHBondContact O-CB 3.41Å; I657-I661 VanDerWaalsContact O-CG1 3.3Å; I657-I661 WeakPolarHBondContact O-CG1 3.31Å; I657-I661 PolarHBondContact O-N 2.92Å
658	P	96.5	Very high	94.3	Very high	15 Å²	15	47.3 Å²	47.3	10%	0.097	25%	0.249	C	C	.	.	H	α-helix	trans	-58.7	-45.9	175.9	-27.6	36.9	0	0	0	112.9	M578 L653 L660 I661 Y662	M578-P658 HydrophobicContact SD-CB 4.27Å; L653-P658 VanDerWaalsContact O-CD 3.25Å; L653-P658 WeakPolarHBondContact O-CD 3.2Å; L653-P658 WeakPolarHBondContact O-CG 3.49Å; P658-L660 PolarHBondContact O-N 2.96Å; P658-I661 PolarHBondContact O-N 3.49Å; P658-Y662 HydrophobicContact CB-CE2 4.04Å; P658-Y662 WeakPolarHBondContact O-CD2 3.43Å; P658-Y662 VanDerWaalsContact O-CG 3.26Å; P658-Y662 PolarHBondContact O-N 3.44Å
659	L	95.6	Very high	94.9	Very high	16 Å²	16	46.6 Å²	46.6	8%	0.084	24%	0.238	C	C	.	.	H	α-helix	trans	-63.2	-42.9	177.9	-68.9	174	0	0	0	112	M578 S581 T655 F656 I657 L663 L719 I722	M578-L659 HydrophobicContact CE-CD1 4.48Å; M578-L659 HydrophobicContact CE-CD2 4.27Å; M578-L659 HydrophobicContact CE-CG 4.07Å; M578-L659 HydrophobicContact SD-CD2 4.06Å; M578-L659 HydrophobicContact SD-CG 4.35Å; S581-L659 WeakPolarHBondContact OG-CD2 3.49Å; T655-L659 HydrophobicContact CG2-CD1 3.98Å; T655-L659 WeakPolarHBondContact O-CB 3.26Å; T655-L659 WeakPolarHBondContact O-CD1 3Å; T655-L659 VanDerWaalsContact O-CG 3.24Å; T655-L659 WeakPolarHBondContact O-CG 3.39Å; T655-L659 PolarHBondContact O-N 3.27Å; F656-L659 PolarHBondContact O-N 3.21Å; I657-L659 PolarHBondContact O-N 2.96Å; L659-L663 WeakPolarHBondContact O-CB 3.44Å; L659-L663 PolarHBondContact O-N 3.08Å; L659-L719 HydrophobicContact CB-CD1 4.14Å; L659-I722 HydrophobicContact CD1-CD1 3.88Å
660	L	97	Very high	95	Very high	44 Å²	44	41.3 Å²	41.3	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-45.7	175	177.4	64.7	0	0	0	111.7	F656 I657 P658 L663 I664 L719	F656-L660 HydrophobicContact CE1-CD2 4.05Å; F656-L660 WeakPolarHBondContact O-CB 2.98Å; F656-L660 PolarHBondContact O-N 2.04Å; I657-L660 PolarHBondContact O-N 3.44Å; P658-L660 PolarHBondContact O-N 2.96Å; L660-L663 PolarHBondContact O-N 3.33Å; L660-I664 HydrophobicContact CD1-CD1 3.79Å; L660-I664 HydrophobicContact CD1-CG1 4.25Å; L660-I664 HydrophobicContact CG-CD1 3.9Å; L660-I664 WeakPolarHBondContact O-CB 3.46Å; L660-I664 VanDerWaalsContact O-CG1 3.27Å; L660-I664 WeakPolarHBondContact O-CG1 3.44Å; L660-I664 PolarHBondContact O-N 3.23Å; L660-L719 HydrophobicContact CB-CD1 4.41Å; L660-L719 HydrophobicContact CB-CD2 4.17Å; L660-L719 HydrophobicContact CD1-CD2 3.86Å
661	I	97.3	Very high	95.1	Very high	84 Å²	84	44.9 Å²	44.9	43%	0.431	23%	0.227	S	C	.	.	H	α-helix	trans	-63	-50.3	178.9	-71	169.1	0	0	0	111	I657 P658 L663 I664 I665	I657-I661 HydrophobicContact CG2-CD1 3.63Å; I657-I661 HydrophobicContact CG2-CG1 4.35Å; I657-I661 WeakPolarHBondContact O-CB 3.41Å; I657-I661 VanDerWaalsContact O-CG1 3.3Å; I657-I661 WeakPolarHBondContact O-CG1 3.31Å; I657-I661 PolarHBondContact O-N 2.92Å; P658-I661 PolarHBondContact O-N 3.49Å; I661-L663 VanDerWaalsContact C-N 3.33Å; I661-L663 PolarHBondContact O-N 3.05Å; I661-I664 PolarHBondContact O-N 2.88Å; I661-I665 HydrophobicContact CG2-CD1 3.68Å; I661-I665 VanDerWaalsContact O-CG1 3.3Å; I661-I665 WeakPolarHBondContact O-CG1 3.2Å; I661-I665 PolarHBondContact O-N 3Å
662	Y	96.8	Very high	95.2	Very high	33 Å²	33	48.3 Å²	48.3	13%	0.129	25%	0.245	C	C	.	.	H	α-helix	trans	-61.5	-42.2	178.5	-59.9	-38.8	0	0	0	111.5	M578 I582 V585 P658 I665 G666	M578-Y662 HydrophobicContact SD-CE2 4.35Å; I582-Y662 HydrophobicContact CD1-CE1 4.15Å; I582-Y662 HydrophobicContact CD1-CE2 4.32Å; I582-Y662 HydrophobicContact CG1-CD1 4.12Å; I582-Y662 HydrophobicContact CG1-CD2 4.31Å; I582-Y662 HydrophobicContact CG1-CE1 3.76Å; I582-Y662 HydrophobicContact CG1-CE2 3.96Å; I582-Y662 HydrophobicContact CG1-CG 4.4Å; V585-Y662 VanDerWaalsContact CG2-O 3.24Å; V585-Y662 WeakPolarHBondContact CG2-O 3.44Å; P658-Y662 HydrophobicContact CB-CE2 4.04Å; P658-Y662 WeakPolarHBondContact O-CD2 3.43Å; P658-Y662 VanDerWaalsContact O-CG 3.26Å; P658-Y662 PolarHBondContact O-N 3.44Å; Y662-I665 PolarHBondContact O-N 3.23Å; Y662-G666 PolarHBondContact O-N 2.87Å
663	L	95.9	Very high	95.1	Very high	13 Å²	13	45.8 Å²	45.8	7%	0.068	23%	0.232	C	C	.	.	H	α-helix	trans	-62.5	-44.7	178.5	-172.1	59.3	0	0	0	112.1	W584 L659 L660 I661 I667 N715 L716 L719	W584-L663 HydrophobicContact CH2-CD1 4.08Å; W584-L663 HydrophobicContact CZ3-CD1 4.21Å; L659-L663 WeakPolarHBondContact O-CB 3.44Å; L659-L663 PolarHBondContact O-N 3.08Å; L660-L663 PolarHBondContact O-N 3.33Å; I661-L663 VanDerWaalsContact C-N 3.33Å; I661-L663 PolarHBondContact O-N 3.05Å; L663-I667 HydrophobicContact CD1-CD1 3.94Å; L663-I667 HydrophobicContact CD1-CG1 4.33Å; L663-I667 HydrophobicContact CG-CD1 3.89Å; L663-I667 WeakPolarHBondContact O-CB 3.3Å; L663-I667 VanDerWaalsContact O-CG1 3.23Å; L663-I667 WeakPolarHBondContact O-CG1 3Å; L663-I667 PolarHBondContact O-N 3.25Å; L663-N715 HydrophobicContact CD1-CB 4.14Å; L663-L716 HydrophobicContact CD2-CD2 3.74Å; L663-L716 HydrophobicContact CD2-CG 4.05Å; L663-L719 HydrophobicContact CD2-CD2 3.72Å
664	I	97	Very high	94.9	Very high	85 Å²	85	43.2 Å²	43.2	44%	0.436	22%	0.217	S	C	.	.	H	α-helix	trans	-61.2	-51.1	175.5	-71.6	167.6	0	0	0	110.9	L660 I661 G666 I667 L668	L660-I664 HydrophobicContact CD1-CD1 3.79Å; L660-I664 HydrophobicContact CD1-CG1 4.25Å; L660-I664 HydrophobicContact CG-CD1 3.9Å; L660-I664 WeakPolarHBondContact O-CB 3.46Å; L660-I664 VanDerWaalsContact O-CG1 3.27Å; L660-I664 WeakPolarHBondContact O-CG1 3.44Å; L660-I664 PolarHBondContact O-N 3.23Å; I661-I664 PolarHBondContact O-N 2.88Å; I664-G666 PolarHBondContact O-N 3.11Å; I664-I667 PolarHBondContact O-N 2.87Å; I664-L668 HydrophobicContact CG2-CD1 3.85Å; I664-L668 HydrophobicContact CG2-CG 4.39Å; I664-L668 VanDerWaalsContact O-CG 3.31Å; I664-L668 WeakPolarHBondContact O-CG 3.16Å; I664-L668 PolarHBondContact O-N 2.91Å
665	I	97.1	Very high	94.7	Very high	64 Å²	64	47.3 Å²	47.3	33%	0.328	24%	0.238	S	C	.	.	H	α-helix	trans	-60.4	-46.1	-177	-66.8	167.9	0	0	0	110.9	V585 I661 Y662 L668 F669	V585-I665 HydrophobicContact CG1-CG2 3.75Å; I661-I665 HydrophobicContact CG2-CD1 3.68Å; I661-I665 VanDerWaalsContact O-CG1 3.3Å; I661-I665 WeakPolarHBondContact O-CG1 3.2Å; I661-I665 PolarHBondContact O-N 3Å; Y662-I665 PolarHBondContact O-N 3.23Å; I665-L668 PolarHBondContact O-N 3.21Å; I665-F669 HydrophobicContact CG2-CD2 4.08Å; I665-F669 HydrophobicContact CG2-CE2 3.54Å; I665-F669 HydrophobicContact CG2-CZ 3.84Å; I665-F669 WeakPolarHBondContact O-CG 3.46Å; I665-F669 PolarHBondContact O-N 2.95Å
666	G	95.5	Very high	94.4	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-67.3	-39.7	177.7	0	0	0	0	0	113	W584 Y662 I664 L668 F669 M670	W584-G666 VanDerWaalsContact CH2-C 3.43Å; W584-G666 VanDerWaalsContact CH2-CA 3.46Å; Y662-G666 PolarHBondContact O-N 2.87Å; I664-G666 PolarHBondContact O-N 3.11Å; G666-L668 VanDerWaalsContact C-N 3.31Å; G666-L668 PolarHBondContact O-N 2.96Å; G666-F669 PolarHBondContact O-N 3.22Å; G666-M670 WeakPolarHBondContact O-CB 3.46Å; G666-M670 VanDerWaalsContact O-CG 3.24Å; G666-M670 WeakPolarHBondContact O-CG 3.21Å; G666-M670 PolarHBondContact O-N 3.46Å
667	I	95.2	Very high	93.8	Very high	53 Å²	53	46.9 Å²	46.9	27%	0.272	24%	0.24	S	C	.	.	H	α-helix	trans	-60.6	-42.2	174.2	-74.9	171.2	0	0	0	110.5	W584 L663 I664 M670 M671 T712	W584-I667 HydrophobicContact CH2-CG1 4.21Å; L663-I667 HydrophobicContact CD1-CD1 3.94Å; L663-I667 HydrophobicContact CD1-CG1 4.33Å; L663-I667 HydrophobicContact CG-CD1 3.89Å; L663-I667 WeakPolarHBondContact O-CB 3.3Å; L663-I667 VanDerWaalsContact O-CG1 3.23Å; L663-I667 WeakPolarHBondContact O-CG1 3Å; L663-I667 PolarHBondContact O-N 3.25Å; I664-I667 PolarHBondContact O-N 2.87Å; I667-M670 PolarHBondContact O-N 3.14Å; I667-M671 HydrophobicContact CG2-CG 4.21Å; I667-M671 WeakPolarHBondContact O-CB 3.41Å; I667-M671 VanDerWaalsContact O-CG 3.27Å; I667-M671 WeakPolarHBondContact O-CG 3.15Å; I667-M671 PolarHBondContact O-N 3.36Å; I667-T712 HydrophobicContact CG1-CG2 3.97Å
668	L	95.3	Very high	93.2	Very high	97 Å²	97	50.6 Å²	50.6	51%	0.508	25%	0.254	S	S	.	.	H	α-helix	trans	-60.5	-48.7	176	-70.8	169.5	0	0	0	111.5	I664 I665 G666 M670 M671 I672	I664-L668 HydrophobicContact CG2-CD1 3.85Å; I664-L668 HydrophobicContact CG2-CG 4.39Å; I664-L668 VanDerWaalsContact O-CG 3.31Å; I664-L668 WeakPolarHBondContact O-CG 3.16Å; I664-L668 PolarHBondContact O-N 2.91Å; I665-L668 PolarHBondContact O-N 3.21Å; G666-L668 VanDerWaalsContact C-N 3.31Å; G666-L668 PolarHBondContact O-N 2.96Å; L668-M670 PolarHBondContact O-N 3.22Å; L668-M671 PolarHBondContact O-N 2.81Å; L668-I672 WeakPolarHBondContact O-CD1 3.5Å; L668-I672 VanDerWaalsContact O-CG1 3.23Å; L668-I672 WeakPolarHBondContact O-CG1 3.49Å; L668-I672 PolarHBondContact O-N 2.96Å
669	F	95.5	Very high	92.6	Very high	54 Å²	54	56.1 Å²	56.1	24%	0.237	28%	0.278	C	S	.	.	H	α-helix	trans	-61.8	-41.7	176.2	-66	-25.5	0	0	0	112.8	V585 A588 L589 L592 I665 G666 G673	V585-F669 HydrophobicContact CG1-CD2 4.23Å; V585-F669 HydrophobicContact CG1-CE2 3.97Å; A588-F669 HydrophobicContact CB-CB 3.91Å; L589-F669 HydrophobicContact CB-CD2 3.86Å; L589-F669 HydrophobicContact CB-CE2 3.93Å; L589-F669 HydrophobicContact CD1-CD2 4.44Å; L589-F669 HydrophobicContact CD1-CE2 4.14Å; L589-F669 HydrophobicContact CD1-CZ 4.19Å; L589-F669 HydrophobicContact CG-CE2 4.44Å; L592-F669 HydrophobicContact CD2-CB 4.12Å; L592-F669 HydrophobicContact CD2-CD1 3.83Å; L592-F669 HydrophobicContact CD2-CG 4.21Å; I665-F669 HydrophobicContact CG2-CD2 4.08Å; I665-F669 HydrophobicContact CG2-CE2 3.54Å; I665-F669 HydrophobicContact CG2-CZ 3.84Å; I665-F669 WeakPolarHBondContact O-CG 3.46Å; I665-F669 PolarHBondContact O-N 2.95Å; G666-F669 PolarHBondContact O-N 3.22Å; F669-G673 PolarHBondContact O-N 3.08Å
670	M	92.3	Very high	91.7	Very high	1 Å²	1	57 Å²	57	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-63.1	-43.8	175.9	-68.7	-57.2	-62.3	0	0	111.6	W584 A588 W591 G666 I667 L668 G673 F674 G705 M709	W584-M670 HydrophobicContact CZ2-CG 4.3Å; A588-M670 HydrophobicContact CB-CG 3.78Å; A588-M670 HydrophobicContact CB-SD 3.63Å; W591-M670 HydrophobicContact CD2-CE 4.39Å; W591-M670 HydrophobicContact CD2-SD 4.41Å; W591-M670 HydrophobicContact CE3-CE 4Å; W591-M670 HydrophobicContact CE3-SD 3.76Å; W591-M670 HydrophobicContact CH2-CE 4.26Å; W591-M670 HydrophobicContact CZ3-CE 3.94Å; W591-M670 WeakPolarHBondContact CZ3-O 3.21Å; W591-M670 HydrophobicContact CZ3-SD 4.07Å; G666-M670 WeakPolarHBondContact O-CB 3.46Å; G666-M670 VanDerWaalsContact O-CG 3.24Å; G666-M670 WeakPolarHBondContact O-CG 3.21Å; G666-M670 PolarHBondContact O-N 3.46Å; I667-M670 PolarHBondContact O-N 3.14Å; L668-M670 PolarHBondContact O-N 3.22Å; M670-G673 PolarHBondContact O-N 3Å; M670-F674 HydrophobicContact CE-CE2 4Å; M670-F674 WeakPolarHBondContact O-CD2 3.29Å; M670-F674 PolarHBondContact O-N 3.39Å; M670-G705 WeakPolarHBondContact CE-O 3.36Å; M670-M709 HydrophobicContact CB-CE 3.93Å; M670-M709 HydrophobicContact CB-SD 4.13Å; M670-M709 HydrophobicContact CE-CG 3.97Å
671	M	92.1	Very high	90.5	Very high	96 Å²	96	57.7 Å²	57.7	47%	0.473	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-46.2	177.9	-74.3	-63.5	-68.8	0	0	112	I667 L668 G673 F674 I675 M709	I667-M671 HydrophobicContact CG2-CG 4.21Å; I667-M671 WeakPolarHBondContact O-CB 3.41Å; I667-M671 VanDerWaalsContact O-CG 3.27Å; I667-M671 WeakPolarHBondContact O-CG 3.15Å; I667-M671 PolarHBondContact O-N 3.36Å; L668-M671 PolarHBondContact O-N 2.81Å; M671-G673 VanDerWaalsContact C-N 3.35Å; M671-G673 PolarHBondContact O-N 2.04Å; M671-F674 PolarHBondContact O-N 3.42Å; M671-I675 WeakPolarHBondContact O-CD1 3.33Å; M671-I675 VanDerWaalsContact O-CG1 3.27Å; M671-I675 WeakPolarHBondContact O-CG1 3.33Å; M671-I675 PolarHBondContact O-N 3.3Å; M671-M709 HydrophobicContact CG-CE 4.5Å; M671-M709 HydrophobicContact SD-CE 3.9Å
672	I	93.6	Very high	89.2	Confident	88 Å²	88	55.9 Å²	55.9	45%	0.451	28%	0.284	S	S	.	.	H	α-helix	trans	-62.2	-43.2	177.5	-63.2	160.5	0	0	0	110.5	L592 L668 F674 I675 A676	L592-I672 HydrophobicContact CD1-CB 4.26Å; L592-I672 HydrophobicContact CD1-CG2 3.77Å; L592-I672 HydrophobicContact CD2-CG2 4.42Å; L668-I672 WeakPolarHBondContact O-CD1 3.5Å; L668-I672 VanDerWaalsContact O-CG1 3.23Å; L668-I672 WeakPolarHBondContact O-CG1 3.49Å; L668-I672 PolarHBondContact O-N 2.96Å; I672-F674 PolarHBondContact O-N 3.23Å; I672-I675 PolarHBondContact O-N 2.64Å; I672-A676 WeakPolarHBondContact O-CB 3.44Å; I672-A676 PolarHBondContact O-N 3.35Å
673	G	90.7	Very high	88	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-66.3	-36.5	178.9	0	0	0	0	0	113.1	W591 F669 M670 M671 A676 L677	W591-G673 VanDerWaalsContact CH2-C 3.48Å; W591-G673 VanDerWaalsContact CZ3-CA 3.49Å; F669-G673 PolarHBondContact O-N 3.08Å; M670-G673 PolarHBondContact O-N 3Å; M671-G673 VanDerWaalsContact C-N 3.35Å; M671-G673 PolarHBondContact O-N 2.04Å; G673-A676 PolarHBondContact O-N 2.96Å; G673-L677 WeakPolarHBondContact O-CB 3.49Å; G673-L677 WeakPolarHBondContact O-CG 3.38Å; G673-L677 PolarHBondContact O-N 3.29Å
674	F	89.5	Confident	86.3	Confident	39 Å²	39	61.8 Å²	61.8	17%	0.171	32%	0.32	C	S	.	.	H	α-helix	trans	-66.9	-43.6	172.5	-93.6	-71.2	0	0	0	111.8	W591 M670 M671 I672 A676 L677 F678 M709	W591-F674 HydrophobicContact CH2-CB 4.29Å; W591-F674 HydrophobicContact CH2-CD1 4.29Å; W591-F674 AromaticContact CH2-CD2 3.39Å; W591-F674 HydrophobicContact CH2-CD2 3.39Å; W591-F674 AromaticContact CH2-CE2 3.63Å; W591-F674 HydrophobicContact CH2-CE2 3.63Å; W591-F674 AromaticContact CH2-CG 3.75Å; W591-F674 HydrophobicContact CH2-CG 3.75Å; W591-F674 HydrophobicContact CH2-CZ 4.21Å; W591-F674 HydrophobicContact CZ2-CD2 4.21Å; W591-F674 HydrophobicContact CZ2-CE2 4.04Å; W591-F674 HydrophobicContact CZ2-CZ 4.23Å; W591-F674 HydrophobicContact CZ3-CD2 4.11Å; W591-F674 HydrophobicContact CZ3-CE2 4.46Å; M670-F674 HydrophobicContact CE-CE2 4Å; M670-F674 WeakPolarHBondContact O-CD2 3.29Å; M670-F674 PolarHBondContact O-N 3.39Å; M671-F674 PolarHBondContact O-N 3.42Å; I672-F674 PolarHBondContact O-N 3.23Å; F674-A676 VanDerWaalsContact C-N 3.33Å; F674-A676 PolarHBondContact O-N 2.99Å; F674-L677 PolarHBondContact O-N 3.2Å; F674-F678 HydrophobicContact CB-CD2 4.37Å; F674-F678 HydrophobicContact CB-CE2 4.14Å; F674-F678 HydrophobicContact CD1-CD2 4.46Å; F674-F678 AromaticContact CD1-CE2 3.67Å; F674-F678 HydrophobicContact CD1-CE2 3.67Å; F674-F678 AromaticContact CD1-CZ 3.98Å; F674-F678 HydrophobicContact CD1-CZ 3.98Å; F674-F678 HydrophobicContact CG-CE2 4.33Å; F674-F678 WeakPolarHBondContact O-CD2 3.48Å; F674-F678 WeakPolarHBondContact O-CG 3.28Å; F674-F678 PolarHBondContact O-N 3.49Å; F674-M709 HydrophobicContact CD2-CE 3.72Å; F674-M709 HydrophobicContact CD2-CG 4.26Å; F674-M709 HydrophobicContact CE2-CE 4.01Å; F674-M709 HydrophobicContact CE2-CG 3.55Å; F674-M709 HydrophobicContact CZ-CG 4.34Å
675	I	90.3	Very high	84.5	Confident	110 Å²	110	66.2 Å²	66.2	56%	0.564	34%	0.336	S	S	*	.	H	α-helix	trans	-58.2	-46.8	175.4	-69.6	163.4	0	0	0	110.3	M671 I672 F678 H679	M671-I675 WeakPolarHBondContact O-CD1 3.33Å; M671-I675 VanDerWaalsContact O-CG1 3.27Å; M671-I675 WeakPolarHBondContact O-CG1 3.33Å; M671-I675 PolarHBondContact O-N 3.3Å; I672-I675 PolarHBondContact O-N 2.64Å; I675-F678 PolarHBondContact O-N 2.95Å; I675-H679 WeakPolarHBondContact O-CB 3.27Å; I675-H679 PolarHBondContact O-N 3.09Å
676	A	87.9	Confident	82.7	Confident	24 Å²	24	70.6 Å²	70.6	20%	0.198	36%	0.36	C	S	.	.	H	α-helix	trans	-62.6	-43.9	178	0	0	0	0	0	112.5	I672 G673 F674 F678 H679 I680	I672-A676 WeakPolarHBondContact O-CB 3.44Å; I672-A676 PolarHBondContact O-N 3.35Å; G673-A676 PolarHBondContact O-N 2.96Å; F674-A676 VanDerWaalsContact C-N 3.33Å; F674-A676 PolarHBondContact O-N 2.99Å; A676-F678 PolarHBondContact O-N 3.09Å; A676-H679 PolarHBondContact O-N 2.64Å; A676-I680 WeakPolarHBondContact O-CB 3.37Å; A676-I680 VanDerWaalsContact O-CG1 3.25Å; A676-I680 WeakPolarHBondContact O-CG1 3.27Å; A676-I680 PolarHBondContact O-N 3.04Å
677	L	83.3	Confident	81	Confident	9 Å²	9	78.2 Å²	78.2	5%	0.047	40%	0.395	C	S	.	.	H	α-helix	trans	-61	-41.9	174.4	-78.7	172.6	0	0	0	113	W591 A595 G673 F674 R681 I701	W591-L677 HydrophobicContact CH2-CD1 3.93Å; W591-L677 HydrophobicContact CZ2-CD1 3.37Å; A595-L677 HydrophobicContact CB-CD1 3.99Å; A595-L677 HydrophobicContact CB-CD2 3.9Å; A595-L677 HydrophobicContact CB-CG 3.82Å; G673-L677 WeakPolarHBondContact O-CB 3.49Å; G673-L677 WeakPolarHBondContact O-CG 3.38Å; G673-L677 PolarHBondContact O-N 3.29Å; F674-L677 PolarHBondContact O-N 3.2Å; L677-R681 WeakPolarHBondContact O-CB 3.38Å; L677-R681 WeakPolarHBondContact O-CG 3.09Å; L677-R681 PolarHBondContact O-N 2.71Å; L677-I701 HydrophobicContact CD1-CG2 4.11Å; L677-I701 HydrophobicContact CD2-CG2 4.05Å
678	F	82.5	Confident	79.3	Confident	138 Å²	138	84.6 Å²	84.6	61%	0.605	42%	0.416	S	S	*	.	H	α-helix	trans	-70.1	-37.2	178.1	-70.9	-53.4	0	0	0	111.9	F674 I675 A676 R681 G682	F674-F678 HydrophobicContact CB-CD2 4.37Å; F674-F678 HydrophobicContact CB-CE2 4.14Å; F674-F678 HydrophobicContact CD1-CD2 4.46Å; F674-F678 AromaticContact CD1-CE2 3.67Å; F674-F678 HydrophobicContact CD1-CE2 3.67Å; F674-F678 AromaticContact CD1-CZ 3.98Å; F674-F678 HydrophobicContact CD1-CZ 3.98Å; F674-F678 HydrophobicContact CG-CE2 4.33Å; F674-F678 WeakPolarHBondContact O-CD2 3.48Å; F674-F678 WeakPolarHBondContact O-CG 3.28Å; F674-F678 PolarHBondContact O-N 3.49Å; I675-F678 PolarHBondContact O-N 2.95Å; A676-F678 PolarHBondContact O-N 3.09Å; F678-R681 PolarHBondContact O-N 3.16Å; F678-G682 PolarHBondContact O-N 3.32Å
679	H	84.7	Confident	77.3	Confident	131 Å²	131	86.4 Å²	86.4	61%	0.606	43%	0.434	S	S	*	.	H	α-helix	trans	-62.7	-50.8	173.6	-178.8	-113.4	0	0	0	111.7	I675 A676 R681 G682 T683	I675-H679 WeakPolarHBondContact O-CB 3.27Å; I675-H679 PolarHBondContact O-N 3.09Å; A676-H679 PolarHBondContact O-N 2.64Å; H679-R681 VanDerWaalsContact C-N 3.3Å; H679-R681 PolarHBondContact O-N 2.73Å; H679-G682 PolarHBondContact O-N 3.16Å; H679-G682 VanDerWaalsContact O-N 3.08Å; H679-T683 PolarHBondContact O-N 2.88Å; H679-T683 VanDerWaalsContact O-N 3.14Å; H679-T683 PolarHBondContact O-OG1 3.17Å
680	I	76	Confident	75.3	Confident	33 Å²	33	93.5 Å²	93.5	17%	0.169	46%	0.459	C	S	.	.	H	α-helix	trans	-60.5	-38.3	178.1	-69.4	167.2	0	0	0	111.4	A676 T683 I684	A676-I680 WeakPolarHBondContact O-CB 3.37Å; A676-I680 VanDerWaalsContact O-CG1 3.25Å; A676-I680 WeakPolarHBondContact O-CG1 3.27Å; A676-I680 PolarHBondContact O-N 3.04Å; I680-T683 PolarHBondContact O-OG1 2.77Å; I680-I684 HydrophobicContact CG2-CD1 3.59Å; I680-I684 HydrophobicContact CG2-CG1 4.44Å; I680-I684 WeakPolarHBondContact O-CB 3.49Å; I680-I684 VanDerWaalsContact O-CG1 3.28Å; I680-I684 WeakPolarHBondContact O-CG1 3.5Å; I680-I684 PolarHBondContact O-N 2.69Å; I680-I684 VanDerWaalsContact O-N 3.08Å
681	R	72.5	Confident	73.6	Confident	59 Å²	59	95.2 Å²	95.2	22%	0.223	47%	0.467	C	S	.	.	H	α-helix	trans	-82.6	-12.8	176.6	-69.2	178.8	-178.8	146.9	1.1	114.5	L677 F678 H679 K685 D698	L677-R681 WeakPolarHBondContact O-CB 3.38Å; L677-R681 WeakPolarHBondContact O-CG 3.09Å; L677-R681 PolarHBondContact O-N 2.71Å; F678-R681 PolarHBondContact O-N 3.16Å; H679-R681 VanDerWaalsContact C-N 3.3Å; H679-R681 PolarHBondContact O-N 2.73Å; R681-K685 WeakPolarHBondContact O-CD 3.48Å; R681-K685 WeakPolarHBondContact O-CG 3.07Å; R681-D698 IonicContact CZ-OD1 3.31Å; R681-D698 VanDerWaalsContact CZ-OD1 3.26Å; R681-D698 IonicContact NE-OD1 2.71Å; R681-D698 PolarHBondContact NE-OD1 3.49Å; R681-D698 PolarHBondContact NH2-O 2.78Å; R681-D698 VanDerWaalsContact NH2-O 3.09Å; R681-D698 IonicContact NH2-OD1 3.49Å; R681-D698 PolarHBondContact NH2-OD1 2.71Å
682	G	68.8	Low	71.7	Confident	46 Å²	46	96.4 Å²	96.4	47%	0.474	48%	0.475	S	S	.	.	H	α-helix	trans	-70.1	-50.9	166.2	0	0	0	0	0	110.4	F678 H679	F678-G682 PolarHBondContact O-N 3.32Å; H679-G682 PolarHBondContact O-N 3.16Å; H679-G682 VanDerWaalsContact O-N 3.08Å
683	T	72.2	Confident	69.8	Low	83 Å²	83	95.1 Å²	95.1	51%	0.509	47%	0.467	S	S	.	.	H	α-helix	trans	-73.9	-42.3	-176.3	54.5	0	0	0	0	113.7	H679 I680 K685	H679-T683 PolarHBondContact O-N 2.88Å; H679-T683 VanDerWaalsContact O-N 3.14Å; H679-T683 PolarHBondContact O-OG1 3.17Å; I680-T683 PolarHBondContact O-OG1 2.77Å; T683-K685 PolarHBondContact O-N 3.03Å; T683-K685 VanDerWaalsContact O-N 3.16Å
684	I	60	Low	68.2	Low	87 Å²	87	100.2 Å²	100.2	45%	0.446	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-66.7	-18.8	-175.9	-71.2	176.5	0	0	0	113.5	I680 L686 Q687	I680-I684 HydrophobicContact CG2-CD1 3.59Å; I680-I684 HydrophobicContact CG2-CG1 4.44Å; I680-I684 WeakPolarHBondContact O-CB 3.49Å; I680-I684 VanDerWaalsContact O-CG1 3.28Å; I680-I684 WeakPolarHBondContact O-CG1 3.5Å; I680-I684 PolarHBondContact O-N 2.69Å; I680-I684 VanDerWaalsContact O-N 3.08Å; I684-L686 PolarHBondContact O-N 3.14Å; I684-Q687 PolarHBondContact O-N 2.95Å; I684-Q687 VanDerWaalsContact O-N 3.14Å
685	K	59.9	Low	66.7	Low	179 Å²	179	102.9 Å²	102.9	78%	0.778	51%	0.506	S	S	*	.	G	3₁₀ helix	trans	-61.5	-12.5	-179.2	-87.9	178.5	178.1	-176.2	0	115.5	R681 T683	R681-K685 WeakPolarHBondContact O-CD 3.48Å; R681-K685 WeakPolarHBondContact O-CG 3.07Å; T683-K685 PolarHBondContact O-N 3.03Å; T683-K685 VanDerWaalsContact O-N 3.16Å
686	L	59.9	Low	65.4	Low	156 Å²	156	104.3 Å²	104.3	82%	0.817	51%	0.508	S	S	*	.	G	3₁₀ helix	trans	-102.4	-2.8	177.2	-79	86.5	0	0	0	114.9	I684	I684-L686 PolarHBondContact O-N 3.14Å
687	Q	58.8	Low	64.2	Low	159 Å²	159	108.1 Å²	108.1	74%	0.743	52%	0.524	S	S	*	.	S	Bend	trans	-133.1	115.3	-172.4	-72.1	-172.4	-17.2	0	0	116.5	I684	I684-Q687 PolarHBondContact O-N 2.95Å; I684-Q687 VanDerWaalsContact O-N 3.14Å
688	R	59.7	Low	63.5	Low	187 Å²	187	109.8 Å²	109.8	71%	0.706	53%	0.533	S	S	*	.			trans	67.4	115.3	161.1	-67.6	-176.7	174.9	167.4	0.5	119.4	R690 I691	R688-R690 PolarHBondContact O-N 3.24Å; R688-I691 WeakPolarHBondContact O-CD1 3.11Å; R688-I691 VanDerWaalsContact O-CG1 3.31Å; R688-I691 WeakPolarHBondContact O-CG1 3.3Å
689	P	52.7	Low	63.3	Low	136 Å²	136	110.4 Å²	110.4	88%	0.883	54%	0.535	S	S	*	.	S	Bend	trans	-80.1	71.9	172.2	35	-36.1	0	0	0	113
690	R	54.9	Low	62.9	Low	202 Å²	202	107.6 Å²	107.6	76%	0.762	53%	0.525	S	S	*	.			trans	-116.6	17.6	167.8	-61.1	-168.9	-167.5	169.1	2.8	113.2	R688 I692	R688-R690 PolarHBondContact O-N 3.24Å; R690-I692 PolarHBondContact O-N 3.38Å
691	I	56.3	Low	63.1	Low	37 Å²	37	107 Å²	107	19%	0.19	52%	0.521	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	15.3	-150.6	-32.3	-176.9	0	0	0	114.2	R688 E693 I694 H695	R688-I691 WeakPolarHBondContact O-CD1 3.11Å; R688-I691 VanDerWaalsContact O-CG1 3.31Å; R688-I691 WeakPolarHBondContact O-CG1 3.3Å; I691-E693 VanDerWaalsContact C-N 3.29Å; I691-E693 PolarHBondContact O-N 3.23Å; I691-I694 HydrophobicContact CG2-CB 3.64Å; I691-I694 HydrophobicContact CG2-CD1 4.45Å; I691-I694 HydrophobicContact CG2-CG2 3.8Å; I691-I694 PolarHBondContact O-N 3.03Å; I691-H695 VanDerWaalsContact CG2-CE1 3.45Å; I691-H695 WeakPolarHBondContact CG2-CE1 3.25Å; I691-H695 WeakPolarHBondContact CG2-ND1 3.49Å; I691-H695 WeakPolarHBondContact O-CB 3.42Å; I691-H695 PolarHBondContact O-CD2 3.33Å; I691-H695 VanDerWaalsContact O-CD2 3.31Å; I691-H695 PolarHBondContact O-N 3.39Å
692	I	51.8	Low	63.7	Low	122 Å²	122	107 Å²	107	63%	0.626	53%	0.525	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-33.4	-171.7	-62.4	179.5	0	0	0	113.2	R690	R690-I692 PolarHBondContact O-N 3.38Å
693	E	54.1	Low	64.5	Low	61 Å²	61	110.6 Å²	110.6	29%	0.285	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-41.7	179.5	-75.4	144.3	-150.7	0	0	112.2	I691 H695 K696 L697 K874 Y875	I691-E693 VanDerWaalsContact C-N 3.29Å; I691-E693 PolarHBondContact O-N 3.23Å; E693-H695 VanDerWaalsContact C-N 3.27Å; E693-H695 PolarHBondContact O-N 3.42Å; E693-K696 WeakPolarHBondContact O-CB 3.37Å; E693-K696 PolarHBondContact O-N 2.98Å; E693-L697 PolarHBondContact O-N 2.88Å; E693-K874 VanDerWaalsContact OE1-CE 3.23Å; E693-K874 WeakPolarHBondContact OE1-CE 3.45Å; E693-Y875 HydrophobicContact CG-CE1 3.69Å; E693-Y875 VanDerWaalsContact OE2-CE1 3.26Å; E693-Y875 WeakPolarHBondContact OE2-CE1 3.27Å
694	I	56.1	Low	65.1	Low	107 Å²	107	106.8 Å²	106.8	55%	0.549	50%	0.501	S	S	.	.	H	α-helix	trans	-58	-40.5	174.8	-63.4	166.5	0	0	0	110.6	I691 K696 L697 D698	I691-I694 HydrophobicContact CG2-CB 3.64Å; I691-I694 HydrophobicContact CG2-CD1 4.45Å; I691-I694 HydrophobicContact CG2-CG2 3.8Å; I691-I694 PolarHBondContact O-N 3.03Å; I694-K696 PolarHBondContact O-N 3.29Å; I694-K696 VanDerWaalsContact O-N 3.13Å; I694-L697 PolarHBondContact O-N 3.06Å; I694-L697 VanDerWaalsContact O-N 3.1Å; I694-D698 PolarHBondContact O-N 3.18Å
695	H	59.3	Low	66.4	Low	94 Å²	94	102.7 Å²	102.7	44%	0.435	48%	0.48	S	S	.	.	H	α-helix	trans	-61.2	-19.7	175	-77.3	-25.3	0	0	0	114.8	I691 E693 D698 K699	I691-H695 VanDerWaalsContact CG2-CE1 3.45Å; I691-H695 WeakPolarHBondContact CG2-CE1 3.25Å; I691-H695 WeakPolarHBondContact CG2-ND1 3.49Å; I691-H695 WeakPolarHBondContact O-CB 3.42Å; I691-H695 PolarHBondContact O-CD2 3.33Å; I691-H695 VanDerWaalsContact O-CD2 3.31Å; I691-H695 PolarHBondContact O-N 3.39Å; E693-H695 VanDerWaalsContact C-N 3.27Å; E693-H695 PolarHBondContact O-N 3.42Å; H695-D698 IonicContact ND1-OD2 3.68Å; H695-K699 WeakPolarHBondContact O-CD 3.18Å; H695-K699 VanDerWaalsContact O-CG 3.27Å; H695-K699 WeakPolarHBondContact O-CG 3.28Å; H695-K699 PolarHBondContact O-N 3.23Å
696	K	61.4	Low	67.7	Low	141 Å²	141	99 Å²	99	61%	0.613	47%	0.468	S	S	*	.	H	α-helix	trans	-79.2	-42.5	173.4	-64.6	-178.6	-178.5	179	0	110.8	E693 I694 K699 L700	E693-K696 WeakPolarHBondContact O-CB 3.37Å; E693-K696 PolarHBondContact O-N 2.98Å; I694-K696 PolarHBondContact O-N 3.29Å; I694-K696 VanDerWaalsContact O-N 3.13Å; K696-K699 PolarHBondContact O-N 2.66Å; K696-L700 PolarHBondContact O-N 3.34Å
697	L	62.5	Low	68.9	Low	104 Å²	104	92.2 Å²	92.2	55%	0.545	43%	0.431	S	S	.	.	H	α-helix	trans	-67.2	-42.5	176	-171.8	62.2	0	0	0	111.4	E693 I694 K699 L700 I701	E693-L697 PolarHBondContact O-N 2.88Å; I694-L697 PolarHBondContact O-N 3.06Å; I694-L697 VanDerWaalsContact O-N 3.1Å; L697-K699 VanDerWaalsContact C-N 3.29Å; L697-K699 PolarHBondContact O-N 3.08Å; L697-L700 WeakPolarHBondContact O-CB 3.45Å; L697-L700 PolarHBondContact O-N 3.41Å; L697-L700 VanDerWaalsContact O-N 3.11Å; L697-I701 HydrophobicContact CD1-CD1 4.25Å; L697-I701 HydrophobicContact CD1-CG1 4.49Å; L697-I701 HydrophobicContact CG-CD1 3.93Å; L697-I701 WeakPolarHBondContact O-CG1 3.11Å; L697-I701 PolarHBondContact O-N 2.79Å
698	D	70.3	Confident	70.1	Confident	43 Å²	43	84.7 Å²	84.7	23%	0.23	40%	0.397	C	S	.	.	H	α-helix	trans	-49.3	-48.2	171.1	-96.4	-47.7	0	0	0	112.4	R681 I694 H695 I702	R681-D698 IonicContact CZ-OD1 3.31Å; R681-D698 VanDerWaalsContact CZ-OD1 3.26Å; R681-D698 IonicContact NE-OD1 2.71Å; R681-D698 PolarHBondContact NE-OD1 3.49Å; R681-D698 PolarHBondContact NH2-O 2.78Å; R681-D698 VanDerWaalsContact NH2-O 3.09Å; R681-D698 IonicContact NH2-OD1 3.49Å; R681-D698 PolarHBondContact NH2-OD1 2.71Å; I694-D698 PolarHBondContact O-N 3.18Å; H695-D698 IonicContact ND1-OD2 3.68Å; D698-I702 WeakPolarHBondContact O-CD1 3.44Å; D698-I702 WeakPolarHBondContact O-CG1 3.16Å; D698-I702 PolarHBondContact O-N 3.31Å
699	K	77	Confident	71.4	Confident	151 Å²	151	78.2 Å²	78.2	66%	0.657	38%	0.375	S	S	*	.	H	α-helix	trans	-68.6	-33.5	-178.7	-77	175.4	179.4	-176.5	0	112.5	H695 K696 L697 R703	H695-K699 WeakPolarHBondContact O-CD 3.18Å; H695-K699 VanDerWaalsContact O-CG 3.27Å; H695-K699 WeakPolarHBondContact O-CG 3.28Å; H695-K699 PolarHBondContact O-N 3.23Å; K696-K699 PolarHBondContact O-N 2.66Å; L697-K699 VanDerWaalsContact C-N 3.29Å; L697-K699 PolarHBondContact O-N 3.08Å; K699-R703 PolarHBondContact O-N 3.01Å; K699-R703 VanDerWaalsContact O-N 3.15Å
700	L	76.5	Confident	73.1	Confident	72 Å²	72	75.5 Å²	75.5	38%	0.377	35%	0.352	S	S	.	.	H	α-helix	trans	-68	-50.4	175.5	-158.1	68.5	0	0	0	110.6	E437 K696 L697 I702 R703 I704	E437-L700 WeakPolarHBondContact OE1-CD1 3.33Å; E437-L700 WeakPolarHBondContact OE1-CD2 3.43Å; E437-L700 VanDerWaalsContact OE1-CG 3.24Å; E437-L700 WeakPolarHBondContact OE1-CG 3.44Å; K696-L700 PolarHBondContact O-N 3.34Å; L697-L700 WeakPolarHBondContact O-CB 3.45Å; L697-L700 PolarHBondContact O-N 3.41Å; L697-L700 VanDerWaalsContact O-N 3.11Å; L700-I702 VanDerWaalsContact C-N 3.33Å; L700-I702 PolarHBondContact O-N 3.43Å; L700-R703 WeakPolarHBondContact O-CB 3.34Å; L700-R703 PolarHBondContact O-N 2.92Å; L700-I704 WeakPolarHBondContact O-CG1 3.3Å; L700-I704 PolarHBondContact O-N 3.45Å
701	I	81.3	Confident	74.7	Confident	20 Å²	20	66 Å²	66	10%	0.103	32%	0.317	C	S	.	.	H	α-helix	trans	-63.5	-36.7	179.2	-63.9	171.6	0	0	0	111.3	W591 A595 L677 L697 G705	W591-I701 PolarHBondContact NE1-O 3.32Å; A595-I701 HydrophobicContact CB-CG2 3.64Å; L677-I701 HydrophobicContact CD1-CG2 4.11Å; L677-I701 HydrophobicContact CD2-CG2 4.05Å; L697-I701 HydrophobicContact CD1-CD1 4.25Å; L697-I701 HydrophobicContact CD1-CG1 4.49Å; L697-I701 HydrophobicContact CG-CD1 3.93Å; L697-I701 WeakPolarHBondContact O-CG1 3.11Å; L697-I701 PolarHBondContact O-N 2.79Å; I701-G705 PolarHBondContact O-N 3.21Å
702	I	84.1	Confident	76.4	Confident	59 Å²	59	65 Å²	65	30%	0.303	31%	0.312	S	S	.	.	H	α-helix	trans	-58.7	-49.1	169.7	-70.7	159.4	0	0	0	111.1	D698 L700 I704 G705 I706	D698-I702 WeakPolarHBondContact O-CD1 3.44Å; D698-I702 WeakPolarHBondContact O-CG1 3.16Å; D698-I702 PolarHBondContact O-N 3.31Å; L700-I702 VanDerWaalsContact C-N 3.33Å; L700-I702 PolarHBondContact O-N 3.43Å; I702-I704 VanDerWaalsContact C-N 3.34Å; I702-I704 PolarHBondContact O-N 2.98Å; I702-G705 PolarHBondContact O-N 3.03Å; I702-G705 VanDerWaalsContact O-N 3.13Å; I702-I706 HydrophobicContact CG2-CD1 3.55Å; I702-I706 HydrophobicContact CG2-CG1 4.14Å; I702-I706 WeakPolarHBondContact O-CG1 3.41Å; I702-I706 PolarHBondContact O-N 2.83Å
703	R	85.6	Confident	78.4	Confident	123 Å²	123	63.7 Å²	63.7	46%	0.464	31%	0.305	S	S	.	.	H	α-helix	trans	-60.2	-44.7	-175.5	-177.4	-174.1	-73.4	-140.2	-6.8	111.3	K699 L700 G705 Y707	K699-R703 PolarHBondContact O-N 3.01Å; K699-R703 VanDerWaalsContact O-N 3.15Å; L700-R703 WeakPolarHBondContact O-CB 3.34Å; L700-R703 PolarHBondContact O-N 2.92Å; R703-G705 VanDerWaalsContact C-N 3.33Å; R703-Y707 VanDerWaalsContact O-CB 3.3Å; R703-Y707 WeakPolarHBondContact O-CB 3.09Å; R703-Y707 PolarHBondContact O-N 2.67Å
704	I	85.7	Confident	80.3	Confident	3 Å²	3	61.1 Å²	61.1	2%	0.015	29%	0.294	C	S	.	.	H	α-helix	trans	-62.7	-41.9	176.2	-58.6	163.6	0	0	0	110.3	P436 E437 L587 W591 L700 I702 Y707 G708 W789	P436-I704 HydrophobicContact CG-CD1 4.1Å; E437-I704 HydrophobicContact CG-CD1 3.58Å; E437-I704 HydrophobicContact CG-CG1 4.24Å; L587-I704 HydrophobicContact CD1-CG2 4.03Å; W591-I704 HydrophobicContact CB-CG2 4.35Å; W591-I704 HydrophobicContact CG-CG2 4.19Å; L700-I704 WeakPolarHBondContact O-CG1 3.3Å; L700-I704 PolarHBondContact O-N 3.45Å; I702-I704 VanDerWaalsContact C-N 3.34Å; I702-I704 PolarHBondContact O-N 2.98Å; I704-Y707 PolarHBondContact O-N 3.27Å; I704-G708 PolarHBondContact O-N 3Å; I704-W789 HydrophobicContact CG1-CZ2 4.42Å
705	G	87.6	Confident	82.1	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-64.4	-44.1	178.6	0	0	0	0	0	114	W591 M670 I701 I702 R703 G708 M709	W591-G705 VanDerWaalsContact CZ2-CA 3.43Å; M670-G705 WeakPolarHBondContact CE-O 3.36Å; I701-G705 PolarHBondContact O-N 3.21Å; I702-G705 PolarHBondContact O-N 3.03Å; I702-G705 VanDerWaalsContact O-N 3.13Å; R703-G705 VanDerWaalsContact C-N 3.33Å; G705-G708 PolarHBondContact O-N 2.04Å; G705-M709 PolarHBondContact O-N 3.09Å; G705-M709 VanDerWaalsContact O-N 3.09Å
706	I	86.9	Confident	83.8	Confident	103 Å²	103	54.3 Å²	54.3	53%	0.528	26%	0.262	S	S	.	.	H	α-helix	trans	-65.2	-41.8	175.6	-67.4	174.9	0	0	0	110.4	I702 M709 L710	I702-I706 HydrophobicContact CG2-CD1 3.55Å; I702-I706 HydrophobicContact CG2-CG1 4.14Å; I702-I706 WeakPolarHBondContact O-CG1 3.41Å; I702-I706 PolarHBondContact O-N 2.83Å; I706-M709 PolarHBondContact O-N 3.46Å; I706-L710 PolarHBondContact O-N 2.94Å
707	Y	83.7	Confident	85.5	Confident	12 Å²	12	49.7 Å²	49.7	5%	0.047	24%	0.244	C	C	.	.	H	α-helix	trans	-61.4	-47.6	175.7	179	-85.1	0	0	0	112.1	L440 L443 L587 R703 I704 M709 L710 Y711 I785 S786 W789	L440-Y707 HydrophobicContact CD1-CD1 3.58Å; L440-Y707 HydrophobicContact CD1-CD2 4.37Å; L440-Y707 HydrophobicContact CD1-CE1 3.46Å; L440-Y707 VanDerWaalsContact CD1-CE1 3.46Å; L440-Y707 HydrophobicContact CD1-CE2 4.23Å; L440-Y707 HydrophobicContact CD1-CG 4.08Å; L440-Y707 HydrophobicContact CG-CE1 3.99Å; L443-Y707 HydrophobicContact CD2-CE1 4.34Å; L587-Y707 HydrophobicContact CD2-CD1 4.17Å; L587-Y707 HydrophobicContact CD2-CE1 4.25Å; R703-Y707 VanDerWaalsContact O-CB 3.3Å; R703-Y707 WeakPolarHBondContact O-CB 3.09Å; R703-Y707 PolarHBondContact O-N 2.67Å; I704-Y707 PolarHBondContact O-N 3.27Å; Y707-M709 PolarHBondContact O-N 3.27Å; Y707-L710 PolarHBondContact O-N 3.09Å; Y707-L710 VanDerWaalsContact O-N 3.08Å; Y707-Y711 PolarHBondContact O-N 3.35Å; Y707-Y711 VanDerWaalsContact O-N 3.15Å; Y707-I785 HydrophobicContact CD2-CG2 4.25Å; Y707-I785 HydrophobicContact CE2-CG2 3.59Å; Y707-S786 WeakPolarHBondContact OH-CA 3.41Å; Y707-S786 WeakPolarHBondContact OH-CB 3.26Å; Y707-S786 PolarHBondContact OH-N 2.94Å; Y707-W789 HydrophobicContact CD2-CB 3.72Å; Y707-W789 AromaticContact CD2-CD1 3.87Å; Y707-W789 HydrophobicContact CD2-CG 4.02Å; Y707-W789 HydrophobicContact CE2-CB 3.83Å; Y707-W789 HydrophobicContact CE2-CG 4.44Å; Y707-W789 AromaticContact CG-CD1 3.98Å; Y707-W789 HydrophobicContact CG-CG 4.42Å
708	G	84.8	Confident	87.1	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-60.9	-30.9	177.3	0	0	0	0	0	113.3	W584 I704 G705	W584-G708 PolarHBondContact NE1-O 2.97Å; I704-G708 PolarHBondContact O-N 3Å; G705-G708 PolarHBondContact O-N 2.04Å
709	M	86.1	Confident	88.3	Confident	52 Å²	52	43.5 Å²	43.5	26%	0.256	21%	0.211	S	C	.	.	H	α-helix	trans	-74.6	-40.5	170.7	-78.6	-65.1	-159.8	0	0	112.6	M670 M671 F674 G705 I706 Y707 Y711 T712	M670-M709 HydrophobicContact CB-CE 3.93Å; M670-M709 HydrophobicContact CB-SD 4.13Å; M670-M709 HydrophobicContact CE-CG 3.97Å; M671-M709 HydrophobicContact CG-CE 4.5Å; M671-M709 HydrophobicContact SD-CE 3.9Å; F674-M709 HydrophobicContact CD2-CE 3.72Å; F674-M709 HydrophobicContact CD2-CG 4.26Å; F674-M709 HydrophobicContact CE2-CE 4.01Å; F674-M709 HydrophobicContact CE2-CG 3.55Å; F674-M709 HydrophobicContact CZ-CG 4.34Å; G705-M709 PolarHBondContact O-N 3.09Å; G705-M709 VanDerWaalsContact O-N 3.09Å; I706-M709 PolarHBondContact O-N 3.46Å; Y707-M709 PolarHBondContact O-N 3.27Å; M709-Y711 PolarHBondContact O-N 2.98Å; M709-T712 WeakPolarHBondContact O-CB 3.26Å; M709-T712 PolarHBondContact O-N 3.1Å; M709-T712 PolarHBondContact O-OG1 3.19Å
710	L	89.3	Confident	89.2	Confident	78 Å²	78	39.3 Å²	39.3	41%	0.408	19%	0.193	S	C	.	.	H	α-helix	trans	-59.6	-33	178.4	-176.6	59.4	0	0	0	112.1	I706 Y707 T712 I713 P714 I785	I706-L710 PolarHBondContact O-N 2.94Å; Y707-L710 PolarHBondContact O-N 3.09Å; Y707-L710 VanDerWaalsContact O-N 3.08Å; L710-T712 VanDerWaalsContact C-N 3.26Å; L710-T712 PolarHBondContact O-N 3.28Å; L710-I713 PolarHBondContact O-N 3.08Å; L710-P714 WeakPolarHBondContact O-CD 3.29Å; L710-I785 HydrophobicContact CD2-CD1 4.42Å; L710-I785 HydrophobicContact CD2-CG1 4.48Å; L710-I785 HydrophobicContact CD2-CG2 3.76Å; L710-I785 HydrophobicContact CG-CD1 4.28Å; L710-I785 HydrophobicContact CG-CG2 4.2Å
711	Y	88.7	Confident	90.1	Very high	4 Å²	4	36 Å²	36	2%	0.016	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-30.9	171.9	-170.7	-82.7	0	0	0	113.9	L443 Y447 A580 W584 Y707 M709 I713 N715 I782	L443-Y711 HydrophobicContact CD1-CE2 3.68Å; L443-Y711 HydrophobicContact CD2-CD2 3.97Å; L443-Y711 HydrophobicContact CD2-CE2 3.73Å; L443-Y711 HydrophobicContact CG-CE2 4.1Å; Y447-Y711 HydrophobicContact CE2-CE2 4.12Å; Y447-Y711 PolarHBondContact OH-OH 2.93Å; A580-Y711 PolarHBondContact O-OH 2.9Å; W584-Y711 HydrophobicContact CB-CD1 3.97Å; W584-Y711 HydrophobicContact CB-CE1 3.51Å; W584-Y711 HydrophobicContact CB-CE2 4.14Å; W584-Y711 HydrophobicContact CB-CG 4.48Å; W584-Y711 AromaticContact CD1-CD1 3.21Å; W584-Y711 AromaticContact CD1-CD2 3.9Å; W584-Y711 AromaticContact CD1-CE1 3.74Å; W584-Y711 AromaticContact CD1-CG 3.32Å; W584-Y711 AromaticContact CD2-CD1 3.51Å; W584-Y711 HydrophobicContact CD2-CD1 3.51Å; W584-Y711 AromaticContact CD2-CE1 3.66Å; W584-Y711 HydrophobicContact CD2-CE1 3.66Å; W584-Y711 HydrophobicContact CD2-CG 4.39Å; W584-Y711 AromaticContact CE2-CD1 3.64Å; W584-Y711 HydrophobicContact CE3-CD1 4.32Å; W584-Y711 HydrophobicContact CE3-CE1 4.18Å; W584-Y711 AromaticContact CG-CD1 3.27Å; W584-Y711 HydrophobicContact CG-CD1 3.27Å; W584-Y711 HydrophobicContact CG-CD2 4.32Å; W584-Y711 AromaticContact CG-CE1 3.32Å; W584-Y711 HydrophobicContact CG-CE1 3.32Å; W584-Y711 HydrophobicContact CG-CE2 4.34Å; W584-Y711 AromaticContact CG-CG 3.82Å; W584-Y711 HydrophobicContact CG-CG 3.82Å; W584-Y711 AromaticContact CG-CZ 3.89Å; W584-Y711 AromaticContact NE1-CD1 3.42Å; W584-Y711 AromaticContact NE1-CG 3.63Å; Y707-Y711 PolarHBondContact O-N 3.35Å; Y707-Y711 VanDerWaalsContact O-N 3.15Å; M709-Y711 PolarHBondContact O-N 2.98Å; Y711-I713 VanDerWaalsContact C-N 3.31Å; Y711-I713 PolarHBondContact O-N 3.44Å; Y711-N715 VanDerWaalsContact CD1-ND2 3.26Å; Y711-N715 WeakPolarHBondContact CD1-ND2 3.45Å; Y711-N715 WeakPolarHBondContact CE1-ND2 3.2Å; Y711-N715 PolarHBondContact O-ND2 3.32Å; Y711-I782 HydrophobicContact CD2-CG2 3.43Å; Y711-I782 VanDerWaalsContact CD2-CG2 3.43Å; Y711-I782 HydrophobicContact CE2-CG2 3.19Å; Y711-I782 HydrophobicContact CG-CG2 4.48Å
712	T	92.1	Very high	90.6	Very high	14 Å²	14	35.5 Å²	35.5	9%	0.086	17%	0.173	C	C	.	.	H	α-helix	trans	-66.6	-32	-178	65.1	0	0	0	0	112.8	W584 I667 M709 L710 N715 L716	W584-T712 HydrophobicContact CH2-CG2 4Å; W584-T712 HydrophobicContact CZ2-CG2 3.47Å; W584-T712 VanDerWaalsContact CZ2-CG2 3.47Å; I667-T712 HydrophobicContact CG1-CG2 3.97Å; M709-T712 WeakPolarHBondContact O-CB 3.26Å; M709-T712 PolarHBondContact O-N 3.1Å; M709-T712 PolarHBondContact O-OG1 3.19Å; L710-T712 VanDerWaalsContact C-N 3.26Å; L710-T712 PolarHBondContact O-N 3.28Å; T712-N715 PolarHBondContact O-N 2.91Å; T712-L716 WeakPolarHBondContact O-CB 3.38Å; T712-L716 WeakPolarHBondContact O-CG 3.31Å; T712-L716 PolarHBondContact O-N 3.3Å
713	I	92.8	Very high	91.1	Very high	95 Å²	95	33.6 Å²	33.6	49%	0.487	17%	0.168	S	C	.	.	H	α-helix	trans	-68.1	-51.6	-170.8	-61.7	171.2	0	0	0	111.6	L710 Y711 N715 L716 I717	L710-I713 PolarHBondContact O-N 3.08Å; Y711-I713 VanDerWaalsContact C-N 3.31Å; Y711-I713 PolarHBondContact O-N 3.44Å; I713-N715 VanDerWaalsContact C-N 3.29Å; I713-N715 PolarHBondContact O-N 3.46Å; I713-L716 PolarHBondContact O-N 2.96Å; I713-I717 HydrophobicContact CG2-CD1 4.15Å; I713-I717 WeakPolarHBondContact O-CG1 3.47Å; I713-I717 PolarHBondContact O-N 2.85Å
714	P	94.6	Very high	91.5	Very high	7 Å²	7	29.4 Å²	29.4	5%	0.045	15%	0.152	C	C	.	.	H	α-helix	trans	-61.7	-36	175.1	-23.4	34.4	0	0	0	113	L710 I717 V718 M778 I782 I785	L710-P714 WeakPolarHBondContact O-CD 3.29Å; P714-I717 PolarHBondContact O-N 3.03Å; P714-V718 WeakPolarHBondContact O-CG2 3.38Å; P714-V718 PolarHBondContact O-N 3.21Å; P714-M778 HydrophobicContact CB-CB 4.17Å; P714-M778 WeakPolarHBondContact CB-O 3.37Å; P714-M778 HydrophobicContact CB-SD 4.18Å; P714-I782 HydrophobicContact CB-CD1 4.04Å; P714-I782 HydrophobicContact CB-CG1 3.72Å; P714-I782 HydrophobicContact CG-CG1 4.04Å; P714-I785 HydrophobicContact CG-CD1 4.42Å
715	N	93.8	Very high	91.8	Very high	19 Å²	19	29.5 Å²	29.5	10%	0.102	15%	0.153	C	C	.	.	H	α-helix	trans	-69.7	-37.7	179.7	-75.6	-85.3	0	0	0	112.8	L663 Y711 T712 I713 I717 V718 L719 I782	L663-N715 HydrophobicContact CD1-CB 4.14Å; Y711-N715 VanDerWaalsContact CD1-ND2 3.26Å; Y711-N715 WeakPolarHBondContact CD1-ND2 3.45Å; Y711-N715 WeakPolarHBondContact CE1-ND2 3.2Å; Y711-N715 PolarHBondContact O-ND2 3.32Å; T712-N715 PolarHBondContact O-N 2.91Å; I713-N715 VanDerWaalsContact C-N 3.29Å; I713-N715 PolarHBondContact O-N 3.46Å; N715-I717 VanDerWaalsContact C-N 3.31Å; N715-I717 PolarHBondContact O-N 3.38Å; N715-V718 PolarHBondContact O-N 3.25Å; N715-L719 VanDerWaalsContact O-CB 3.27Å; N715-L719 WeakPolarHBondContact O-CB 3.36Å; N715-L719 PolarHBondContact O-N 3.09Å; N715-I782 WeakPolarHBondContact ND2-CD1 3.49Å
716	L	95.5	Very high	91.9	Very high	40 Å²	40	30.6 Å²	30.6	21%	0.209	16%	0.158	C	C	.	.	H	α-helix	trans	-61.7	-39.2	171.1	-77.6	164.2	0	0	0	111.7	F23 L663 T712 I713 F720	F23-L716 HydrophobicContact CZ-CD2 4.18Å; L663-L716 HydrophobicContact CD2-CD2 3.74Å; L663-L716 HydrophobicContact CD2-CG 4.05Å; T712-L716 WeakPolarHBondContact O-CB 3.38Å; T712-L716 WeakPolarHBondContact O-CG 3.31Å; T712-L716 PolarHBondContact O-N 3.3Å; I713-L716 PolarHBondContact O-N 2.96Å; L716-F720 WeakPolarHBondContact O-CB 3.29Å; L716-F720 PolarHBondContact O-N 2.92Å
717	I	96.4	Very high	92.1	Very high	44 Å²	44	31.6 Å²	31.6	23%	0.226	16%	0.155	C	C	.	.	H	α-helix	trans	-68.4	-47.4	177.1	-63.7	165	0	0	0	110.6	I713 P714 N715 L719 F720 I721 L774 M778	I713-I717 HydrophobicContact CG2-CD1 4.15Å; I713-I717 WeakPolarHBondContact O-CG1 3.47Å; I713-I717 PolarHBondContact O-N 2.85Å; P714-I717 PolarHBondContact O-N 3.03Å; N715-I717 VanDerWaalsContact C-N 3.31Å; N715-I717 PolarHBondContact O-N 3.38Å; I717-L719 PolarHBondContact O-N 3.07Å; I717-F720 PolarHBondContact O-N 3.48Å; I717-I721 HydrophobicContact CG2-CD1 3.85Å; I717-I721 VanDerWaalsContact O-CG1 3.27Å; I717-I721 WeakPolarHBondContact O-CG1 3.06Å; I717-I721 PolarHBondContact O-N 3.42Å; I717-L774 HydrophobicContact CG2-CD2 4.19Å; I717-L774 HydrophobicContact CG2-CG 4.31Å; I717-M778 HydrophobicContact CB-CG 4.32Å; I717-M778 HydrophobicContact CD1-CE 3.87Å; I717-M778 HydrophobicContact CD1-CG 4.49Å; I717-M778 HydrophobicContact CD1-SD 4Å; I717-M778 HydrophobicContact CG2-CG 3.9Å
718	V	96	Very high	92.5	Very high	12 Å²	12	32 Å²	32	7%	0.073	16%	0.159	C	C	.	.	H	α-helix	trans	-59.5	-44.5	176.3	169.6	0	0	0	0	111.3	P714 N715 F720 I721 I722 M778	P714-V718 WeakPolarHBondContact O-CG2 3.38Å; P714-V718 PolarHBondContact O-N 3.21Å; N715-V718 PolarHBondContact O-N 3.25Å; V718-F720 PolarHBondContact O-N 3.39Å; V718-I721 PolarHBondContact O-N 2.77Å; V718-I722 HydrophobicContact CG1-CD1 3.76Å; V718-I722 HydrophobicContact CG1-CG1 4.49Å; V718-I722 VanDerWaalsContact O-CG1 3.31Å; V718-I722 WeakPolarHBondContact O-CG1 3.34Å; V718-I722 PolarHBondContact O-N 3.21Å; V718-M778 HydrophobicContact CG2-CB 3.76Å
719	L	95.6	Very high	92.7	Very high	4 Å²	4	32.8 Å²	32.8	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-64.9	-39.3	178.5	-173.4	64.9	0	0	0	112.4	F656 L659 L660 L663 N715 I717 I722 G723	F656-L719 HydrophobicContact CD2-CD1 3.52Å; F656-L719 HydrophobicContact CD2-CG 4.39Å; F656-L719 HydrophobicContact CE2-CD1 3.63Å; F656-L719 HydrophobicContact CE2-CG 4.03Å; F656-L719 HydrophobicContact CG-CD1 4.18Å; F656-L719 HydrophobicContact CZ-CD1 4.36Å; L659-L719 HydrophobicContact CB-CD1 4.14Å; L660-L719 HydrophobicContact CB-CD1 4.41Å; L660-L719 HydrophobicContact CB-CD2 4.17Å; L660-L719 HydrophobicContact CD1-CD2 3.86Å; L663-L719 HydrophobicContact CD2-CD2 3.72Å; N715-L719 VanDerWaalsContact O-CB 3.27Å; N715-L719 WeakPolarHBondContact O-CB 3.36Å; N715-L719 PolarHBondContact O-N 3.09Å; I717-L719 PolarHBondContact O-N 3.07Å; L719-I722 PolarHBondContact O-N 3.5Å; L719-G723 PolarHBondContact O-N 2.85Å
720	F	95.3	Very high	92.8	Very high	64 Å²	64	34.3 Å²	34.3	28%	0.281	17%	0.167	S	C	.	.	H	α-helix	trans	-61.2	-42.5	172.8	172.6	-98.1	0	0	0	112	Y22 I26 L716 I717 V718 G723 Y724	Y22-F720 HydrophobicContact CD1-CE2 4.16Å; Y22-F720 AromaticContact CE1-CE2 3.54Å; Y22-F720 HydrophobicContact CE1-CE2 3.54Å; Y22-F720 AromaticContact CE1-CZ 3.86Å; Y22-F720 HydrophobicContact CE1-CZ 3.86Å; I26-F720 HydrophobicContact CD1-CD2 4.32Å; I26-F720 HydrophobicContact CD1-CE2 3.75Å; L716-F720 WeakPolarHBondContact O-CB 3.29Å; L716-F720 PolarHBondContact O-N 2.92Å; I717-F720 PolarHBondContact O-N 3.48Å; V718-F720 PolarHBondContact O-N 3.39Å; F720-G723 PolarHBondContact O-N 2.96Å; F720-Y724 PolarHBondContact O-N 3.01Å
721	I	95.6	Very high	92.9	Very high	3 Å²	3	32.1 Å²	32.1	2%	0.015	16%	0.155	C	C	.	.	H	α-helix	trans	-67.4	-40.5	178.7	-62.2	164.4	0	0	0	111.2	I717 V718 G723 Y724 E725 I771 L774 K775	I717-I721 HydrophobicContact CG2-CD1 3.85Å; I717-I721 VanDerWaalsContact O-CG1 3.27Å; I717-I721 WeakPolarHBondContact O-CG1 3.06Å; I717-I721 PolarHBondContact O-N 3.42Å; V718-I721 PolarHBondContact O-N 2.77Å; I721-G723 VanDerWaalsContact C-N 3.27Å; I721-G723 PolarHBondContact O-N 2.84Å; I721-Y724 WeakPolarHBondContact O-CB 3.09Å; I721-Y724 PolarHBondContact O-N 3.42Å; I721-Y724 VanDerWaalsContact O-N 3.13Å; I721-E725 WeakPolarHBondContact CG2-OE1 3.32Å; I721-E725 WeakPolarHBondContact O-CG 3.1Å; I721-E725 PolarHBondContact O-N 3.14Å; I721-I771 HydrophobicContact CB-CG2 4.36Å; I721-I771 HydrophobicContact CD1-CG2 4.45Å; I721-I771 HydrophobicContact CG1-CG2 3.97Å; I721-I771 HydrophobicContact CG2-CG2 3.6Å; I721-L774 HydrophobicContact CD1-CB 4.23Å; I721-L774 HydrophobicContact CD1-CD2 4.09Å; I721-L774 HydrophobicContact CD1-CG 4.02Å; I721-K775 HydrophobicContact CD1-CB 4.11Å; I721-K775 HydrophobicContact CG2-CB 4.03Å; I721-K775 HydrophobicContact CG2-CD 4.1Å; I721-K775 HydrophobicContact CG2-CG 4.33Å
722	I	93.1	Very high	93	Very high	9 Å²	9	32.3 Å²	32.3	5%	0.046	16%	0.156	C	C	.	.	H	α-helix	trans	-61.8	-37.1	173.8	-65.2	163	0	0	0	110.8	F651 T655 F656 L659 V718 L719 E725 L726	F651-I722 HydrophobicContact CD1-CG2 4.48Å; F651-I722 HydrophobicContact CE1-CG2 3.82Å; F651-I722 HydrophobicContact CZ-CG2 3.95Å; T655-I722 HydrophobicContact CG2-CD1 4.08Å; F656-I722 HydrophobicContact CB-CG2 4.08Å; F656-I722 HydrophobicContact CD2-CB 4.35Å; F656-I722 HydrophobicContact CD2-CG2 3.88Å; F656-I722 HydrophobicContact CG-CG2 4.48Å; L659-I722 HydrophobicContact CD1-CD1 3.88Å; V718-I722 HydrophobicContact CG1-CD1 3.76Å; V718-I722 HydrophobicContact CG1-CG1 4.49Å; V718-I722 VanDerWaalsContact O-CG1 3.31Å; V718-I722 WeakPolarHBondContact O-CG1 3.34Å; V718-I722 PolarHBondContact O-N 3.21Å; L719-I722 PolarHBondContact O-N 3.5Å; I722-E725 PolarHBondContact O-N 3.46Å; I722-L726 HydrophobicContact CG2-CD1 4.32Å; I722-L726 WeakPolarHBondContact O-CB 3.49Å; I722-L726 WeakPolarHBondContact O-CG 3.39Å; I722-L726 PolarHBondContact O-N 3.12Å
723	G	93.8	Very high	92.9	Very high	18 Å²	18	31.8 Å²	31.8	19%	0.186	15%	0.152	C	C	.	.	H	α-helix	trans	-66.6	-36.5	172.6	0	0	0	0	0	113.9	L719 F720 I721 R727	L719-G723 PolarHBondContact O-N 2.85Å; F720-G723 PolarHBondContact O-N 2.96Å; I721-G723 VanDerWaalsContact C-N 3.27Å; I721-G723 PolarHBondContact O-N 2.84Å; G723-R727 WeakPolarHBondContact O-CB 3.4Å; G723-R727 PolarHBondContact O-N 3Å
724	Y	93.6	Very high	92.8	Very high	36 Å²	36	27.3 Å²	27.3	14%	0.141	13%	0.129	C	C	.	.	H	α-helix	trans	-65.4	-43.6	172.9	173.4	-92.9	0	0	0	111.6	F720 I721 R727 N728 W732 I771	F720-Y724 PolarHBondContact O-N 3.01Å; I721-Y724 WeakPolarHBondContact O-CB 3.09Å; I721-Y724 PolarHBondContact O-N 3.42Å; I721-Y724 VanDerWaalsContact O-N 3.13Å; Y724-R727 PolarHBondContact O-N 2.91Å; Y724-N728 WeakPolarHBondContact O-CB 3.33Å; Y724-N728 PolarHBondContact O-N 3.06Å; Y724-W732 AromaticContact CD1-CH2 3.83Å; Y724-W732 HydrophobicContact CD1-CH2 3.83Å; Y724-W732 HydrophobicContact CD1-CZ2 4.27Å; Y724-W732 AromaticContact CE1-CH2 3.41Å; Y724-W732 HydrophobicContact CE1-CH2 3.41Å; Y724-W732 VanDerWaalsContact CE1-CH2 3.41Å; Y724-W732 AromaticContact CE1-CZ2 3.48Å; Y724-W732 HydrophobicContact CE1-CZ2 3.48Å; Y724-W732 VanDerWaalsContact CE1-CZ2 3.48Å; Y724-W732 AromaticContact CZ-CZ2 3.74Å; Y724-I771 HydrophobicContact CD1-CG2 4.07Å; Y724-I771 HydrophobicContact CE1-CD1 3.95Å; Y724-I771 HydrophobicContact CE1-CG2 4.16Å; Y724-I771 HydrophobicContact CE2-CD1 4.25Å
725	E	91.9	Very high	92.5	Very high	5 Å²	5	27.1 Å²	27.1	2%	0.023	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-49.8	173.6	-71.9	170	-163.5	0	0	111.4	F651 I721 I722 R727 N728 T729 Y772 K775	F651-E725 HydrophobicContact CE1-CB 4.18Å; I721-E725 WeakPolarHBondContact CG2-OE1 3.32Å; I721-E725 WeakPolarHBondContact O-CG 3.1Å; I721-E725 PolarHBondContact O-N 3.14Å; I722-E725 PolarHBondContact O-N 3.46Å; E725-R727 PolarHBondContact O-N 3.45Å; E725-N728 PolarHBondContact O-N 3.12Å; E725-T729 VanDerWaalsContact O-CB 3.31Å; E725-T729 WeakPolarHBondContact O-CB 3.4Å; E725-T729 PolarHBondContact O-N 2.97Å; E725-T729 PolarHBondContact O-OG1 3.18Å; E725-Y772 HydrophobicContact CG-CE1 4.4Å; E725-Y772 HydrophobicContact CG-CE2 4.41Å; E725-K775 WeakPolarHBondContact OE1-CD 3.28Å; E725-K775 WeakPolarHBondContact OE1-CE 3.4Å; E725-K775 IonicContact OE1-NZ 3.26Å; E725-K775 PolarHBondContact OE1-NZ 3.17Å; E725-K775 IonicContact OE2-NZ 2.68Å; E725-K775 PolarHBondContact OE2-NZ 3.39Å
726	L	91.4	Very high	92.3	Very high	23 Å²	23	27.1 Å²	27.1	12%	0.12	13%	0.128	C	C	.	.	H	α-helix	trans	-55.1	-36.5	177.5	-87.4	168.2	0	0	0	113.7	F651 L652 F656 I722	F651-L726 HydrophobicContact CB-CD2 4.12Å; F651-L726 HydrophobicContact CD1-CD2 3.67Å; F651-L726 HydrophobicContact CD1-CG 3.71Å; F651-L726 HydrophobicContact CE1-CG 4.22Å; F651-L726 HydrophobicContact CG-CD2 4.34Å; L652-L726 HydrophobicContact CB-CD2 4.23Å; L652-L726 HydrophobicContact CD1-CD1 4.04Å; F656-L726 HydrophobicContact CB-CD1 3.71Å; F656-L726 HydrophobicContact CD1-CD1 4.38Å; F656-L726 HydrophobicContact CD2-CD1 3.87Å; F656-L726 HydrophobicContact CG-CD1 3.74Å; I722-L726 HydrophobicContact CG2-CD1 4.32Å; I722-L726 WeakPolarHBondContact O-CB 3.49Å; I722-L726 WeakPolarHBondContact O-CG 3.39Å; I722-L726 PolarHBondContact O-N 3.12Å
727	R	90.8	Very high	92	Very high	123 Å²	123	25.2 Å²	25.2	46%	0.464	12%	0.119	S	C	.	.	H	α-helix	trans	-82	-38.9	-177.9	-171.6	-171.1	65.6	-151.3	-9	112.8	G723 Y724 E725	G723-R727 WeakPolarHBondContact O-CB 3.4Å; G723-R727 PolarHBondContact O-N 3Å; Y724-R727 PolarHBondContact O-N 2.91Å; E725-R727 PolarHBondContact O-N 3.45Å
728	N	91.2	Very high	91.8	Very high	22 Å²	22	23.2 Å²	23.2	12%	0.118	11%	0.108	C	C	.	.	H	α-helix	trans	-100.9	-18.9	-167.7	-73.2	29.5	0	0	0	114.5	Y724 E725 Y730 I731 W732	Y724-N728 WeakPolarHBondContact O-CB 3.33Å; Y724-N728 PolarHBondContact O-N 3.06Å; E725-N728 PolarHBondContact O-N 3.12Å; N728-Y730 VanDerWaalsContact C-N 3.3Å; N728-Y730 PolarHBondContact O-N 3.24Å; N728-I731 PolarHBondContact O-N 2.9Å; N728-W732 HydrophobicContact CB-CD2 4.06Å; N728-W732 HydrophobicContact CB-CE3 4.34Å; N728-W732 HydrophobicContact CB-CH2 3.59Å; N728-W732 HydrophobicContact CB-CZ2 3.29Å; N728-W732 HydrophobicContact CB-CZ3 4.1Å; N728-W732 PolarHBondContact O-N 3.37Å
729	T	88.6	Confident	91.4	Very high	17 Å²	17	27.6 Å²	27.6	10%	0.104	13%	0.128	C	C	.	.	H	α-helix	trans	-55	-41	-172.9	-65.5	0	0	0	0	113.6	E725 I731 W732 Q733	E725-T729 VanDerWaalsContact O-CB 3.31Å; E725-T729 WeakPolarHBondContact O-CB 3.4Å; E725-T729 PolarHBondContact O-N 2.97Å; E725-T729 PolarHBondContact O-OG1 3.18Å; T729-I731 PolarHBondContact O-N 3.31Å; T729-W732 PolarHBondContact O-N 3.09Å; T729-Q733 HydrophobicContact CG2-CG 4.33Å; T729-Q733 WeakPolarHBondContact O-CG 3.35Å; T729-Q733 PolarHBondContact O-N 3.06Å
730	Y	89.1	Confident	91.2	Very high	84 Å²	84	27.7 Å²	27.7	33%	0.329	13%	0.129	S	C	.	.	H	α-helix	trans	-58.6	-45.8	177.5	-174.8	-100.7	0	0	0	112.5	I331 A381 D382 N728 W732 Q733 L734	I331-Y730 HydrophobicContact CD1-CE1 4.29Å; A381-Y730 HydrophobicContact CB-CE2 4.46Å; D382-Y730 WeakPolarHBondContact OD2-CE2 3.19Å; N728-Y730 VanDerWaalsContact C-N 3.3Å; N728-Y730 PolarHBondContact O-N 3.24Å; Y730-W732 PolarHBondContact O-N 2.96Å; Y730-Q733 PolarHBondContact O-N 3.01Å; Y730-L734 HydrophobicContact CE1-CD2 4.08Å; Y730-L734 VanDerWaalsContact O-CB 3.23Å; Y730-L734 WeakPolarHBondContact O-CB 3.33Å; Y730-L734 PolarHBondContact O-N 3.14Å
731	I	90.6	Very high	90.9	Very high	31 Å²	31	28.3 Å²	28.3	16%	0.159	13%	0.132	C	C	.	.	H	α-helix	trans	-65.6	-41	-178.5	-57.3	174.9	0	0	0	110.6	L332 E335 N728 T729 L734 G735	L332-I731 HydrophobicContact CD2-CG2 4.24Å; E335-I731 HydrophobicContact CG-CG2 4.27Å; N728-I731 PolarHBondContact O-N 2.9Å; T729-I731 PolarHBondContact O-N 3.31Å; I731-L734 PolarHBondContact O-N 3.13Å; I731-G735 PolarHBondContact O-N 2.83Å
732	W	90.9	Very high	90.5	Very high	8 Å²	8	29.2 Å²	29.2	3%	0.03	14%	0.135	C	C	.	.	H	α-helix	trans	-66.3	-41.3	178.3	-57.8	-35.4	0	0	0	112.7	Y394 Y724 N728 T729 Y730 G735 I736 S765 K766 P767 Y772	Y394-W732 HydrophobicContact CE1-CB 3.99Å; Y394-W732 VanDerWaalsContact OH-C 3.25Å; Y394-W732 VanDerWaalsContact OH-CB 3.27Å; Y394-W732 WeakPolarHBondContact OH-CB 3.41Å; Y394-W732 PolarHBondContact OH-O 2.89Å; Y724-W732 AromaticContact CD1-CH2 3.83Å; Y724-W732 HydrophobicContact CD1-CH2 3.83Å; Y724-W732 HydrophobicContact CD1-CZ2 4.27Å; Y724-W732 AromaticContact CE1-CH2 3.41Å; Y724-W732 HydrophobicContact CE1-CH2 3.41Å; Y724-W732 VanDerWaalsContact CE1-CH2 3.41Å; Y724-W732 AromaticContact CE1-CZ2 3.48Å; Y724-W732 HydrophobicContact CE1-CZ2 3.48Å; Y724-W732 VanDerWaalsContact CE1-CZ2 3.48Å; Y724-W732 AromaticContact CZ-CZ2 3.74Å; N728-W732 HydrophobicContact CB-CD2 4.06Å; N728-W732 HydrophobicContact CB-CE3 4.34Å; N728-W732 HydrophobicContact CB-CH2 3.59Å; N728-W732 HydrophobicContact CB-CZ2 3.29Å; N728-W732 HydrophobicContact CB-CZ3 4.1Å; N728-W732 PolarHBondContact O-N 3.37Å; T729-W732 PolarHBondContact O-N 3.09Å; Y730-W732 PolarHBondContact O-N 2.96Å; W732-G735 PolarHBondContact O-N 3.29Å; W732-I736 PolarHBondContact O-N 3.5Å; W732-S765 VanDerWaalsContact CD1-O 3.31Å; W732-K766 VanDerWaalsContact CD1-C 3.45Å; W732-K766 VanDerWaalsContact NE1-C 3.31Å; W732-K766 PolarHBondContact NE1-O 3.48Å; W732-P767 HydrophobicContact CD2-CB 3.99Å; W732-P767 HydrophobicContact CD2-CG 4.34Å; W732-P767 HydrophobicContact CE3-CB 3.96Å; W732-P767 HydrophobicContact CE3-CG 4.35Å; W732-P767 HydrophobicContact CH2-CB 4.01Å; W732-P767 HydrophobicContact CZ2-CB 3.97Å; W732-P767 HydrophobicContact CZ3-CB 4.01Å; W732-Y772 HydrophobicContact CH2-CE2 4.31Å; W732-Y772 HydrophobicContact CZ3-CE2 4.26Å; W732-Y772 VanDerWaalsContact CZ3-OH 3.24Å; W732-Y772 WeakPolarHBondContact CZ3-OH 3.06Å
733	Q	90.1	Very high	90.1	Very high	4 Å²	4	30.1 Å²	30.1	2%	0.019	14%	0.14	C	C	.	.	H	α-helix	trans	-65.3	-46.7	175.3	-72	-177.7	-5.7	0	0	111.8	V380 A381 Y394 N646 T729 Y730 G735 I736 A737	V380-Q733 HydrophobicContact CG1-CB 3.93Å; V380-Q733 HydrophobicContact CG1-CG 4.06Å; A381-Q733 HydrophobicContact CB-CB 3.86Å; Y394-Q733 PolarHBondContact OH-N 3.12Å; N646-Q733 PolarHBondContact OD1-NE2 2.88Å; N646-Q733 PolarHBondContact OD1-OE1 3.36Å; N646-Q733 VanDerWaalsContact OD1-OE1 3.14Å; T729-Q733 HydrophobicContact CG2-CG 4.33Å; T729-Q733 WeakPolarHBondContact O-CG 3.35Å; T729-Q733 PolarHBondContact O-N 3.06Å; Y730-Q733 PolarHBondContact O-N 3.01Å; Q733-G735 VanDerWaalsContact C-N 3.26Å; Q733-G735 PolarHBondContact O-N 3.29Å; Q733-I736 PolarHBondContact O-N 3.32Å; Q733-I736 VanDerWaalsContact O-N 3.1Å; Q733-A737 WeakPolarHBondContact O-CB 3.14Å; Q733-A737 PolarHBondContact O-N 3.36Å
734	L	90.3	Very high	89.4	Confident	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-60.2	-38.8	178.7	-168.7	70.2	0	0	0	111	F324 A328 I331 L332 A381 Y730 I731 I736 A737 C738	F324-L734 HydrophobicContact CZ-CD1 4.05Å; A328-L734 HydrophobicContact CB-CD1 3.86Å; A328-L734 HydrophobicContact CB-CD2 4.03Å; A328-L734 HydrophobicContact CB-CG 4.24Å; I331-L734 HydrophobicContact CB-CD2 4.38Å; I331-L734 HydrophobicContact CG2-CD2 4.06Å; L332-L734 HydrophobicContact CD1-CD2 4.31Å; L332-L734 HydrophobicContact CD1-CG 4.16Å; L332-L734 HydrophobicContact CD2-CB 4.45Å; L332-L734 HydrophobicContact CD2-CD2 4.09Å; L332-L734 HydrophobicContact CD2-CG 4.33Å; L332-L734 HydrophobicContact CG-CD2 3.91Å; L332-L734 HydrophobicContact CG-CG 4.26Å; A381-L734 HydrophobicContact CB-CB 4Å; A381-L734 HydrophobicContact CB-CD1 3.96Å; Y730-L734 HydrophobicContact CE1-CD2 4.08Å; Y730-L734 VanDerWaalsContact O-CB 3.23Å; Y730-L734 WeakPolarHBondContact O-CB 3.33Å; Y730-L734 PolarHBondContact O-N 3.14Å; I731-L734 PolarHBondContact O-N 3.13Å; L734-I736 VanDerWaalsContact C-N 3.3Å; L734-I736 PolarHBondContact O-N 2.85Å; L734-A737 PolarHBondContact O-N 3.11Å; L734-C738 VanDerWaalsContact CD1-SG 3.59Å; L734-C738 WeakPolarHBondContact O-CB 3.43Å; L734-C738 PolarHBondContact O-N 3.14Å; L734-C738 PolarHBondContact O-SG 2.87Å; L734-C738 VanDerWaalsContact O-SG 3.37Å
735	G	89.5	Confident	88.2	Confident	3 Å²	3	30.5 Å²	30.5	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-64.4	-24.6	175.3	0	0	0	0	0	115.3	I731 W732 Q733 P764	I731-G735 PolarHBondContact O-N 2.83Å; W732-G735 PolarHBondContact O-N 3.29Å; Q733-G735 VanDerWaalsContact C-N 3.26Å; Q733-G735 PolarHBondContact O-N 3.29Å; G735-P764 WeakPolarHBondContact O-CB 3.47Å; G735-P764 WeakPolarHBondContact O-CG 3.32Å
736	I	89.2	Confident	86.6	Confident	20 Å²	20	39.4 Å²	39.4	10%	0.103	19%	0.189	C	C	.	.	H	α-helix	trans	-81.4	-48.9	168.9	-64.2	162.6	0	0	0	110.1	R361 P363 L364 P393 Y394 W732 Q733 L734 C738	R361-I736 PolarHBondContact NH2-O 2.9Å; P363-I736 HydrophobicContact CG-CG2 3.72Å; L364-I736 HydrophobicContact CD1-CG2 4.25Å; L364-I736 HydrophobicContact CD2-CG2 4Å; L364-I736 HydrophobicContact CG-CG2 3.89Å; P393-I736 HydrophobicContact CG-CD1 3.6Å; P393-I736 HydrophobicContact CG-CG1 4.48Å; Y394-I736 HydrophobicContact CD1-CD1 3.92Å; Y394-I736 HydrophobicContact CD1-CG1 4.34Å; Y394-I736 HydrophobicContact CE1-CD1 3.27Å; Y394-I736 HydrophobicContact CE1-CG1 3.79Å; Y394-I736 HydrophobicContact CE2-CD1 4.32Å; Y394-I736 VanDerWaalsContact CZ-CD1 3.47Å; W732-I736 PolarHBondContact O-N 3.5Å; Q733-I736 PolarHBondContact O-N 3.32Å; Q733-I736 VanDerWaalsContact O-N 3.1Å; L734-I736 VanDerWaalsContact C-N 3.3Å; L734-I736 PolarHBondContact O-N 2.85Å; I736-C738 VanDerWaalsContact C-N 3.35Å; I736-C738 PolarHBondContact O-N 3.07Å
737	A	89.3	Confident	84.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-60.8	-43.1	-172.5	0	0	0	0	0	112.3	D359 R361 L364 I383 Q733 L734	D359-A737 PolarHBondContact N-O 3.01Å; R361-A737 PolarHBondContact NE-O 3.46Å; L364-A737 HydrophobicContact CD1-CB 4.04Å; I383-A737 HydrophobicContact CD1-CB 3.76Å; Q733-A737 WeakPolarHBondContact O-CB 3.14Å; Q733-A737 PolarHBondContact O-N 3.36Å; L734-A737 PolarHBondContact O-N 3.11Å
738	C	91.9	Very high	82.6	Confident	2 Å²	2	46.5 Å²	46.5	1%	0.014	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	134.2	-179.8	-55.2	0	0	0	0	112.2	L332 C356 T357 C358 R361 L734 I736	L332-C738 HydrophobicContact CD1-CB 4.01Å; C356-C738 HydrophobicContact CB-CB 4.16Å; T357-C738 CarbonylContact O-C 3.54Å; T357-C738 WeakPolarHBondContact O-CA 3.31Å; C358-C738 HydrophobicContact CB-CB 4.08Å; C358-C738 WeakPolarHBondContact CB-SG 3.42Å; C358-C738 WeakPolarHBondContact SG-CB 3.37Å; C358-C738 CovalentContact SG-SG 2.04Å; C358-C738 PolarHBondContact SG-SG 3.33Å; R361-C738 VanDerWaalsContact NH2-C 3.27Å; R361-C738 PolarHBondContact NH2-O 3.4Å; R361-C738 VanDerWaalsContact NH2-O 3.12Å; L734-C738 VanDerWaalsContact CD1-SG 3.59Å; L734-C738 WeakPolarHBondContact O-CB 3.43Å; L734-C738 PolarHBondContact O-N 3.14Å; L734-C738 PolarHBondContact O-SG 2.87Å; L734-C738 VanDerWaalsContact O-SG 3.37Å; I736-C738 VanDerWaalsContact C-N 3.35Å; I736-C738 PolarHBondContact O-N 3.07Å
739	H	88.8	Confident	80.5	Confident	104 Å²	104	55.2 Å²	55.2	48%	0.481	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	142.9	153.9	-162.4	-115.3	0	0	0	107.7	C356 T357	C356-H739 CarbonylContact C-O 3.55Å; C356-H739 WeakPolarHBondContact CA-O 3.11Å; C356-H739 WeakPolarHBondContact CB-O 3.37Å; T357-H739 PolarHBondContact N-O 3.39Å; T357-H739 PolarHBondContact O-N 2.86Å
740	C	90.2	Very high	78.5	Confident	5 Å²	5	63 Å²	63	3%	0.034	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	147.4	176.9	-54.9	0	0	0	0	110.9	L332 L354 K355 C356 W762	L332-C740 VanDerWaalsContact CD1-SG 3.57Å; L354-C740 HydrophobicContact CD1-CB 3.91Å; L354-C740 HydrophobicContact CD2-CB 3.91Å; L354-C740 HydrophobicContact CG-CB 3.8Å; K355-C740 WeakPolarHBondContact O-CA 3.41Å; C356-C740 HydrophobicContact CB-CB 4.12Å; C356-C740 WeakPolarHBondContact CB-SG 3.49Å; C356-C740 WeakPolarHBondContact SG-CB 3.46Å; C356-C740 CovalentContact SG-SG 2.04Å; C356-C740 PolarHBondContact SG-SG 2.87Å; C740-W762 HydrophobicContact CB-CB 4.49Å; C740-W762 HydrophobicContact CB-CD2 4.06Å; C740-W762 HydrophobicContact CB-CG 3.8Å; C740-W762 VanDerWaalsContact O-CB 3.23Å; C740-W762 WeakPolarHBondContact O-CB 3.27Å
741	H	89.4	Confident	76.5	Confident	77 Å²	77	64.7 Å²	64.7	36%	0.356	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.9	153.2	170.7	55.3	-62.8	0	0	0	109.1	L354 K355	L354-H741 WeakPolarHBondContact CA-O 3.05Å; L354-H741 WeakPolarHBondContact CD1-O 3.06Å; K355-H741 PolarHBondContact N-O 3Å; K355-H741 PolarHBondContact O-CE1 3.37Å; K355-H741 PolarHBondContact O-N 3.27Å; K355-H741 VanDerWaalsContact O-N 3.08Å; K355-H741 PolarHBondContact O-ND1 3.25Å
742	Y	86.6	Confident	74.2	Confident	22 Å²	22	71.5 Å²	71.5	9%	0.086	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	137.9	168.7	-65.5	-82.5	0	0	0	108.9	F333 A336 I342 L352 H353 L354 P760 W762	F333-Y742 HydrophobicContact CE2-CE1 4.44Å; A336-Y742 HydrophobicContact CB-CE1 4.46Å; I342-Y742 HydrophobicContact CD1-CE1 4.31Å; I342-Y742 HydrophobicContact CD1-CE2 4.34Å; I342-Y742 WeakPolarHBondContact CD1-OH 3.28Å; I342-Y742 HydrophobicContact CG2-CE1 4.01Å; L352-Y742 HydrophobicContact CD1-CD1 4.29Å; H353-Y742 WeakPolarHBondContact O-CA 3.23Å; L354-Y742 HydrophobicContact CD1-CD1 3.86Å; L354-Y742 HydrophobicContact CD1-CD2 4.4Å; L354-Y742 HydrophobicContact CD1-CE1 3.83Å; L354-Y742 HydrophobicContact CD1-CE2 4.39Å; L354-Y742 HydrophobicContact CD1-CG 4.16Å; Y742-P760 HydrophobicContact CD2-CG 4.2Å; Y742-P760 WeakPolarHBondContact CD2-O 3.42Å; Y742-P760 HydrophobicContact CE2-CG 4.02Å; Y742-P760 VanDerWaalsContact CE2-O 3.22Å; Y742-P760 WeakPolarHBondContact CE2-O 3.25Å; Y742-W762 HydrophobicContact CE2-CE3 4.43Å
743	D	84.5	Confident	72.2	Confident	28 Å²	28	75.8 Å²	75.8	15%	0.15	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.5	-179.4	-175.8	-20.3	0	0	0	106.7	H353 K355 G745	H353-D743 VanDerWaalsContact CE1-CB 3.45Å; H353-D743 WeakPolarHBondContact CE1-CB 3.5Å; H353-D743 IonicContact CE1-OD1 2.95Å; H353-D743 IonicContact CE1-OD2 3.09Å; H353-D743 PolarHBondContact N-O 3.27Å; H353-D743 PolarHBondContact ND1-O 2.94Å; H353-D743 IonicContact NE2-OD2 3.89Å; H353-D743 PolarHBondContact O-N 2.04Å; K355-D743 HydrophobicContact CB-CB 4.33Å; K355-D743 HydrophobicContact CD-CB 4.27Å; K355-D743 VanDerWaalsContact CD-OD2 3.23Å; K355-D743 WeakPolarHBondContact CD-OD2 3.23Å; K355-D743 IonicContact NZ-OD2 3.57Å; K355-D743 PolarHBondContact NZ-OD2 3.42Å; D743-G745 VanDerWaalsContact C-N 3.33Å; D743-G745 PolarHBondContact OD1-N 3.28Å
744	I	79.5	Confident	70.1	Confident	34 Å²	34	83.1 Å²	83.1	17%	0.174	42%	0.417	C	S	.	.			trans	-87.9	-10	-178	-53.8	174.8	0	0	0	110.5	F349 N351 L352 Y747 L759	F349-I744 HydrophobicContact CB-CG2 4.15Å; F349-I744 HydrophobicContact CD1-CD1 4.08Å; F349-I744 HydrophobicContact CD1-CG2 3.76Å; F349-I744 HydrophobicContact CE1-CD1 4.14Å; F349-I744 HydrophobicContact CG-CD1 4.42Å; F349-I744 HydrophobicContact CG-CG2 4.23Å; N351-I744 CarbonylContact C-O 3.48Å; N351-I744 WeakPolarHBondContact CB-O 3.49Å; L352-I744 HydrophobicContact CD1-CG1 4.4Å; I744-Y747 HydrophobicContact CG2-CE2 3.64Å; I744-L759 HydrophobicContact CD1-CD1 4.26Å; I744-L759 HydrophobicContact CD1-CD2 4.2Å; I744-L759 HydrophobicContact CG1-CD1 4.15Å; I744-L759 HydrophobicContact CG1-CD2 4.35Å
745	G	68.5	Low	68	Low	28 Å²	28	89.5 Å²	89.5	29%	0.289	45%	0.451	S	S	.	.			trans	77.9	165.5	-168.6	0	0	0	0	0	112	D743 Y747	D743-G745 VanDerWaalsContact C-N 3.33Å; D743-G745 PolarHBondContact OD1-N 3.28Å; G745-Y747 PolarHBondContact O-N 2.9Å
746	Q	58.8	Low	66.3	Low	192 Å²	192	95.3 Å²	95.3	90%	0.897	49%	0.488	S	S	*	.	P	Polyproline II helix	trans	-65.5	124.4	176.1	-67.4	-179.3	-75.8	0	0	110.3
747	Y	53.5	Low	64.8	Low	154 Å²	154	97.6 Å²	97.6	60%	0.604	50%	0.503	S	S	*	.	P	Polyproline II helix	trans	-74.4	153.5	155.3	-78.6	-94.5	0	0	0	109.1	I744 G745	I744-Y747 HydrophobicContact CG2-CE2 3.64Å; G745-Y747 PolarHBondContact O-N 2.9Å
748	N	45.1	Very low	63.8	Low	141 Å²	141	102.2 Å²	102.2	75%	0.754	54%	0.541	S	S	*	.	P	Polyproline II helix	trans	-71.9	143	168.7	-61.2	-12.1	0	0	0	109	E750	N748-E750 PolarHBondContact O-N 3.48Å
749	E	47.1	Very low	63	Low	205 Å²	205	104.9 Å²	104.9	96%	0.958	56%	0.555	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	24.6	-165.7	-59.4	170	117	0	0	116.1
750	E	46	Very low	62.4	Low	181 Å²	181	102.4 Å²	102.4	85%	0.846	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112.9	9	-172.5	-64	-171	138.8	0	0	114.6	N748	N748-E750 PolarHBondContact O-N 3.48Å
751	V	47	Very low	62	Low	119 Å²	119	109.8 Å²	109.8	72%	0.721	59%	0.585	S	S	*	*	S	Bend	trans	-140.5	119.4	177.6	-173.5	0	0	0	0	111.1
752	E	42.8	Very low	61.6	Low	174 Å²	174	107.7 Å²	107.7	81%	0.813	57%	0.574	S	S	*	*			trans	-59.3	141.2	174	-67.4	179.6	125.7	0	0	111.8	I754	E752-I754 PolarHBondContact O-N 3.42Å
753	P	48.6	Very low	61.5	Low	99 Å²	99	112.6 Å²	112.6	64%	0.643	60%	0.602	S	S	*	*			trans	-72.5	91.1	-177.4	28.6	-34.6	0	0	0	112.2	L755	P753-L755 PolarHBondContact O-N 2.8Å
754	I	45.5	Very low	61.5	Low	158 Å²	158	113.3 Å²	113.3	81%	0.81	61%	0.608	S	S	*	*			trans	-66.4	106.4	174.6	-47.1	178	0	0	0	109.8	E752	E752-I754 PolarHBondContact O-N 3.42Å
755	L	46.4	Very low	61.7	Low	134 Å²	134	113.5 Å²	113.5	70%	0.702	61%	0.612	S	S	*	*	S	Bend	trans	76.7	124	176.3	-162	77.3	0	0	0	115.4	P753 V757	P753-L755 PolarHBondContact O-N 2.8Å; L755-V757 PolarHBondContact O-N 3.5Å
756	P	53.9	Low	62.7	Low	125 Å²	125	117.6 Å²	117.6	81%	0.812	62%	0.622	S	S	*	*			trans	-72.9	93	173.7	30.3	-34.3	0	0	0	110.7	A758	P756-A758 PolarHBondContact O-N 3.17Å
757	V	58.4	Low	64.1	Low	68 Å²	68	108.7 Å²	108.7	41%	0.412	58%	0.581	S	S	.	*			trans	-72.1	99.9	174.2	179.3	0	0	0	0	109.4	F349 L755 L759	F349-V757 HydrophobicContact CE2-CG1 4.21Å; F349-V757 HydrophobicContact CZ-CB 4.45Å; F349-V757 HydrophobicContact CZ-CG1 4.39Å; F349-V757 HydrophobicContact CZ-CG2 4.21Å; L755-V757 PolarHBondContact O-N 3.5Å; V757-L759 PolarHBondContact O-N 3.09Å
758	A	67.3	Low	65.9	Low	97 Å²	97	106.1 Å²	106.1	80%	0.802	58%	0.575	S	S	*	*			trans	-61.2	102.3	174.8	0	0	0	0	0	110.6	P756	P756-A758 PolarHBondContact O-N 3.17Å
759	L	74.2	Confident	68	Low	58 Å²	58	101.5 Å²	101.5	30%	0.304	55%	0.547	S	S	.	.	P	Polyproline II helix	trans	-63.1	143	179	-69.9	171.5	0	0	0	110.9	L345 L352 I744 V757	L345-L759 HydrophobicContact CD2-CD2 3.93Å; L352-L759 HydrophobicContact CD1-CD2 4.32Å; I744-L759 HydrophobicContact CD1-CD1 4.26Å; I744-L759 HydrophobicContact CD1-CD2 4.2Å; I744-L759 HydrophobicContact CG1-CD1 4.15Å; I744-L759 HydrophobicContact CG1-CD2 4.35Å; V757-L759 PolarHBondContact O-N 3.09Å
760	P	78.2	Confident	70.1	Confident	52 Å²	52	95.2 Å²	95.2	34%	0.338	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-65.9	138.6	-177.6	26.2	-33.2	0	0	0	111.2	I342 L345 Y742 W762	I342-P760 HydrophobicContact CD1-CB 4.21Å; I342-P760 HydrophobicContact CD1-CG 3.46Å; I342-P760 VanDerWaalsContact CD1-CG 3.46Å; L345-P760 HydrophobicContact CD2-CG 3.87Å; Y742-P760 HydrophobicContact CD2-CG 4.2Å; Y742-P760 WeakPolarHBondContact CD2-O 3.42Å; Y742-P760 HydrophobicContact CE2-CG 4.02Å; Y742-P760 VanDerWaalsContact CE2-O 3.22Å; Y742-P760 WeakPolarHBondContact CE2-O 3.25Å; P760-W762 PolarHBondContact O-N 3.14Å
761	I	81	Confident	72.3	Confident	159 Å²	159	88.3 Å²	88.3	82%	0.815	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-60.7	133.1	177.2	-59	174	0	0	0	109.6	N763	I761-N763 PolarHBondContact O-N 3.38Å
762	W	81.3	Confident	74.4	Confident	34 Å²	34	84 Å²	84	13%	0.129	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-62.4	123.9	173.7	172.7	-116	0	0	0	110.7	L332 A336 L354 C740 Y742 P760 P764	L332-W762 HydrophobicContact CB-CH2 4.03Å; L332-W762 HydrophobicContact CB-CZ2 4.05Å; L332-W762 HydrophobicContact CD1-CZ2 4.18Å; L332-W762 HydrophobicContact CD2-CZ2 4.21Å; L332-W762 HydrophobicContact CG-CZ2 4.38Å; A336-W762 HydrophobicContact CB-CH2 4.46Å; A336-W762 HydrophobicContact CB-CZ3 3.75Å; L354-W762 HydrophobicContact CD1-CD2 4.25Å; L354-W762 HydrophobicContact CD1-CE3 3.87Å; L354-W762 HydrophobicContact CD1-CZ3 4.36Å; L354-W762 HydrophobicContact CD2-CD2 4.42Å; L354-W762 HydrophobicContact CD2-CE3 4.14Å; L354-W762 HydrophobicContact CD2-CH2 4.01Å; L354-W762 HydrophobicContact CD2-CZ2 4.26Å; L354-W762 HydrophobicContact CD2-CZ3 3.95Å; C740-W762 HydrophobicContact CB-CB 4.49Å; C740-W762 HydrophobicContact CB-CD2 4.06Å; C740-W762 HydrophobicContact CB-CG 3.8Å; C740-W762 VanDerWaalsContact O-CB 3.23Å; C740-W762 WeakPolarHBondContact O-CB 3.27Å; Y742-W762 HydrophobicContact CE2-CE3 4.43Å; P760-W762 PolarHBondContact O-N 3.14Å; W762-P764 HydrophobicContact CZ2-CB 4.21Å
763	N	83.7	Confident	76.8	Confident	125 Å²	125	76.1 Å²	76.1	67%	0.668	43%	0.428	S	S	*	.			trans	-123.5	105.3	177	-174.9	15.8	0	0	0	108.3	I761	I761-N763 PolarHBondContact O-N 3.38Å
764	P	84.2	Confident	79	Confident	43 Å²	43	74.5 Å²	74.5	28%	0.279	41%	0.414	S	S	.	.			trans	-66.5	146.8	-173.9	26.4	-34.1	0	0	0	112.1	G735 W762 K766	G735-P764 WeakPolarHBondContact O-CB 3.47Å; G735-P764 WeakPolarHBondContact O-CG 3.32Å; W762-P764 HydrophobicContact CZ2-CB 4.21Å; P764-K766 PolarHBondContact O-N 2.92Å
765	S	85.2	Confident	81.4	Confident	38 Å²	38	68.3 Å²	68.3	27%	0.266	38%	0.381	S	S	.	.			trans	-60.8	129.8	173.9	-70	0	0	0	0	110.5	E335 W732	E335-S765 WeakPolarHBondContact CG-OG 3.34Å; W732-S765 VanDerWaalsContact CD1-O 3.31Å
766	K	87.8	Confident	83.7	Confident	114 Å²	114	62.4 Å²	62.4	50%	0.496	35%	0.35	S	S	.	.			trans	-117.2	158.4	177	62.9	-175.9	177.4	-173.3	0	111	Y394 W732 P764	Y394-K766 HydrophobicContact CD1-CB 3.88Å; Y394-K766 HydrophobicContact CG-CB 4.41Å; W732-K766 VanDerWaalsContact CD1-C 3.45Å; W732-K766 VanDerWaalsContact NE1-C 3.31Å; W732-K766 PolarHBondContact NE1-O 3.48Å; P764-K766 PolarHBondContact O-N 2.92Å
767	P	90.1	Very high	85.8	Confident	4 Å²	4	58.4 Å²	58.4	3%	0.026	32%	0.32	C	S	.	.			trans	-61.6	155.9	168.1	22.7	-31	0	0	0	112.2	Y394 Y395 W732 Y772	Y394-P767 HydrophobicContact CD1-CG 4.32Å; Y394-P767 HydrophobicContact CD2-CG 3.37Å; Y394-P767 HydrophobicContact CE1-CG 4.48Å; Y394-P767 HydrophobicContact CE2-CG 3.65Å; Y394-P767 HydrophobicContact CG-CG 3.79Å; Y395-P767 PolarHBondContact OH-O 2.9Å; W732-P767 HydrophobicContact CD2-CB 3.99Å; W732-P767 HydrophobicContact CD2-CG 4.34Å; W732-P767 HydrophobicContact CE3-CB 3.96Å; W732-P767 HydrophobicContact CE3-CG 4.35Å; W732-P767 HydrophobicContact CH2-CB 4.01Å; W732-P767 HydrophobicContact CZ2-CB 3.97Å; W732-P767 HydrophobicContact CZ3-CB 4.01Å; P767-Y772 HydrophobicContact CB-CD2 4.15Å; P767-Y772 HydrophobicContact CB-CE2 3.47Å; P767-Y772 VanDerWaalsContact CB-CE2 3.47Å; P767-Y772 HydrophobicContact CG-CE2 4.45Å
768	E	89.7	Confident	87.6	Confident	101 Å²	101	56.7 Å²	56.7	47%	0.472	31%	0.308	S	S	.	.			trans	-87.6	114	171.6	-85.2	-61.3	152.7	0	0	110.9	S770 I771 Y772	E768-S770 PolarHBondContact O-N 3.09Å; E768-I771 HydrophobicContact CB-CB 4.15Å; E768-I771 HydrophobicContact CB-CD1 3.75Å; E768-I771 HydrophobicContact CB-CG1 3.77Å; E768-I771 HydrophobicContact CG-CD1 4.31Å; E768-I771 WeakPolarHBondContact O-CB 3.04Å; E768-I771 PolarHBondContact O-N 3.03Å; E768-Y772 PolarHBondContact O-N 3.47Å
769	Y	90.1	Very high	88.9	Confident	43 Å²	43	52.7 Å²	52.7	17%	0.169	27%	0.273	C	S	.	.	H	α-helix	trans	-55.7	-41.5	-177.2	-175.4	-101.8	0	0	0	112	Y395 S400 F403 T404 I637 I771 Y772 M773	Y395-Y769 HydrophobicContact CD1-CD2 4.5Å; Y395-Y769 HydrophobicContact CD2-CD2 4.24Å; Y395-Y769 HydrophobicContact CE1-CD2 4.31Å; Y395-Y769 HydrophobicContact CE1-CG 4.45Å; Y395-Y769 HydrophobicContact CE2-CD2 4.05Å; Y395-Y769 HydrophobicContact CG-CD2 4.45Å; Y395-Y769 WeakPolarHBondContact OH-CA 3.27Å; Y395-Y769 PolarHBondContact OH-N 3.22Å; Y395-Y769 VanDerWaalsContact OH-N 3.16Å; S400-Y769 PolarHBondContact O-OH 2.54Å; S400-Y769 VanDerWaalsContact O-OH 3.11Å; F403-Y769 AromaticContact CD1-CE1 3.86Å; F403-Y769 HydrophobicContact CD1-CE1 3.86Å; F403-Y769 WeakPolarHBondContact CD1-OH 3.33Å; F403-Y769 HydrophobicContact CE1-CE1 4.28Å; T404-Y769 PolarHBondContact N-OH 3.12Å; T404-Y769 PolarHBondContact OG1-OH 2.92Å; I637-Y769 HydrophobicContact CD1-CD2 3.86Å; I637-Y769 HydrophobicContact CD1-CE2 4.14Å; I637-Y769 HydrophobicContact CG1-CD2 4.49Å; I637-Y769 HydrophobicContact CG1-CE2 4.33Å; Y769-I771 VanDerWaalsContact C-N 3.29Å; Y769-I771 PolarHBondContact O-N 2.91Å; Y769-Y772 PolarHBondContact O-N 3.5Å; Y769-M773 HydrophobicContact CD1-CG 3.96Å; Y769-M773 HydrophobicContact CE1-CG 3.56Å; Y769-M773 HydrophobicContact CE1-SD 4.24Å; Y769-M773 HydrophobicContact CE2-CG 4.35Å; Y769-M773 HydrophobicContact CE2-SD 4.23Å; Y769-M773 WeakPolarHBondContact O-CG 3.04Å; Y769-M773 PolarHBondContact O-N 2.91Å; Y769-M773 VanDerWaalsContact O-N 3.09Å
770	S	91.5	Very high	89.9	Confident	73 Å²	73	50 Å²	50	51%	0.51	26%	0.259	S	S	.	.	H	α-helix	trans	-56.5	-39.6	178.3	59.9	0	0	0	0	112.9	E768 M773 L774	E768-S770 PolarHBondContact O-N 3.09Å; S770-M773 PolarHBondContact O-N 2.95Å; S770-L774 VanDerWaalsContact O-CB 3.29Å; S770-L774 WeakPolarHBondContact O-CB 3.25Å; S770-L774 PolarHBondContact O-N 2.83Å
771	I	92.3	Very high	90.7	Very high	37 Å²	37	49.4 Å²	49.4	19%	0.19	25%	0.252	C	S	.	.	H	α-helix	trans	-69.7	-41	-178.5	-64.2	-174.8	0	0	0	111	I721 Y724 E768 Y769 L774 K775	I721-I771 HydrophobicContact CB-CG2 4.36Å; I721-I771 HydrophobicContact CD1-CG2 4.45Å; I721-I771 HydrophobicContact CG1-CG2 3.97Å; I721-I771 HydrophobicContact CG2-CG2 3.6Å; Y724-I771 HydrophobicContact CD1-CG2 4.07Å; Y724-I771 HydrophobicContact CE1-CD1 3.95Å; Y724-I771 HydrophobicContact CE1-CG2 4.16Å; Y724-I771 HydrophobicContact CE2-CD1 4.25Å; E768-I771 HydrophobicContact CB-CB 4.15Å; E768-I771 HydrophobicContact CB-CD1 3.75Å; E768-I771 HydrophobicContact CB-CG1 3.77Å; E768-I771 HydrophobicContact CG-CD1 4.31Å; E768-I771 WeakPolarHBondContact O-CB 3.04Å; E768-I771 PolarHBondContact O-N 3.03Å; Y769-I771 VanDerWaalsContact C-N 3.29Å; Y769-I771 PolarHBondContact O-N 2.91Å; I771-L774 WeakPolarHBondContact O-CB 3.07Å; I771-L774 PolarHBondContact O-N 3.37Å; I771-K775 PolarHBondContact O-N 3.41Å; I771-K775 VanDerWaalsContact O-N 3.1Å
772	Y	90.7	Very high	91.2	Very high	27 Å²	27	41.9 Å²	41.9	11%	0.106	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-44.6	175.3	-82.1	-102.7	0	0	0	111.7	I637 E725 W732 P767 E768 Y769 L774 K775 H776	I637-Y772 HydrophobicContact CD1-CD1 4.34Å; I637-Y772 HydrophobicContact CD1-CG 4.11Å; I637-Y772 HydrophobicContact CG2-CD1 3.73Å; I637-Y772 HydrophobicContact CG2-CE1 4.42Å; I637-Y772 HydrophobicContact CG2-CG 4.37Å; E725-Y772 HydrophobicContact CG-CE1 4.4Å; E725-Y772 HydrophobicContact CG-CE2 4.41Å; W732-Y772 HydrophobicContact CH2-CE2 4.31Å; W732-Y772 HydrophobicContact CZ3-CE2 4.26Å; W732-Y772 VanDerWaalsContact CZ3-OH 3.24Å; W732-Y772 WeakPolarHBondContact CZ3-OH 3.06Å; P767-Y772 HydrophobicContact CB-CD2 4.15Å; P767-Y772 HydrophobicContact CB-CE2 3.47Å; P767-Y772 VanDerWaalsContact CB-CE2 3.47Å; P767-Y772 HydrophobicContact CG-CE2 4.45Å; E768-Y772 PolarHBondContact O-N 3.47Å; Y769-Y772 PolarHBondContact O-N 3.5Å; Y772-L774 VanDerWaalsContact C-N 3.28Å; Y772-L774 PolarHBondContact O-N 3.13Å; Y772-K775 WeakPolarHBondContact O-CB 3.3Å; Y772-K775 PolarHBondContact O-N 3.01Å; Y772-H776 PolarHBondContact O-CD2 2.04Å
773	M	93.5	Very high	91.8	Very high	9 Å²	9	40.3 Å²	40.3	4%	0.044	21%	0.208	C	C	.	.	H	α-helix	trans	-65.1	-32.9	177	-60.5	-48.9	-63.3	0	0	112.4	F403 T404 W407 Y769 S770 F777	F403-M773 HydrophobicContact CD1-CE 4.5Å; F403-M773 HydrophobicContact CE1-CE 4.49Å; T404-M773 HydrophobicContact CG2-CE 4.11Å; T404-M773 HydrophobicContact CG2-SD 4.14Å; W407-M773 HydrophobicContact CB-CE 3.7Å; W407-M773 HydrophobicContact CG-CE 3.59Å; Y769-M773 HydrophobicContact CD1-CG 3.96Å; Y769-M773 HydrophobicContact CE1-CG 3.56Å; Y769-M773 HydrophobicContact CE1-SD 4.24Å; Y769-M773 HydrophobicContact CE2-CG 4.35Å; Y769-M773 HydrophobicContact CE2-SD 4.23Å; Y769-M773 WeakPolarHBondContact O-CG 3.04Å; Y769-M773 PolarHBondContact O-N 2.91Å; Y769-M773 VanDerWaalsContact O-N 3.09Å; S770-M773 PolarHBondContact O-N 2.95Å; M773-F777 WeakPolarHBondContact O-CB 3.36Å; M773-F777 PolarHBondContact O-N 2.99Å; M773-F777 VanDerWaalsContact O-N 3.15Å
774	L	95.2	Very high	92.2	Very high	66 Å²	66	35.1 Å²	35.1	35%	0.346	18%	0.18	S	C	.	.	H	α-helix	trans	-64.9	-38.5	174	-176.4	65	0	0	0	112.5	I717 I721 S770 I771 Y772 F777 M778	I717-L774 HydrophobicContact CG2-CD2 4.19Å; I717-L774 HydrophobicContact CG2-CG 4.31Å; I721-L774 HydrophobicContact CD1-CB 4.23Å; I721-L774 HydrophobicContact CD1-CD2 4.09Å; I721-L774 HydrophobicContact CD1-CG 4.02Å; S770-L774 VanDerWaalsContact O-CB 3.29Å; S770-L774 WeakPolarHBondContact O-CB 3.25Å; S770-L774 PolarHBondContact O-N 2.83Å; I771-L774 WeakPolarHBondContact O-CB 3.07Å; I771-L774 PolarHBondContact O-N 3.37Å; Y772-L774 VanDerWaalsContact C-N 3.28Å; Y772-L774 PolarHBondContact O-N 3.13Å; L774-F777 HydrophobicContact CD1-CD1 4.18Å; L774-F777 PolarHBondContact O-N 3.28Å; L774-M778 HydrophobicContact CD1-CE 3.67Å; L774-M778 HydrophobicContact CD1-CG 4.03Å; L774-M778 HydrophobicContact CG-CG 4.33Å; L774-M778 WeakPolarHBondContact O-CB 3.09Å; L774-M778 WeakPolarHBondContact O-CG 3.23Å; L774-M778 PolarHBondContact O-N 3.49Å
775	K	95.5	Very high	92.5	Very high	28 Å²	28	34.3 Å²	34.3	12%	0.122	17%	0.173	C	C	.	.	H	α-helix	trans	-54.4	-57.2	176.3	-175.1	175.1	68.2	-165.9	0	111.2	I721 E725 I771 Y772 F777 M778 T779	I721-K775 HydrophobicContact CD1-CB 4.11Å; I721-K775 HydrophobicContact CG2-CB 4.03Å; I721-K775 HydrophobicContact CG2-CD 4.1Å; I721-K775 HydrophobicContact CG2-CG 4.33Å; E725-K775 WeakPolarHBondContact OE1-CD 3.28Å; E725-K775 WeakPolarHBondContact OE1-CE 3.4Å; E725-K775 IonicContact OE1-NZ 3.26Å; E725-K775 PolarHBondContact OE1-NZ 3.17Å; E725-K775 IonicContact OE2-NZ 2.68Å; E725-K775 PolarHBondContact OE2-NZ 3.39Å; I771-K775 PolarHBondContact O-N 3.41Å; I771-K775 VanDerWaalsContact O-N 3.1Å; Y772-K775 WeakPolarHBondContact O-CB 3.3Å; Y772-K775 PolarHBondContact O-N 3.01Å; K775-F777 PolarHBondContact O-N 3.08Å; K775-M778 PolarHBondContact O-N 2.72Å; K775-T779 PolarHBondContact O-N 3.4Å; K775-T779 PolarHBondContact O-OG1 3.4Å
776	H	95	Very high	92.4	Very high	10 Å²	10	32.5 Å²	32.5	5%	0.046	16%	0.16	C	C	.	.	H	α-helix	trans	-66.5	-38.7	-178.1	-59.1	-73.3	0	0	0	112.6	L408 Y454 Y772 T779 L780	L408-H776 HydrophobicContact CD2-CB 3.48Å; L408-H776 VanDerWaalsContact CD2-CB 3.48Å; Y454-H776 HydrophobicContact CE1-CB 4.05Å; Y454-H776 AromaticContact CE1-ND1 3.58Å; Y454-H776 AromaticContact CZ-ND1 3.7Å; Y454-H776 PolarHBondContact OH-ND1 3.46Å; Y772-H776 PolarHBondContact O-CD2 2.04Å; H776-T779 PolarHBondContact O-N 3.36Å; H776-L780 PolarHBondContact O-N 3.03Å
777	F	96.1	Very high	92.1	Very high	41 Å²	41	27.1 Å²	27.1	18%	0.18	14%	0.138	C	C	.	.	H	α-helix	trans	-58.9	-49	174.3	169.6	-108.5	0	0	0	111.9	W407 W411 M773 L774 K775 T779 L780 M781	W407-F777 HydrophobicContact CZ2-CB 4.37Å; W407-F777 HydrophobicContact CZ2-CD2 4.23Å; W407-F777 HydrophobicContact CZ2-CG 4.34Å; W411-F777 AromaticContact CD1-CD2 3.93Å; W411-F777 AromaticContact CD2-CD2 3.67Å; W411-F777 HydrophobicContact CD2-CD2 3.67Å; W411-F777 AromaticContact CD2-CE2 3.77Å; W411-F777 HydrophobicContact CD2-CE2 3.77Å; W411-F777 AromaticContact CE2-CD2 3.57Å; W411-F777 AromaticContact CE2-CE2 3.53Å; W411-F777 HydrophobicContact CE3-CD2 4.21Å; W411-F777 AromaticContact CE3-CE2 3.93Å; W411-F777 HydrophobicContact CE3-CE2 3.93Å; W411-F777 AromaticContact CG-CD2 3.95Å; W411-F777 HydrophobicContact CG-CD2 3.95Å; W411-F777 AromaticContact CH2-CE2 3.74Å; W411-F777 HydrophobicContact CH2-CE2 3.74Å; W411-F777 HydrophobicContact CZ2-CD2 4.06Å; W411-F777 AromaticContact CZ2-CE2 3.53Å; W411-F777 HydrophobicContact CZ2-CE2 3.53Å; W411-F777 AromaticContact CZ3-CE2 3.92Å; W411-F777 HydrophobicContact CZ3-CE2 3.92Å; W411-F777 AromaticContact NE1-CD2 3.69Å; M773-F777 WeakPolarHBondContact O-CB 3.36Å; M773-F777 PolarHBondContact O-N 2.99Å; M773-F777 VanDerWaalsContact O-N 3.15Å; L774-F777 HydrophobicContact CD1-CD1 4.18Å; L774-F777 PolarHBondContact O-N 3.28Å; K775-F777 PolarHBondContact O-N 3.08Å; F777-T779 VanDerWaalsContact C-N 3.34Å; F777-T779 PolarHBondContact O-N 3.46Å; F777-L780 PolarHBondContact O-N 2.94Å; F777-M781 HydrophobicContact CE1-CE 4.39Å; F777-M781 HydrophobicContact CE2-CE 3.51Å; F777-M781 HydrophobicContact CZ-CE 3.41Å; F777-M781 VanDerWaalsContact CZ-CE 3.41Å; F777-M781 VanDerWaalsContact O-CB 3.3Å; F777-M781 WeakPolarHBondContact O-CB 3.49Å; F777-M781 PolarHBondContact O-N 3.25Å
778	M	96.2	Very high	91.7	Very high	32 Å²	32	32.5 Å²	32.5	16%	0.158	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-34	179.5	-71.3	-65.3	172.9	0	0	112.4	P714 I717 V718 L774 K775 I782	P714-M778 HydrophobicContact CB-CB 4.17Å; P714-M778 WeakPolarHBondContact CB-O 3.37Å; P714-M778 HydrophobicContact CB-SD 4.18Å; I717-M778 HydrophobicContact CB-CG 4.32Å; I717-M778 HydrophobicContact CD1-CE 3.87Å; I717-M778 HydrophobicContact CD1-CG 4.49Å; I717-M778 HydrophobicContact CD1-SD 4Å; I717-M778 HydrophobicContact CG2-CG 3.9Å; V718-M778 HydrophobicContact CG2-CB 3.76Å; L774-M778 HydrophobicContact CD1-CE 3.67Å; L774-M778 HydrophobicContact CD1-CG 4.03Å; L774-M778 HydrophobicContact CG-CG 4.33Å; L774-M778 WeakPolarHBondContact O-CB 3.09Å; L774-M778 WeakPolarHBondContact O-CG 3.23Å; L774-M778 PolarHBondContact O-N 3.49Å; K775-M778 PolarHBondContact O-N 2.72Å; M778-I782 WeakPolarHBondContact O-CG1 3.34Å
779	T	95.5	Very high	91.2	Very high	13 Å²	13	28.7 Å²	28.7	8%	0.08	14%	0.142	C	C	.	.	H	α-helix	trans	-61.2	-46.5	171	-53.9	0	0	0	0	112.1	Y447 K775 H776 F777	Y447-T779 VanDerWaalsContact CE1-O 3.25Å; Y447-T779 WeakPolarHBondContact CE1-O 3.43Å; K775-T779 PolarHBondContact O-N 3.4Å; K775-T779 PolarHBondContact O-OG1 3.4Å; H776-T779 PolarHBondContact O-N 3.36Å; F777-T779 VanDerWaalsContact C-N 3.34Å; F777-T779 PolarHBondContact O-N 3.46Å
780	L	96.1	Very high	90.8	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-76.5	-32.1	-177.2	-70.4	167.9	0	0	0	113.3	W411 C415 Y454 H776 F777 I782 G783 I784	W411-L780 HydrophobicContact CB-CB 4.38Å; W411-L780 HydrophobicContact CB-CD1 3.9Å; C415-L780 HydrophobicContact CB-CB 4.36Å; C415-L780 HydrophobicContact CB-CD2 4.07Å; Y454-L780 HydrophobicContact CD1-CD1 4.27Å; Y454-L780 HydrophobicContact CD2-CD1 4.38Å; Y454-L780 HydrophobicContact CD2-CD2 3.85Å; Y454-L780 HydrophobicContact CD2-CG 4.39Å; Y454-L780 HydrophobicContact CE1-CD1 4.36Å; Y454-L780 HydrophobicContact CE2-CD1 4.49Å; Y454-L780 HydrophobicContact CE2-CD2 4.06Å; Y454-L780 HydrophobicContact CE2-CG 4.28Å; Y454-L780 HydrophobicContact CG-CD1 4.28Å; Y454-L780 HydrophobicContact CG-CD2 4.42Å; H776-L780 PolarHBondContact O-N 3.03Å; F777-L780 PolarHBondContact O-N 2.94Å; L780-I782 PolarHBondContact O-N 2.94Å; L780-I782 VanDerWaalsContact O-N 3.12Å; L780-G783 PolarHBondContact O-N 2.88Å; L780-G783 VanDerWaalsContact O-N 3.12Å; L780-I784 PolarHBondContact O-N 3.08Å
781	M	94.5	Very high	90.3	Very high	40 Å²	40	30.9 Å²	30.9	20%	0.197	14%	0.139	C	C	.	.	H	α-helix	trans	-55.8	-29.8	178.6	-179.6	52.7	69.7	0	0	112.9	W411 F777 G783 I784 I785	W411-M781 HydrophobicContact CZ3-CE 4.17Å; F777-M781 HydrophobicContact CE1-CE 4.39Å; F777-M781 HydrophobicContact CE2-CE 3.51Å; F777-M781 HydrophobicContact CZ-CE 3.41Å; F777-M781 VanDerWaalsContact CZ-CE 3.41Å; F777-M781 VanDerWaalsContact O-CB 3.3Å; F777-M781 WeakPolarHBondContact O-CB 3.49Å; F777-M781 PolarHBondContact O-N 3.25Å; M781-G783 PolarHBondContact O-N 3.03Å; M781-I784 WeakPolarHBondContact O-CB 3.37Å; M781-I784 PolarHBondContact O-N 3.4Å; M781-I784 VanDerWaalsContact O-N 3.15Å; M781-I784 HydrophobicContact SD-CB 4.17Å; M781-I784 HydrophobicContact SD-CG2 4.35Å; M781-I785 HydrophobicContact CG-CD1 3.81Å; M781-I785 HydrophobicContact CG-CG1 4.32Å; M781-I785 WeakPolarHBondContact O-CG1 3.35Å; M781-I785 PolarHBondContact O-N 3.19Å; M781-I785 HydrophobicContact SD-CD1 4.28Å; M781-I785 HydrophobicContact SD-CG1 4.19Å
782	I	91.7	Very high	89.9	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-41.4	178.8	-61.2	161.2	0	0	0	112	Y447 Y711 P714 N715 M778 L780 I784 I785 S786	Y447-I782 HydrophobicContact CD2-CG2 4.04Å; Y447-I782 HydrophobicContact CE1-CB 3.94Å; Y447-I782 HydrophobicContact CE1-CD1 4.34Å; Y447-I782 HydrophobicContact CE1-CG2 4.15Å; Y447-I782 HydrophobicContact CE2-CB 4.06Å; Y447-I782 HydrophobicContact CE2-CG2 3.35Å; Y447-I782 VanDerWaalsContact CZ-CG2 3.44Å; Y447-I782 WeakPolarHBondContact OH-CD1 3.19Å; Y711-I782 HydrophobicContact CD2-CG2 3.43Å; Y711-I782 VanDerWaalsContact CD2-CG2 3.43Å; Y711-I782 HydrophobicContact CE2-CG2 3.19Å; Y711-I782 HydrophobicContact CG-CG2 4.48Å; P714-I782 HydrophobicContact CB-CD1 4.04Å; P714-I782 HydrophobicContact CB-CG1 3.72Å; P714-I782 HydrophobicContact CG-CG1 4.04Å; N715-I782 WeakPolarHBondContact ND2-CD1 3.49Å; M778-I782 WeakPolarHBondContact O-CG1 3.34Å; L780-I782 PolarHBondContact O-N 2.94Å; L780-I782 VanDerWaalsContact O-N 3.12Å; I782-I784 VanDerWaalsContact C-N 3.32Å; I782-I785 PolarHBondContact O-N 2.99Å; I782-S786 PolarHBondContact O-N 3.35Å
783	G	92.4	Very high	89.6	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-73.7	-22	175.5	0	0	0	0	0	113.7	S418 L780 M781 S786	S418-G783 WeakPolarHBondContact CB-O 3.41Å; S418-G783 PolarHBondContact OG-O 2.89Å; L780-G783 PolarHBondContact O-N 2.88Å; L780-G783 VanDerWaalsContact O-N 3.12Å; M781-G783 PolarHBondContact O-N 3.03Å; G783-S786 PolarHBondContact O-OG 2.83Å
784	I	93.5	Very high	89.1	Confident	17 Å²	17	41.9 Å²	41.9	9%	0.087	20%	0.195	C	C	.	.	H	α-helix	trans	-73.9	-42.2	170.8	-59.4	175.4	0	0	0	109.9	W411 F414 C415 S418 L780 M781 I782 S786 G787 F788	W411-I784 HydrophobicContact CE3-CD1 3.67Å; W411-I784 HydrophobicContact CZ3-CD1 4.05Å; F414-I784 HydrophobicContact CB-CD1 3.84Å; F414-I784 HydrophobicContact CB-CG1 4.35Å; C415-I784 HydrophobicContact CB-CG1 4.1Å; S418-I784 WeakPolarHBondContact OG-CA 3.4Å; S418-I784 PolarHBondContact OG-O 3.33Å; L780-I784 PolarHBondContact O-N 3.08Å; M781-I784 WeakPolarHBondContact O-CB 3.37Å; M781-I784 PolarHBondContact O-N 3.4Å; M781-I784 VanDerWaalsContact O-N 3.15Å; M781-I784 HydrophobicContact SD-CB 4.17Å; M781-I784 HydrophobicContact SD-CG2 4.35Å; I782-I784 VanDerWaalsContact C-N 3.32Å; I784-S786 VanDerWaalsContact C-N 3.29Å; I784-S786 PolarHBondContact O-N 2.53Å; I784-G787 PolarHBondContact O-N 2.96Å; I784-F788 HydrophobicContact CG2-CD2 4.36Å; I784-F788 HydrophobicContact CG2-CE2 3.77Å; I784-F788 WeakPolarHBondContact O-CD2 3.34Å
785	I	90.4	Very high	88.7	Confident	25 Å²	25	39.1 Å²	39.1	13%	0.128	18%	0.182	C	C	.	.	H	α-helix	trans	-60	-35.6	176	-74	164.2	0	0	0	111.9	Y707 L710 P714 M781 I782 F788	Y707-I785 HydrophobicContact CD2-CG2 4.25Å; Y707-I785 HydrophobicContact CE2-CG2 3.59Å; L710-I785 HydrophobicContact CD2-CD1 4.42Å; L710-I785 HydrophobicContact CD2-CG1 4.48Å; L710-I785 HydrophobicContact CD2-CG2 3.76Å; L710-I785 HydrophobicContact CG-CD1 4.28Å; L710-I785 HydrophobicContact CG-CG2 4.2Å; P714-I785 HydrophobicContact CG-CD1 4.42Å; M781-I785 HydrophobicContact CG-CD1 3.81Å; M781-I785 HydrophobicContact CG-CG1 4.32Å; M781-I785 WeakPolarHBondContact O-CG1 3.35Å; M781-I785 PolarHBondContact O-N 3.19Å; M781-I785 HydrophobicContact SD-CD1 4.28Å; M781-I785 HydrophobicContact SD-CG1 4.19Å; I782-I785 PolarHBondContact O-N 2.99Å; I785-F788 PolarHBondContact O-N 3.48Å
786	S	83.4	Confident	88.3	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-67.2	-37	-179.4	84.6	0	0	0	0	114.2	S444 Y707 I782 G783 I784 F788 W789	S444-S786 VanDerWaalsContact OG-CB 3.32Å; S444-S786 WeakPolarHBondContact OG-CB 3.41Å; S444-S786 PolarHBondContact OG-OG 2.82Å; Y707-S786 WeakPolarHBondContact OH-CA 3.41Å; Y707-S786 WeakPolarHBondContact OH-CB 3.26Å; Y707-S786 PolarHBondContact OH-N 2.94Å; I782-S786 PolarHBondContact O-N 3.35Å; G783-S786 PolarHBondContact O-OG 2.83Å; I784-S786 VanDerWaalsContact C-N 3.29Å; I784-S786 PolarHBondContact O-N 2.53Å; S786-F788 PolarHBondContact O-N 2.86Å; S786-W789 WeakPolarHBondContact O-CB 3.5Å; S786-W789 PolarHBondContact O-N 3.32Å
787	G	80.1	Confident	87.8	Confident	2 Å²	2	46.3 Å²	46.3	2%	0.021	22%	0.22	C	C	.	.	H	α-helix	trans	-62.1	-42.3	175.2	0	0	0	0	0	112.7	S418 I784 W789 I790 W791	S418-G787 VanDerWaalsContact OG-CA 3.29Å; S418-G787 WeakPolarHBondContact OG-CA 3.36Å; S418-G787 PolarHBondContact OG-N 2.99Å; I784-G787 PolarHBondContact O-N 2.96Å; G787-W789 PolarHBondContact O-N 3.25Å; G787-I790 PolarHBondContact O-N 3.37Å; G787-I790 VanDerWaalsContact O-N 3.09Å; G787-W791 PolarHBondContact O-N 3.25Å
788	F	82.4	Confident	87.3	Confident	116 Å²	116	45.3 Å²	45.3	51%	0.509	22%	0.218	S	C	.	.	H	α-helix	trans	-61.2	-25	176.8	-71.3	-56.7	0	0	0	113.7	I784 I785 S786 W791	I784-F788 HydrophobicContact CG2-CD2 4.36Å; I784-F788 HydrophobicContact CG2-CE2 3.77Å; I784-F788 WeakPolarHBondContact O-CD2 3.34Å; I785-F788 PolarHBondContact O-N 3.48Å; S786-F788 PolarHBondContact O-N 2.86Å; F788-W791 HydrophobicContact CD1-CD2 4.04Å; F788-W791 AromaticContact CD1-CE3 3.88Å; F788-W791 HydrophobicContact CD1-CE3 3.88Å; F788-W791 HydrophobicContact CD1-CH2 4.25Å; F788-W791 HydrophobicContact CD1-CZ2 4.39Å; F788-W791 AromaticContact CD1-CZ3 3.99Å; F788-W791 HydrophobicContact CD1-CZ3 3.99Å; F788-W791 HydrophobicContact CE1-CE3 4.13Å; F788-W791 AromaticContact CE1-CH2 3.79Å; F788-W791 HydrophobicContact CE1-CH2 3.79Å; F788-W791 HydrophobicContact CE1-CZ2 4.21Å; F788-W791 AromaticContact CE1-CZ3 3.75Å; F788-W791 HydrophobicContact CE1-CZ3 3.75Å
789	W	79.1	Confident	86.8	Confident	22 Å²	22	47.1 Å²	47.1	8%	0.083	22%	0.223	C	C	.	.	H	α-helix	trans	-70.2	-34	175.2	177.5	91.3	0	0	0	112.7	F433 E437 L440 I704 Y707 S786 G787	F433-W789 HydrophobicContact CD1-CH2 4.38Å; F433-W789 HydrophobicContact CD1-CZ3 4.31Å; F433-W789 HydrophobicContact CE1-CH2 4.28Å; F433-W789 AromaticContact CE1-CZ3 3.95Å; F433-W789 HydrophobicContact CE1-CZ3 3.95Å; E437-W789 HydrophobicContact CB-CH2 3.95Å; E437-W789 HydrophobicContact CB-CZ2 4.37Å; E437-W789 HydrophobicContact CG-CH2 3.94Å; E437-W789 HydrophobicContact CG-CZ2 3.94Å; E437-W789 WeakPolarHBondContact OE1-CZ2 3.45Å; E437-W789 WeakPolarHBondContact OE2-CH2 3.4Å; L440-W789 HydrophobicContact CD1-CB 4.35Å; L440-W789 HydrophobicContact CD1-CD2 3.54Å; L440-W789 HydrophobicContact CD1-CE3 3.69Å; L440-W789 HydrophobicContact CD1-CG 3.8Å; L440-W789 HydrophobicContact CD1-CZ2 4.5Å; L440-W789 HydrophobicContact CD1-CZ3 4.26Å; L440-W789 HydrophobicContact CD2-CD2 4.15Å; L440-W789 HydrophobicContact CD2-CE3 3.47Å; L440-W789 VanDerWaalsContact CD2-CE3 3.47Å; L440-W789 HydrophobicContact CD2-CZ3 3.93Å; L440-W789 HydrophobicContact CG-CE3 4.22Å; I704-W789 HydrophobicContact CG1-CZ2 4.42Å; Y707-W789 HydrophobicContact CD2-CB 3.72Å; Y707-W789 AromaticContact CD2-CD1 3.87Å; Y707-W789 HydrophobicContact CD2-CG 4.02Å; Y707-W789 HydrophobicContact CE2-CB 3.83Å; Y707-W789 HydrophobicContact CE2-CG 4.44Å; Y707-W789 AromaticContact CG-CD1 3.98Å; Y707-W789 HydrophobicContact CG-CG 4.42Å; S786-W789 WeakPolarHBondContact O-CB 3.5Å; S786-W789 PolarHBondContact O-N 3.32Å; G787-W789 PolarHBondContact O-N 3.25Å
790	I	81.8	Confident	86.5	Confident	1 Å²	1	53.8 Å²	53.8	1%	0.005	25%	0.247	C	C	.	.	H	α-helix	trans	-76.5	-23.3	178.4	-69.3	-157.2	0	0	0	112.4	T422 T425 F433 I441 G787 S792 T795	T422-I790 HydrophobicContact CG2-CD1 3.57Å; T425-I790 HydrophobicContact CG2-CG2 3.79Å; F433-I790 HydrophobicContact CE1-CD1 4.02Å; F433-I790 HydrophobicContact CZ-CD1 4.02Å; I441-I790 HydrophobicContact CD1-CD1 3.96Å; G787-I790 PolarHBondContact O-N 3.37Å; G787-I790 VanDerWaalsContact O-N 3.09Å; I790-S792 PolarHBondContact O-N 3.42Å; I790-S792 PolarHBondContact O-OG 3.05Å; I790-T795 HydrophobicContact CG2-CG2 3.84Å; I790-T795 WeakPolarHBondContact O-CB 3.44Å; I790-T795 PolarHBondContact O-OG1 3.35Å
791	W	81.6	Confident	85.9	Confident	161 Å²	161	62.5 Å²	62.5	61%	0.61	28%	0.28	S	S	*	.			trans	-59	110.6	177	-73.5	23.6	0	0	0	110.9	G787 F788	G787-W791 PolarHBondContact O-N 3.25Å; F788-W791 HydrophobicContact CD1-CD2 4.04Å; F788-W791 AromaticContact CD1-CE3 3.88Å; F788-W791 HydrophobicContact CD1-CE3 3.88Å; F788-W791 HydrophobicContact CD1-CH2 4.25Å; F788-W791 HydrophobicContact CD1-CZ2 4.39Å; F788-W791 AromaticContact CD1-CZ3 3.99Å; F788-W791 HydrophobicContact CD1-CZ3 3.99Å; F788-W791 HydrophobicContact CE1-CE3 4.13Å; F788-W791 AromaticContact CE1-CH2 3.79Å; F788-W791 HydrophobicContact CE1-CH2 3.79Å; F788-W791 HydrophobicContact CE1-CZ2 4.21Å; F788-W791 AromaticContact CE1-CZ3 3.75Å; F788-W791 HydrophobicContact CE1-CZ3 3.75Å
792	S	82.5	Confident	85.4	Confident	29 Å²	29	66.1 Å²	66.1	20%	0.203	29%	0.294	C	S	.	.	S	Bend	trans	-166.7	153	-173.6	55.5	0	0	0	0	110.1	R432 I790 K794 T795 I796	R432-S792 PolarHBondContact NH2-OG 2.98Å; I790-S792 PolarHBondContact O-N 3.42Å; I790-S792 PolarHBondContact O-OG 3.05Å; S792-K794 PolarHBondContact O-N 3.27Å; S792-T795 WeakPolarHBondContact O-CA 3.48Å; S792-T795 WeakPolarHBondContact O-CB 3.35Å; S792-T795 PolarHBondContact O-N 3.42Å; S792-T795 PolarHBondContact OG-OG1 2.87Å; S792-I796 PolarHBondContact O-N 3.29Å
793	N	84.3	Confident	84.9	Confident	130 Å²	130	69.3 Å²	69.3	70%	0.695	32%	0.316	S	S	*	.	H	α-helix	trans	-54.4	-40.8	179.4	-56.8	34.9	0	0	0	111.4	T795 I796 D797	N793-T795 VanDerWaalsContact C-N 3.3Å; N793-T795 PolarHBondContact O-N 3.19Å; N793-I796 CarbonylContact O-C 3.54Å; N793-I796 WeakPolarHBondContact O-CA 3.43Å; N793-I796 WeakPolarHBondContact O-CB 3.29Å; N793-I796 PolarHBondContact O-N 3.31Å; N793-I796 VanDerWaalsContact O-N 3.09Å; N793-D797 VanDerWaalsContact O-CG 3.32Å; N793-D797 PolarHBondContact O-N 3.48Å
794	K	83.7	Confident	84.1	Confident	144 Å²	144	76 Å²	76	63%	0.626	35%	0.345	S	S	*	.	H	α-helix	trans	-53.7	-43.6	172.9	-72.1	-171	175.5	-171.9	0	113.1	S792 D797 T798	S792-K794 PolarHBondContact O-N 3.27Å; K794-D797 PolarHBondContact O-N 2.97Å; K794-T798 PolarHBondContact O-N 3.21Å; K794-T798 PolarHBondContact O-OG1 3.42Å; K794-T798 VanDerWaalsContact O-OG1 3.09Å
795	T	86.5	Confident	82.7	Confident	9 Å²	9	79.8 Å²	79.8	6%	0.055	37%	0.366	C	S	.	.	H	α-helix	trans	-66	-45	177.1	-62.3	0	0	0	0	110.3	T425 R432 I790 S792 N793 D797 T798 W799	T425-T795 HydrophobicContact CG2-CG2 3.87Å; R432-T795 PolarHBondContact NH1-OG1 2.96Å; R432-T795 PolarHBondContact NH2-OG1 3.05Å; I790-T795 HydrophobicContact CG2-CG2 3.84Å; I790-T795 WeakPolarHBondContact O-CB 3.44Å; I790-T795 PolarHBondContact O-OG1 3.35Å; S792-T795 WeakPolarHBondContact O-CA 3.48Å; S792-T795 WeakPolarHBondContact O-CB 3.35Å; S792-T795 PolarHBondContact O-N 3.42Å; S792-T795 PolarHBondContact OG-OG1 2.87Å; N793-T795 VanDerWaalsContact C-N 3.3Å; N793-T795 PolarHBondContact O-N 3.19Å; T795-D797 VanDerWaalsContact C-N 3.27Å; T795-D797 PolarHBondContact O-N 2.81Å; T795-T798 PolarHBondContact O-N 2.8Å; T795-W799 VanDerWaalsContact O-CD1 3.26Å; T795-W799 PolarHBondContact O-N 2.96Å
796	I	86.8	Confident	81.2	Confident	114 Å²	114	79.6 Å²	79.6	59%	0.585	37%	0.37	S	S	*	.	H	α-helix	trans	-59.4	-39.9	175	-59.9	172.3	0	0	0	110.5	S792 N793 R800	S792-I796 PolarHBondContact O-N 3.29Å; N793-I796 CarbonylContact O-C 3.54Å; N793-I796 WeakPolarHBondContact O-CA 3.43Å; N793-I796 WeakPolarHBondContact O-CB 3.29Å; N793-I796 PolarHBondContact O-N 3.31Å; N793-I796 VanDerWaalsContact O-N 3.09Å; I796-R800 WeakPolarHBondContact O-CB 3.45Å; I796-R800 PolarHBondContact O-N 3.44Å
797	D	85.7	Confident	79.7	Confident	74 Å²	74	85.8 Å²	85.8	40%	0.396	40%	0.403	S	S	.	.	H	α-helix	trans	-65.6	-41.5	175.1	-68.1	-43.9	0	0	0	112.8	N793 K794 T795 R800 R801	N793-D797 VanDerWaalsContact O-CG 3.32Å; N793-D797 PolarHBondContact O-N 3.48Å; K794-D797 PolarHBondContact O-N 2.97Å; T795-D797 VanDerWaalsContact C-N 3.27Å; T795-D797 PolarHBondContact O-N 2.81Å; D797-R800 PolarHBondContact O-N 2.91Å; D797-R801 VanDerWaalsContact O-CG 3.25Å; D797-R801 WeakPolarHBondContact O-CG 3.4Å; D797-R801 PolarHBondContact O-N 3.4Å
798	T	85.1	Confident	78.1	Confident	21 Å²	21	93 Å²	93	13%	0.129	43%	0.434	C	S	.	.	H	α-helix	trans	-62.9	-51.1	175.1	-65.2	0	0	0	0	111	I428 D429 K794 T795 R800 R801 F802	I428-T798 HydrophobicContact CB-CG2 4.32Å; I428-T798 HydrophobicContact CG2-CG2 3.56Å; D429-T798 HydrophobicContact CB-CG2 3.81Å; D429-T798 PolarHBondContact OD2-OG1 2.83Å; K794-T798 PolarHBondContact O-N 3.21Å; K794-T798 PolarHBondContact O-OG1 3.42Å; K794-T798 VanDerWaalsContact O-OG1 3.09Å; T795-T798 PolarHBondContact O-N 2.8Å; T798-R800 VanDerWaalsContact C-N 3.34Å; T798-R800 PolarHBondContact O-N 3.32Å; T798-R801 PolarHBondContact O-N 3.28Å; T798-F802 PolarHBondContact O-N 2.82Å
799	W	86.7	Confident	76.4	Confident	70 Å²	70	91.5 Å²	91.5	27%	0.265	44%	0.437	S	S	.	.	H	α-helix	trans	-64.7	-37.2	176.8	-79.4	84.9	0	0	0	111.9	I421 F424 T425 I428 T795 F802 C803	I421-W799 HydrophobicContact CG2-CZ2 4.42Å; F424-W799 HydrophobicContact CB-CH2 3.69Å; F424-W799 HydrophobicContact CB-CZ2 3.67Å; F424-W799 HydrophobicContact CD2-CH2 4.39Å; F424-W799 HydrophobicContact CG-CH2 4.36Å; T425-W799 PolarHBondContact OG1-NE1 3.05Å; I428-W799 HydrophobicContact CD1-CD2 4.31Å; I428-W799 HydrophobicContact CD1-CE3 4.42Å; I428-W799 HydrophobicContact CD1-CH2 4.37Å; I428-W799 HydrophobicContact CD1-CZ2 4.25Å; I428-W799 HydrophobicContact CD1-CZ3 4.45Å; T795-W799 VanDerWaalsContact O-CD1 3.26Å; T795-W799 PolarHBondContact O-N 2.96Å; W799-F802 PolarHBondContact O-N 3.24Å; W799-C803 WeakPolarHBondContact O-CB 3.31Å; W799-C803 PolarHBondContact O-N 2.9Å; W799-C803 PolarHBondContact O-SG 3.43Å; W799-C803 VanDerWaalsContact O-SG 3.33Å
800	R	87.8	Confident	74.6	Confident	153 Å²	153	97.5 Å²	97.5	58%	0.577	47%	0.469	S	S	*	.	H	α-helix	trans	-59.5	-48.8	172.7	-174.9	179.9	-175.6	178	2.9	111	I796 D797 T798 F802 C803 F804	I796-R800 WeakPolarHBondContact O-CB 3.45Å; I796-R800 PolarHBondContact O-N 3.44Å; D797-R800 PolarHBondContact O-N 2.91Å; T798-R800 VanDerWaalsContact C-N 3.34Å; T798-R800 PolarHBondContact O-N 3.32Å; R800-F802 VanDerWaalsContact C-N 3.3Å; R800-F802 PolarHBondContact O-N 3.26Å; R800-C803 PolarHBondContact O-N 2.9Å; R800-F804 HydrophobicContact CG-CD2 3.56Å; R800-F804 HydrophobicContact CG-CE2 3.74Å; R800-F804 WeakPolarHBondContact O-CB 3.39Å; R800-F804 VanDerWaalsContact O-CD2 3.28Å; R800-F804 WeakPolarHBondContact O-CD2 3.4Å; R800-F804 PolarHBondContact O-N 2.88Å
801	R	84.2	Confident	72.4	Confident	183 Å²	183	105.9 Å²	105.9	69%	0.691	51%	0.506	S	S	*	.	H	α-helix	trans	-59.6	-42.4	176.2	-71.7	166.9	-173.6	-161	0.7	111.5	D797 T798 N805	D797-R801 VanDerWaalsContact O-CG 3.25Å; D797-R801 WeakPolarHBondContact O-CG 3.4Å; D797-R801 PolarHBondContact O-N 3.4Å; T798-R801 PolarHBondContact O-N 3.28Å; R801-N805 VanDerWaalsContact O-CB 3.26Å; R801-N805 WeakPolarHBondContact O-CB 3.17Å; R801-N805 PolarHBondContact O-N 3.48Å
802	F	83.1	Confident	70.3	Confident	116 Å²	116	105.6 Å²	105.6	51%	0.509	51%	0.512	S	S	.	.	H	α-helix	trans	-62.6	-53.1	177.6	-174	-102.5	0	0	0	112.1	I428 T798 W799 R800 G806	I428-F802 HydrophobicContact CD1-CB 4.39Å; I428-F802 HydrophobicContact CD1-CD1 4.03Å; I428-F802 HydrophobicContact CD1-CD2 4.17Å; I428-F802 HydrophobicContact CD1-CE1 4.35Å; I428-F802 HydrophobicContact CD1-CE2 4.49Å; I428-F802 HydrophobicContact CD1-CG 3.93Å; I428-F802 HydrophobicContact CG1-CD2 4.08Å; I428-F802 HydrophobicContact CG1-CE2 4.24Å; I428-F802 HydrophobicContact CG1-CG 4.36Å; I428-F802 HydrophobicContact CG2-CB 4.29Å; I428-F802 HydrophobicContact CG2-CD2 4.13Å; I428-F802 HydrophobicContact CG2-CG 4.41Å; T798-F802 PolarHBondContact O-N 2.82Å; W799-F802 PolarHBondContact O-N 3.24Å; R800-F802 VanDerWaalsContact C-N 3.3Å; R800-F802 PolarHBondContact O-N 3.26Å; F802-G806 PolarHBondContact O-N 3.36Å
803	C	82.6	Confident	68.1	Low	69 Å²	69	113.8 Å²	113.8	47%	0.466	54%	0.544	S	S	.	.	H	α-helix	trans	-66.4	-44.2	-179.2	-63.9	0	0	0	0	113.1	W799 R800 N805 G806	W799-C803 WeakPolarHBondContact O-CB 3.31Å; W799-C803 PolarHBondContact O-N 2.9Å; W799-C803 PolarHBondContact O-SG 3.43Å; W799-C803 VanDerWaalsContact O-SG 3.33Å; R800-C803 PolarHBondContact O-N 2.9Å; C803-N805 PolarHBondContact O-N 2.77Å; C803-G806 PolarHBondContact O-N 3.01Å
804	F	75.6	Confident	65.6	Low	139 Å²	139	115.2 Å²	115.2	61%	0.61	55%	0.552	S	S	*	*	H	α-helix	trans	-70.3	-30.4	-179.7	-82.2	-96.5	0	0	0	112.9	R800	R800-F804 HydrophobicContact CG-CD2 3.56Å; R800-F804 HydrophobicContact CG-CE2 3.74Å; R800-F804 WeakPolarHBondContact O-CB 3.39Å; R800-F804 VanDerWaalsContact O-CD2 3.28Å; R800-F804 WeakPolarHBondContact O-CD2 3.4Å; R800-F804 PolarHBondContact O-N 2.88Å
805	N	64.3	Low	63.1	Low	98 Å²	98	117.1 Å²	117.1	52%	0.524	56%	0.56	S	S	.	*	H	α-helix	trans	-81.7	-25.2	170.5	-71.9	-8.8	0	0	0	112.7	R801 C803 N807 K808 C809	R801-N805 VanDerWaalsContact O-CB 3.26Å; R801-N805 WeakPolarHBondContact O-CB 3.17Å; R801-N805 PolarHBondContact O-N 3.48Å; C803-N805 PolarHBondContact O-N 2.77Å; N805-N807 PolarHBondContact O-N 3.41Å; N805-K808 WeakPolarHBondContact O-CA 3.32Å; N805-K808 WeakPolarHBondContact O-CB 3.25Å; N805-K808 PolarHBondContact O-N 3.3Å; N805-C809 PolarHBondContact O-N 3.36Å
806	G	58.2	Low	60.5	Low	20 Å²	20	125.8 Å²	125.8	21%	0.206	60%	0.599	C	S	.	*	H	α-helix	trans	-54.8	-40.1	175.3	0	0	0	0	0	112.5	F802 C803 K808 C809 L810	F802-G806 PolarHBondContact O-N 3.36Å; C803-G806 PolarHBondContact O-N 3.01Å; G806-K808 PolarHBondContact O-N 3.08Å; G806-C809 PolarHBondContact O-N 3.09Å; G806-C809 VanDerWaalsContact O-N 3.14Å; G806-L810 PolarHBondContact O-N 2.86Å
807	N	50.8	Low	58	Low	130 Å²	130	127.3 Å²	127.3	70%	0.695	61%	0.609	S	S	*	*	H	α-helix	trans	-66.7	-14.1	174.8	-71.7	2.6	0	0	0	114.3	N805	N805-N807 PolarHBondContact O-N 3.41Å
808	K	47.7	Very low	55.4	Low	155 Å²	155	131.2 Å²	131.2	67%	0.674	63%	0.63	S	S	*	*	H	α-helix	trans	-90.8	-42.5	166.3	-74.4	-174.2	172.3	-177.2	0	111.8	N805 G806 Q812	N805-K808 WeakPolarHBondContact O-CA 3.32Å; N805-K808 WeakPolarHBondContact O-CB 3.25Å; N805-K808 PolarHBondContact O-N 3.3Å; G806-K808 PolarHBondContact O-N 3.08Å; K808-Q812 PolarHBondContact O-N 3.23Å
809	C	45.9	Very low	53	Low	84 Å²	84	135.9 Å²	135.9	57%	0.568	66%	0.663	S	S	*	*	H	α-helix	trans	-70.1	-38.2	-176.5	-62.5	0	0	0	0	113.9	N805 G806	N805-C809 PolarHBondContact O-N 3.36Å; G806-C809 PolarHBondContact O-N 3.09Å; G806-C809 VanDerWaalsContact O-N 3.14Å
810	L	42.2	Very low	50.5	Low	147 Å²	147	137.4 Å²	137.4	77%	0.77	68%	0.684	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	-25.3	180	-88.3	160.6	0	0	0	113.7	G806	G806-L810 PolarHBondContact O-N 2.86Å
811	F	34.9	Very low	47.8	Very low	178 Å²	178	135.7 Å²	135.7	78%	0.781	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.1	-7.9	178.9	-106.8	-79.9	0	0	0	114.5
812	Q	37.7	Very low	45.4	Very low	155 Å²	155	133.3 Å²	133.3	72%	0.724	71%	0.706	S	S	*	*	G	3₁₀ helix	trans	-89.1	-11.4	-178.4	-141	169.1	-4.9	0	0	113.8	K808	K808-Q812 PolarHBondContact O-N 3.23Å
813	F	35.7	Very low	42.9	Very low	201 Å²	201	135.9 Å²	135.9	88%	0.882	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-83.6	-3	-179.5	-104.8	-81.3	0	0	0	115.5
814	N	31.9	Very low	40.7	Very low	160 Å²	160	136.1 Å²	136.1	86%	0.856	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-135.8	35.1	-177.9	-154.5	6	0	0	0	113.5
815	K	31.6	Very low	38.5	Very low	183 Å²	183	137.6 Å²	137.6	80%	0.796	75%	0.752	S	S	*	*			trans	-138.9	59.3	174.7	-159.6	178.6	-178.6	178.1	0	112.7
816	H	32.5	Very low	37	Very low	191 Å²	191	140.5 Å²	140.5	88%	0.884	77%	0.767	S	S	*	*			trans	-126.6	60.2	170.9	-121.6	-70.7	0	0	0	111.2
817	N	33.1	Very low	35.8	Very low	147 Å²	147	145.7 Å²	145.7	79%	0.786	80%	0.795	S	S	*	*	S	Bend	trans	-142.3	121.3	167.4	-99.9	-32.3	0	0	0	110
818	N	33	Very low	34.8	Very low	156 Å²	156	144.9 Å²	144.9	83%	0.834	79%	0.79	S	S	*	*	S	Bend	trans	65	147.5	172.7	-59.9	-23.9	0	0	0	118.6
819	S	33.3	Very low	34.3	Very low	119 Å²	119	142.4 Å²	142.4	83%	0.832	79%	0.79	S	S	*	*			trans	59.4	121.6	-174.6	-125.1	0	0	0	0	115.7
820	S	33.7	Very low	33.9	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	80%	0.796	S	S	*	*			cis	161.5	161.2	-11.7	39.4	0	0	0	0	105.2
821	S	32.6	Very low	33.6	Very low	117 Å²	117	142.9 Å²	142.9	82%	0.818	80%	0.796	S	S	*	*			trans	71.8	53.9	169.1	-165.7	0	0	0	0	117.7
822	C	33.3	Very low	33.6	Very low	133 Å²	133	140.7 Å²	140.7	90%	0.899	79%	0.79	S	S	*	*			trans	-155.3	38.8	145.4	-131.2	0	0	0	0	113
823	N	31.5	Very low	33.4	Very low	170 Å²	170	141.7 Å²	141.7	91%	0.909	80%	0.795	S	S	*	*			trans	-109.4	121	178.9	-70.6	-0.6	0	0	0	110.1
824	G	35	Very low	33.4	Very low	75 Å²	75	141.6 Å²	141.6	77%	0.773	80%	0.797	S	S	*	*			trans	177.5	138.1	175.9	0	0	0	0	0	111.4
825	L	29.3	Very low	33.5	Very low	169 Å²	169	140.5 Å²	140.5	89%	0.885	79%	0.792	S	S	*	*			trans	-66.1	155.2	175.4	-109.8	65.2	0	0	0	111.5
826	L	33.5	Very low	33.8	Very low	159 Å²	159	136.3 Å²	136.3	83%	0.832	78%	0.777	S	S	*	*	S	Bend	trans	80.2	111.4	168.8	-59.4	162	0	0	0	118.3
827	V	32.5	Very low	33.7	Very low	130 Å²	130	138.4 Å²	138.4	79%	0.788	78%	0.779	S	S	*	*			trans	58.9	100.7	144.1	-168.7	0	0	0	0	118.9
828	N	29.3	Very low	33.9	Very low	112 Å²	112	140 Å²	140	60%	0.599	78%	0.781	S	S	*	*				-156.7	119.7	124.7	-159.8	-32.4	0	0	0	111.6	N830	N828-N830 VanDerWaalsContact C-N 3.29Å; N828-N830 PolarHBondContact O-N 3.23Å; N828-N830 WeakPolarHBondContact OD1-CB 3.3Å; N828-N830 PolarHBondContact OD1-N 3.06Å
829	P	36.9	Very low	34	Very low	104 Å²	104	141.6 Å²	141.6	68%	0.675	78%	0.781	S	S	*	*			trans	-69	-21.2	175.5	-19.7	33.3	0	0	0	114.7	C831	P829-C831 PolarHBondContact O-N 3Å
830	N	39.4	Very low	34	Very low	127 Å²	127	146.2 Å²	146.2	68%	0.679	78%	0.78	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	21.5	-156.4	-58.4	-2.1	0	0	0	115.1	N828	N828-N830 VanDerWaalsContact C-N 3.29Å; N828-N830 PolarHBondContact O-N 3.23Å; N828-N830 WeakPolarHBondContact OD1-CB 3.3Å; N828-N830 PolarHBondContact OD1-N 3.06Å
831	C	34.2	Very low	34	Very low	114 Å²	114	153.1 Å²	153.1	77%	0.77	79%	0.79	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.2	2	179.8	-71.2	0	0	0	0	114.5	P829	P829-C831 PolarHBondContact O-N 3Å
832	I	35.6	Very low	34.1	Very low	131 Å²	131	155.9 Å²	155.9	67%	0.672	79%	0.793	S	S	*	*			trans	-134.3	59.7	-179.6	-45.5	179.2	0	0	0	110.9	I836	I832-I836 HydrophobicContact CG2-CD1 4.44Å
833	E	33.4	Very low	33.9	Very low	177 Å²	177	159 Å²	159	83%	0.827	79%	0.791	S	S	*	*			trans	-126.6	68.1	178.1	-164.2	170.1	-148.1	0	0	112.7
834	Q	35	Very low	33.8	Very low	198 Å²	198	158 Å²	158	93%	0.925	78%	0.78	S	S	*	*	S	Bend	trans	-152.3	-22.9	162.9	-118.9	163.9	41.6	0	0	115.6
835	D	35.3	Very low	33.5	Very low	138 Å²	138	165.7 Å²	165.7	74%	0.738	79%	0.786	S	S	*	*	S	Bend	trans	-99.9	-3.7	-172	-126.6	-23.3	0	0	0	115.3
836	I	37.3	Very low	33.6	Very low	94 Å²	94	164 Å²	164	48%	0.482	78%	0.777	S	S	.	*	S	Bend	trans	-87.6	-24.8	-166.6	-66.4	177	0	0	0	113.3	I832 H838	I832-I836 HydrophobicContact CG2-CD1 4.44Å; I836-H838 VanDerWaalsContact C-N 3.33Å; I836-H838 PolarHBondContact O-N 3.22Å
837	Y	31.3	Very low	33.4	Very low	235 Å²	235	164.5 Å²	164.5	92%	0.922	78%	0.775	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-25.3	-173.7	-130.3	-89	0	0	0	114
838	H	36.2	Very low	33.4	Very low	180 Å²	180	164.3 Å²	164.3	83%	0.833	77%	0.768	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.8	-7.4	-172.1	-133	-67.1	0	0	0	114.7	I836	I836-H838 VanDerWaalsContact C-N 3.33Å; I836-H838 PolarHBondContact O-N 3.22Å
839	K	35	Very low	33.6	Very low	190 Å²	190	164.1 Å²	164.1	83%	0.826	77%	0.773	S	S	*	*	S	Bend	trans	-111.8	0.6	-164.2	-144.7	168.2	-172.6	171.2	0	115.6
840	R	34.2	Very low	33.3	Very low	217 Å²	217	163.8 Å²	163.8	82%	0.819	77%	0.773	S	S	*	*	S	Bend	trans	-103.2	-6	-175.5	-77.9	-173.1	175.5	175.9	0.4	116.6
841	R	34.2	Very low	33	Very low	245 Å²	245	165 Å²	165	93%	0.925	78%	0.78	S	S	*	*	S	Bend	trans	-102	13.5	-170.2	-143.1	177.8	-174.8	177.7	1.3	116.7
842	M	33.7	Very low	33.2	Very low	176 Å²	176	166.6 Å²	166.6	87%	0.867	79%	0.785	S	S	*	*	S	Bend	trans	-128.1	43	177.4	-61.9	-152.7	-59.3	0	0	113.8
843	K	29	Very low	33.1	Very low	199 Å²	199	165.6 Å²	165.6	87%	0.865	79%	0.79	S	S	*	*			trans	-132.5	70.5	168.8	-82.5	-163.7	171.4	-169	0	111.6
844	H	29	Very low	32.9	Very low	148 Å²	148	166.5 Å²	166.5	69%	0.685	80%	0.797	S	S	*	*			trans	-161.6	59.3	160.5	-136.7	-59.9	0	0	0	115.1
845	W	28.8	Very low	32.6	Very low	236 Å²	236	160.7 Å²	160.7	89%	0.894	78%	0.783	S	S	*	*			trans	-139	52.7	164.8	-83.9	108	0	0	0	111.6	I848	W845-I848 HydrophobicContact CE3-CD1 4.45Å; W845-I848 HydrophobicContact CH2-CD1 4.14Å; W845-I848 HydrophobicContact CZ3-CD1 3.84Å
846	I	31.1	Very low	32.6	Very low	135 Å²	135	160.5 Å²	160.5	69%	0.692	79%	0.787	S	S	*	*	S	Bend	trans	-130.5	132.4	160.7	-64.8	178.6	0	0	0	105.6
847	Q	29.4	Very low	32.5	Very low	169 Å²	169	162.2 Å²	162.2	79%	0.79	80%	0.801	S	S	*	*			trans	53	102.8	175.5	-68.5	163.8	-51.2	0	0	116.4
848	I	33.6	Very low	32.5	Very low	126 Å²	126	157.6 Å²	157.6	65%	0.646	80%	0.798	S	S	*	*			trans	-114	106.2	154.5	-63.8	174.2	0	0	0	106.8	W845	W845-I848 HydrophobicContact CE3-CD1 4.45Å; W845-I848 HydrophobicContact CH2-CD1 4.14Å; W845-I848 HydrophobicContact CZ3-CD1 3.84Å
849	P	32.9	Very low	32.5	Very low	107 Å²	107	158.6 Å²	158.6	70%	0.695	80%	0.8	S	S	*	*			trans	-67.1	154.2	169.3	-18	32.2	0	0	0	111.3
850	S	30.6	Very low	32.6	Very low	98 Å²	98	158 Å²	158	69%	0.685	80%	0.804	S	S	*	*	S	Bend	trans	-63.5	143.8	167.5	53.6	0	0	0	0	111.7
851	N	33.1	Very low	32.6	Very low	152 Å²	152	154.3 Å²	154.3	81%	0.813	81%	0.806	S	S	*	*			trans	79.1	109.7	171.7	-45.2	-29	0	0	0	116.3
852	V	38	Very low	32.7	Very low	147 Å²	147	149.8 Å²	149.8	89%	0.891	80%	0.8	S	S	*	*				-172.3	144.5	124.1	143.6	0	0	0	0	107.8
853	S	34.9	Very low	32.8	Very low	110 Å²	110	147 Å²	147	77%	0.769	79%	0.794	S	S	*	*			trans	-85.7	141.5	-173.6	45.8	0	0	0	0	113.3	A855	S853-A855 PolarHBondContact O-N 3.15Å
854	M	29.1	Very low	32.9	Very low	197 Å²	197	149.1 Å²	149.1	97%	0.97	80%	0.796	S	S	*	*			trans	-93.5	80.2	180	-166.5	-179.5	-62.9	0	0	111.3
855	A	28.6	Very low	33.3	Very low	76 Å²	76	149 Å²	149	63%	0.628	80%	0.799	S	S	*	*			trans	-106.3	150.2	164.5	0	0	0	0	0	110	S853	S853-A855 PolarHBondContact O-N 3.15Å
856	T	33.9	Very low	33.4	Very low	134 Å²	134	148.1 Å²	148.1	82%	0.822	80%	0.801	S	S	*	*			trans	76	103.8	-176.9	-31	0	0	0	0	115
857	V	35.9	Very low	33.7	Very low	130 Å²	130	146.9 Å²	146.9	79%	0.788	81%	0.805	S	S	*	*				169	94	116.4	163.9	0	0	0	0	107
858	T	31.6	Very low	33.9	Very low	138 Å²	138	147.6 Å²	147.6	85%	0.847	81%	0.805	S	S	*	*			trans	-145.5	97.4	174.9	-13.7	0	0	0	0	109.5
859	K	36.9	Very low	33.9	Very low	201 Å²	201	148.2 Å²	148.2	87%	0.874	81%	0.809	S	S	*	*			trans	-173.4	163.1	166.3	-112.3	160	-174.6	177.7	0	111.5
860	L	36.3	Very low	33.8	Very low	176 Å²	176	151.6 Å²	151.6	92%	0.921	82%	0.821	S	S	*	*			trans	72.6	69.4	171.5	-61.5	166.1	0	0	0	117
861	T	34.6	Very low	34.1	Very low	140 Å²	140	152 Å²	152	86%	0.859	82%	0.824	S	S	*	*			trans	-84.4	139.3	143.5	50.1	0	0	0	0	110.3
862	D	36.8	Very low	34	Very low	151 Å²	151	152 Å²	152	81%	0.807	82%	0.821	S	S	*	*			trans	-155.5	-175.7	143.2	-149.7	-17.2	0	0	0	111.2
863	T	33.9	Very low	33.6	Very low	118 Å²	118	153 Å²	153	72%	0.724	82%	0.822	S	S	*	*			trans	-129.8	142.1	-142.2	55.1	0	0	0	0	114.4
864	R	32.3	Very low	33.4	Very low	243 Å²	243	154.6 Å²	154.6	92%	0.917	82%	0.815	S	S	*	*			trans	-168.7	173.2	156.1	-109.8	160.5	-172.1	-169.3	1.7	111.2
865	I	38.1	Very low	33.5	Very low	145 Å²	145	152.5 Å²	152.5	74%	0.744	80%	0.797	S	S	*	*			trans	68.5	63.9	177	-38.7	-179.8	0	0	0	114.8
866	K	30.5	Very low	33.9	Very low	218 Å²	218	154 Å²	154	95%	0.948	80%	0.8	S	S	*	*			trans	-105.5	48.9	168.8	-161.3	179	-179.3	178.7	0	112.2
867	S	35.7	Very low	33.9	Very low	109 Å²	109	155 Å²	155	76%	0.762	80%	0.799	S	S	*	*	S	Bend	trans	-144.6	4.4	-171.3	58.5	0	0	0	0	116.6
868	K	34.4	Very low	33.6	Very low	183 Å²	183	158.1 Å²	158.1	80%	0.796	80%	0.802	S	S	*	*	S	Bend	trans	-132.1	18.5	-171.1	-137.4	176	-173.7	179.7	0	116.1
869	L	34.1	Very low	33.7	Very low	139 Å²	139	158.2 Å²	158.2	73%	0.728	80%	0.796	S	S	*	*			trans	-114.2	23.3	-170.2	-137.9	75.9	0	0	0	116	S871	L869-S871 VanDerWaalsContact C-N 3.28Å; L869-S871 PolarHBondContact O-N 3.3Å; L869-S871 VanDerWaalsContact O-N 3.14Å
870	N	31.3	Very low	33.4	Very low	178 Å²	178	157.4 Å²	157.4	95%	0.952	80%	0.795	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86	58	173.3	-81.1	-1.9	0	0	0	112.4
871	S	35.4	Very low	33.3	Very low	106 Å²	106	155.7 Å²	155.7	74%	0.741	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-152.5	-15.8	173.7	63.4	0	0	0	0	115.6	L869	L869-S871 VanDerWaalsContact C-N 3.28Å; L869-S871 PolarHBondContact O-N 3.3Å; L869-S871 VanDerWaalsContact O-N 3.14Å
872	M	30.9	Very low	33.1	Very low	154 Å²	154	156.7 Å²	156.7	76%	0.759	79%	0.787	S	S	*	*			trans	-116.9	100.4	-178.1	-62.2	-175.6	78.6	0	0	110.2
873	N	29.6	Very low	33.1	Very low	168 Å²	168	157.8 Å²	157.8	90%	0.898	79%	0.788	S	S	*	*			trans	-144.8	79.9	178.8	-146.3	-12.5	0	0	0	112.5
874	K	31.1	Very low	33.1	Very low	143 Å²	143	160.7 Å²	160.7	62%	0.622	79%	0.793	S	S	*	*			trans	-158.3	151.1	164.5	-142.5	162.7	-171	163.8	0	109.8	E693	E693-K874 VanDerWaalsContact OE1-CE 3.23Å; E693-K874 WeakPolarHBondContact OE1-CE 3.45Å
875	Y	31.8	Very low	32.8	Very low	153 Å²	153	154.7 Å²	154.7	60%	0.6	79%	0.786	S	S	*	*			trans	68.2	99.9	-172.5	-55.7	-75	0	0	0	114.7	E693	E693-Y875 HydrophobicContact CG-CE1 3.69Å; E693-Y875 VanDerWaalsContact OE2-CE1 3.26Å; E693-Y875 WeakPolarHBondContact OE2-CE1 3.27Å
876	P	36.9	Very low	32.3	Very low	106 Å²	106	154.8 Å²	154.8	69%	0.688	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-81.1	138.4	173.8	33	-32.8	0	0	0	111.6
877	I	33.4	Very low	32.5	Very low	155 Å²	155	150.7 Å²	150.7	80%	0.795	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-88.7	129.2	166.5	-63.4	168.4	0	0	0	107.6	I879	I877-I879 HydrophobicContact CG2-CG1 4.46Å
878	F	30.1	Very low	32.3	Very low	196 Å²	196	151.7 Å²	151.7	86%	0.86	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-83.7	124.4	166.4	-87.6	-92.9	0	0	0	109.4
879	I	33.6	Very low	32	Very low	141 Å²	141	148.7 Å²	148.7	72%	0.723	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-103.3	132.5	163.6	-62.6	174.3	0	0	0	105.6	I877	I877-I879 HydrophobicContact CG2-CG1 4.46Å
880	E	31.5	Very low	31.9	Very low	183 Å²	183	150.1 Å²	150.1	86%	0.855	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-88.6	127.5	179.2	-166.6	156.4	-135.9	0	0	109.4
881	N	33	Very low	31.7	Very low	141 Å²	141	146.6 Å²	146.6	75%	0.754	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-88.2	117.8	-179.7	-72.3	-11.8	0	0	0	109.4
882	N	31.1	Very low	31.6	Very low	160 Å²	160	148.2 Å²	148.2	86%	0.856	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-77.8	124.2	166.6	-79.3	-13.3	0	0	0	110
883	E	36.8	Very low	31.6	Very low	175 Å²	175	146.7 Å²	146.7	82%	0.818	78%	0.777	S	S	*	*			trans	-114.8	149.5	162.7	-69.5	-168.8	141.1	0	0	111.1
884	H	32.8	Very low	31.8	Very low	179 Å²	179	144.8 Å²	144.8	83%	0.829	77%	0.772	S	S	*	*			trans	-24.3	157.2	167.5	-56.4	83.5	0	0	0	117.5
885	C	28.1	Very low	31.9	Very low	116 Å²	116	143.7 Å²	143.7	78%	0.784	78%	0.777	S	S	*	*			cis	-155.6	177.5	26	-150.2	0	0	0	0	114.3
886	N	27.4	Very low	32.1	Very low	148 Å²	148	142.4 Å²	142.4	79%	0.791	79%	0.785	S	S	*	*			trans	-81	149.5	179.1	-62.5	-46.1	0	0	0	113.8
887	T	33.5	Very low	32	Very low	132 Å²	132	143.6 Å²	143.6	81%	0.81	79%	0.791	S	S	*	*			trans	-154.1	113.4	141.1	6.1	0	0	0	0	114.6
888	T	32.3	Very low	31.9	Very low	130 Å²	130	141.9 Å²	141.9	80%	0.798	79%	0.788	S	S	*	*			trans	43	116.9	141.2	51.4	0	0	0	0	122.9
889	V	26.7	Very low	32.1	Very low	120 Å²	120	139.5 Å²	139.5	73%	0.727	79%	0.79	S	S	*	*			trans	-54.1	145.8	158.6	175	0	0	0	0	114.2
890	I	33.2	Very low	32	Very low	169 Å²	169	138.8 Å²	138.8	87%	0.867	79%	0.792	S	S	*	*			trans	-133.7	143.2	140.3	-65.5	-173.6	0	0	0	108.5
891	T	27.7	Very low	32.1	Very low	103 Å²	103	139.3 Å²	139.3	63%	0.632	80%	0.796	S	S	*	*			trans	-120.6	138.4	-176.7	-52.7	0	0	0	0	111	T893	T891-T893 HydrophobicContact CG2-CG2 4.34Å
892	T	33.5	Very low	31.8	Very low	141 Å²	141	142.1 Å²	142.1	87%	0.865	80%	0.802	S	S	*	*			trans	-147.4	145.9	162	18.8	0	0	0	0	111
893	T	29.5	Very low	31.9	Very low	122 Å²	122	141.5 Å²	141.5	75%	0.748	80%	0.804	S	S	*	*			trans	-143.4	132.9	-167.8	50.6	0	0	0	0	113.2	T891	T891-T893 HydrophobicContact CG2-CG2 4.34Å
894	T	34.8	Very low	31.6	Very low	128 Å²	128	139.1 Å²	139.1	79%	0.785	80%	0.802	S	S	*	*			trans	-152.1	125.6	159.7	36.7	0	0	0	0	106.8
895	T	32.8	Very low	31.6	Very low	119 Å²	119	139.1 Å²	139.1	73%	0.73	80%	0.804	S	S	*	*				57.7	121.6	63.5	68.2	0	0	0	0	112.9
896	T	34.9	Very low	31.5	Very low	127 Å²	127	139.4 Å²	139.4	78%	0.779	80%	0.802	S	S	*	*			cis	-144	-153.6	2.1	-13.7	0	0	0	0	108.9
897	T	34.5	Very low	31.5	Very low	130 Å²	130	136.8 Å²	136.8	80%	0.798	80%	0.802	S	S	*	*			cis	-152.4	-170.7	16.5	-32	0	0	0	0	109.1
898	T	31.7	Very low	31.3	Very low	120 Å²	120	137 Å²	137	74%	0.736	80%	0.803	S	S	*	*			trans	-139.8	150.8	-171	50.9	0	0	0	0	114
899	T	35.2	Very low	31	Very low	146 Å²	146	135.6 Å²	135.6	90%	0.896	80%	0.798	S	S	*	*			trans	-152.3	148.1	144.4	-30.5	0	0	0	0	110.2
900	T	30.9	Very low	31.1	Very low	125 Å²	125	138.6 Å²	138.6	77%	0.767	80%	0.801	S	S	*	*			trans	-146.5	147.7	-172.8	53.1	0	0	0	0	111.7
901	M	33.2	Very low	30.9	Very low	194 Å²	194	137.4 Å²	137.4	96%	0.956	79%	0.792	S	S	*	*			trans	-137	146.1	152.5	-91.3	-170.3	168.8	0	0	111.3
902	K	27.1	Very low	31	Very low	201 Å²	201	139.8 Å²	139.8	87%	0.874	80%	0.796	S	S	*	*			trans	-130.5	146.2	172.8	-76.2	-179.4	175.1	178.9	0	108.1
903	T	34.4	Very low	30.6	Very low	147 Å²	147	139.2 Å²	139.2	90%	0.902	79%	0.788	S	S	*	*			trans	-146.3	143.7	146.3	-37.7	0	0	0	0	109.9
904	T	29.3	Very low	30.5	Very low	124 Å²	124	139 Å²	139	76%	0.761	79%	0.787	S	S	*	*			trans	-115.1	158.7	179.3	29.2	0	0	0	0	110
905	M	32.5	Very low	30.1	Very low	179 Å²	179	138.8 Å²	138.8	88%	0.882	79%	0.785	S	S	*	*				-174.7	-178.7	125.8	-98.9	178.6	97.5	0	0	111.9
906	T	27	Very low	29.7	Very low	122 Å²	122	137.2 Å²	137.2	75%	0.748	78%	0.779	S	S	*	*			trans	-148.3	144.4	-147.9	50	0	0	0	0	115.9
907	A	27.9	Very low	29.3	Very low	94 Å²	94	140.9 Å²	140.9	78%	0.777	78%	0.78	S	S	*	*			trans	67.1	166.8	157.9	0	0	0	0	0	116.7
908	T	28.9	Very low	28.9	Very low	137 Å²	137	140.2 Å²	140.2	84%	0.84	77%	0.771	S	S	*	*			cis	-138.7	-178.3	13.7	41.6	0	0	0	0	113.6
909	S	26.1	Very low	28.7	Very low	99 Å²	99	143 Å²	143	69%	0.692	77%	0.774	S	S	*	*			trans	-54.2	163.3	176.6	61.6	0	0	0	0	116.5
910	K	28.8	Very low	28.5	Very low	183 Å²	183	142.9 Å²	142.9	80%	0.796	77%	0.766	S	S	*	*				-175.5	179.5	69.3	-130.3	175.3	-178.7	-175.4	0	114.9
911	E	27.2	Very low	28.4	Very low	145 Å²	145	143 Å²	143	68%	0.678	76%	0.762	S	S	*	*			trans	-65.8	162	174.6	-54.8	114.8	130.7	0	0	113.3
912	H	29.9	Very low	28.3	Very low	152 Å²	152	141.4 Å²	141.4	70%	0.704	76%	0.758	S	S	*	*				-173	153	55.4	-114.3	-68.5	0	0	0	114.3
913	N	26.3	Very low	28.6	Very low	129 Å²	129	135.4 Å²	135.4	69%	0.69	75%	0.752	S	S	*	*			trans	48.2	155.8	140.6	-70.1	12.9	0	0	0	126.1
914	T	27.3	Very low	28.3	Very low	119 Å²	119	135.4 Å²	135.4	73%	0.73	75%	0.752	S	S	*	*			trans	79.1	96.1	147	32.6	0	0	0	0	122
915	T	25.6	Very low	28.2	Very low	122 Å²	122	137.1 Å²	137.1	75%	0.748	76%	0.756	S	S	*	*				49.8	132.7	119.8	58.7	0	0	0	0	123.2
916	S	25.6	Very low	28.1	Very low	87 Å²	87	132.7 Å²	132.7	61%	0.608	74%	0.743	S	S	*	*				117.6	127.9	129.5	-72.5	0	0	0	0	119.1
917	Y	25.7	Very low	28.2	Very low	204 Å²	204	133.5 Å²	133.5	80%	0.8	74%	0.742	S	S	*	*			trans	58	150.6	154.8	-51.5	-52.8	0	0	0	118
918	D	27	Very low	28.3	Very low	115 Å²	115	135.5 Å²	135.5	62%	0.615	74%	0.739	S	S	*	*			cis	-165.1	164.5	-17.2	-114.9	-23.7	0	0	0	109.1
919	F	26.7	Very low	28.5	Very low	179 Å²	179	136 Å²	136	79%	0.785	74%	0.736	S	S	*	*			trans	61.3	152.3	161.3	-69.4	-54.9	0	0	0	118.2
920	I	31.8	Very low	29	Very low	143 Å²	143	136 Å²	136	73%	0.733	73%	0.734	S	S	*	*			cis	-142.7	145.4	3.7	-115.8	148.5	0	0	0	110.5
921	N	28.7	Very low	29	Very low	129 Å²	129	134.4 Å²	134.4	69%	0.69	73%	0.733	S	S	*	*			trans	-16	156.3	154	-59.8	-8.9	0	0	0	118.4
922	N	30.7	Very low	29.2	Very low	160 Å²	160	134.8 Å²	134.8	86%	0.856	74%	0.739	S	S	*	*			cis	-164.7	165.2	8	-119.7	-10.1	0	0	0	110.9
923	G	32.4	Very low	29.4	Very low	74 Å²	74	132.5 Å²	132.5	76%	0.763	75%	0.747	S	S	*	*			trans	124.3	92	163.3	0	0	0	0	0	114.9
924	T	28.5	Very low	29.6	Very low	147 Å²	147	133.7 Å²	133.7	90%	0.902	75%	0.752	S	S	*	*			trans	-86.4	135.9	-169.6	43.1	0	0	0	0	114.6
925	L	28.6	Very low	29.8	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	76%	0.758	S	S	*	*			trans	-144.3	144.4	168.1	-159.3	83.3	0	0	0	111.4
926	S	30.6	Very low	30.2	Very low	86 Å²	86	135.2 Å²	135.2	60%	0.601	76%	0.758	S	S	*	*			trans	64.6	120.2	151.1	69.2	0	0	0	0	121.6
927	N	28.6	Very low	30.3	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	77%	0.769	S	S	*	*				69.7	130.8	117.6	-70.4	-14.3	0	0	0	124.5
928	I	30.2	Very low	30.7	Very low	136 Å²	136	133.1 Å²	133.1	70%	0.697	76%	0.759	S	S	*	*				72.3	98	127.9	-62.2	170.9	0	0	0	118.2
929	N	32.1	Very low	30.9	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	77%	0.768	S	S	*	*				61.3	172.9	122.3	-89.4	-15.9	0	0	0	120.8
930	P	36.1	Very low	31.3	Very low	99 Å²	99	130.2 Å²	130.2	64%	0.643	76%	0.762	S	S	*	*			cis	-138.5	-169.4	-23.5	29.6	-5.9	0	0	0	114.6
931	L	29.7	Very low	31.1	Very low	149 Å²	149	132 Å²	132	78%	0.78	77%	0.765	S	S	*	*			trans	86.6	119.9	153.8	-54.6	175.4	0	0	0	122.1
932	L	31.1	Very low	31.2	Very low	153 Å²	153	131.2 Å²	131.2	80%	0.801	77%	0.77	S	S	*	*			trans	45.5	119	140.7	-77.9	78.5	0	0	0	121.9
933	A	34.1	Very low	31.1	Very low	104 Å²	104	128.7 Å²	128.7	86%	0.86	76%	0.76	S	S	*	*				-152.1	153.6	117.2	0	0	0	0	0	110.7
934	L	31.1	Very low	30.9	Very low	153 Å²	153	134.4 Å²	134.4	80%	0.801	77%	0.767	S	S	*	*			trans	-106	139.7	170.2	-68.9	113.4	0	0	0	110.4
935	N	31.5	Very low	31	Very low	159 Å²	159	133 Å²	133	85%	0.85	76%	0.763	S	S	*	*				-172	160	119.9	-95.2	-29.6	0	0	0	112
936	P	34.1	Very low	31	Very low	115 Å²	115	135.4 Å²	135.4	75%	0.747	76%	0.762	S	S	*	*			trans	-102.8	173.9	-169.4	39.9	-36.2	0	0	0	114.9
937	L	27.5	Very low	31	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	77%	0.767	S	S	*	*			trans	120.4	135.3	147.3	-150.6	75.5	0	0	0	116.4
938	S	34	Very low	31	Very low	86 Å²	86	135.9 Å²	135.9	60%	0.601	76%	0.761	S	S	*	*			trans	59.8	99.1	154.2	51.9	0	0	0	0	121.8
939	T	31.3	Very low	31	Very low	131 Å²	131	135.4 Å²	135.4	80%	0.804	77%	0.767	S	S	*	*				62.7	157.2	123.7	57.6	0	0	0	0	122.2
940	P	33.9	Very low	30.8	Very low	101 Å²	101	134.8 Å²	134.8	66%	0.656	76%	0.764	S	S	*	*			cis	-143	-179.2	-35.8	40.9	-23.5	0	0	0	115.4
941	F	27.8	Very low	30.5	Very low	182 Å²	182	138.8 Å²	138.8	80%	0.798	77%	0.774	S	S	*	*			trans	61	111.7	154	-78.8	-66.6	0	0	0	123.1	T943	F941-T943 HydrophobicContact CD1-CG2 4.02Å
942	S	31.3	Very low	30.4	Very low	112 Å²	112	138 Å²	138	78%	0.783	77%	0.77	S	S	*	*				-175.2	87.1	120.2	52.9	0	0	0	0	111.4
943	T	28.1	Very low	30.3	Very low	107 Å²	107	138.8 Å²	138.8	66%	0.656	77%	0.773	S	S	*	*				61.7	102.2	94.6	60.3	0	0	0	0	117.2	F941	F941-T943 HydrophobicContact CD1-CG2 4.02Å
944	H	29.6	Very low	30	Very low	194 Å²	194	142.6 Å²	142.6	90%	0.898	77%	0.773	S	S	*	*			trans	-136.9	149.6	134.3	-114	-92.3	0	0	0	108.1
945	S	30.2	Very low	29.7	Very low	117 Å²	117	146.3 Å²	146.3	82%	0.818	78%	0.778	S	S	*	*			trans	-86	148.8	-145.6	-52.5	0	0	0	0	117.7
946	Y	28.1	Very low	29.4	Very low	211 Å²	211	148.8 Å²	148.8	83%	0.827	78%	0.781	S	S	*	*			trans	-85.6	158.6	154.3	-87.7	-105.3	0	0	0	110.5	V948	Y946-V948 HydrophobicContact CD1-CG2 3.92Å
947	D	29.8	Very low	29.1	Very low	133 Å²	133	148.3 Å²	148.3	71%	0.711	78%	0.781	S	S	*	*			trans	-118.9	118.4	157.9	-127.8	2.9	0	0	0	106.5	K538	K538-D947 IonicContact NZ-OD2 2.66Å; K538-D947 PolarHBondContact NZ-OD2 2.89Å
948	V	29.2	Very low	29	Very low	102 Å²	102	145.9 Å²	145.9	62%	0.618	78%	0.777	S	S	*	*			trans	-142.2	121.4	178.7	176	0	0	0	0	109.7	Y946	Y946-V948 HydrophobicContact CD1-CG2 3.92Å
949	P	30.3	Very low	28.7	Very low	125 Å²	125	152 Å²	152	81%	0.812	79%	0.794	S	S	*	*			trans	-88.2	116.2	166.2	-3	22.3	0	0	0	110.5
950	N	27.4	Very low	28.4	Very low	137 Å²	137	149.7 Å²	149.7	73%	0.733	80%	0.796	S	S	*	*			trans	-72	150.2	154.6	-80.3	-16.4	0	0	0	109.1
951	H	31.5	Very low	28	Very low	183 Å²	183	148.6 Å²	148.6	85%	0.847	80%	0.795	S	S	*	*				-161.9	155.2	118.6	-107.2	-57.8	0	0	0	112.7
952	D	25.8	Very low	27.9	Very low	133 Å²	133	150.6 Å²	150.6	71%	0.711	80%	0.799	S	S	*	*			trans	-77.1	157.9	-174.3	-41.6	-105.1	0	0	0	113
953	I	29.1	Very low	27.7	Very low	168 Å²	168	155.9 Å²	155.9	86%	0.862	80%	0.803	S	S	*	*				-167.7	164.6	121.8	-97.3	155.2	0	0	0	109.6
954	Q	28.6	Very low	27.6	Very low	185 Å²	185	154.6 Å²	154.6	86%	0.864	80%	0.798	S	S	*	*			trans	-87.9	158.8	-153.5	-64.7	168	-36.4	0	0	116.2
955	Y	24.3	Very low	27.6	Very low	231 Å²	231	151.7 Å²	151.7	91%	0.906	79%	0.788	S	S	*	*			trans	-48.5	143.8	166.4	-77.4	-107.3	0	0	0	114.5
956	K	25.7	Very low	27.5	Very low	210 Å²	210	150.5 Å²	150.5	91%	0.913	77%	0.773	S	S	*	*				-155.7	158	121.7	-133.9	174.2	-177.2	177.9	0	113.4
957	S	26.7	Very low	27.4	Very low	105 Å²	105	141.2 Å²	141.2	73%	0.734	74%	0.741	S	S	*	*			trans	-121.6	145.9	179.8	49.6	0	0	0	0	112.1
958	S	27.3	Very low	27.3	Very low	110 Å²	110	137.8 Å²	137.8	77%	0.769	73%	0.727	S	S	*	*			trans	-173.2	123.6	156.1	-92.8	0	0	0	0	107.4
959	F	26.5	Very low	27.1	Very low	216 Å²	216	139.1 Å²	139.1	95%	0.947	74%	0.736	S	S	*	*				67.6	118	78.3	-97.1	-77.9	0	0	0	115.1
960	G	25.4	Very low	27	Very low	82 Å²	82	140.1 Å²	140.1	85%	0.845	73%	0.733	S	S	*	*			trans	154.8	111.9	167.8	0	0	0	0	0	113.5
961	A	25.5	Very low	26.8	Very low	78 Å²	78	139.3 Å²	139.3	65%	0.645	74%	0.738	S	S	*	*			trans	-101.4	162.3	-170.9	0	0	0	0	0	115
962	Y	26.7	Very low	26.6	Very low	223 Å²	223	137.5 Å²	137.5	88%	0.875	73%	0.73	S	S	*	*			trans	-156.2	165	146.7	-97.6	-71.5	0	0	0	110.8
963	Y	26.9	Very low	26.7	Very low	224 Å²	224	139 Å²	139	88%	0.878	73%	0.733	S	S	*	*			trans	-151.6	155.7	-161.6	-103.5	-85.7	0	0	0	115.4
964	S	25.4	Very low	26.5	Very low	79 Å²	79	140.8 Å²	140.8	55%	0.552	73%	0.73	S	S	*	*			trans	71.1	177.1	162.9	-109.9	0	0	0	0	120.7	N76 D77	N76-S964 PolarHBondContact ND2-OG 3.48Å; D77-S964 WeakPolarHBondContact OD1-CA 3.48Å; D77-S964 PolarHBondContact OD1-OG 3.39Å
965	I	28.8	Very low	26.5	Very low	134 Å²	134	134.2 Å²	134.2	69%	0.687	71%	0.713	S	S	*	*			cis	-153.3	160.5	27.4	-154.8	166.8	0	0	0	115.7	D77	D77-I965 WeakPolarHBondContact CB-O 3.37Å; D77-I965 VanDerWaalsContact OD1-C 3.32Å; D77-I965 WeakPolarHBondContact OD1-CA 3.35Å; D77-I965 PolarHBondContact OD1-N 3.5Å
966	D	28.5	Very low	26.6	Very low	91 Å²	91	130.7 Å²	130.7	49%	0.487	71%	0.71	S	S	.	*			trans	110.3	-114.9	172.4	-154.3	75.7	0	0	0	121.6	N76	N76-D966 WeakPolarHBondContact CA-O 3.44Å; N76-D966 PolarHBondContact N-O 3.18Å; N76-D966 PolarHBondContact ND2-N 3.05Å
967	G	27.2	Very low	26.7	Very low	16 Å²	16	127.5 Å²	127.5	17%	0.165	71%	0.707	C	S	.	*			trans	148.8	96.8	169.2	0	0	0	0	0	124.1	N76 D77 P78	N76-G967 VanDerWaalsContact CA-CA 3.46Å; D77-G967 VanDerWaalsContact C-N 3.31Å; D77-G967 CarbonylContact O-C 3.59Å; D77-G967 WeakPolarHBondContact O-CA 3.48Å; P78-G967 VanDerWaalsContact CD-N 3.26Å
968	S	25.9	Very low	26.6	Very low	61 Å²	61	127.9 Å²	127.9	43%	0.427	70%	0.701	S	S	.	*			trans	-173.6	130.8	173.5	63.1	0	0	0	0	119.9	D77 P78	D77-S968 PolarHBondContact O-N 3.49Å; P78-S968 WeakPolarHBondContact CG-OG 3.43Å
969	T	25.6	Very low	26.7	Very low	131 Å²	131	127.4 Å²	127.4	80%	0.804	70%	0.698	S	S	*	*			trans	28.6	116	140.6	58.6	0	0	0	0	122.5
970	I	27.9	Very low	26.7	Very low	145 Å²	145	127.6 Å²	127.6	74%	0.744	69%	0.694	S	S	*	*			trans	-131.1	122.5	147.1	-68.7	-177.2	0	0	0	109.9	Q972	I970-Q972 HydrophobicContact CG2-CB 3.79Å; I970-Q972 HydrophobicContact CG2-CG 3.82Å
971	S	24.3	Very low	26.9	Very low	121 Å²	121	129.5 Å²	129.5	85%	0.846	68%	0.68	S	S	*	*			trans	-111.3	82.2	171.6	55.6	0	0	0	0	109.7
972	Q	27.6	Very low	27.1	Very low	145 Å²	145	129.8 Å²	129.8	68%	0.678	67%	0.674	S	S	*	*			trans	-134.3	141.8	-177	-75.9	178.3	-31.8	0	0	113.1	I970	I970-Q972 HydrophobicContact CG2-CB 3.79Å; I970-Q972 HydrophobicContact CG2-CG 3.82Å
973	Q	27.2	Very low	27.2	Very low	164 Å²	164	125.4 Å²	125.4	77%	0.766	67%	0.666	S	S	*	*			trans	52.9	94.1	153.4	-67	166.5	-56.1	0	0	118.3
974	Y	25.3	Very low	27.3	Very low	205 Å²	205	120.6 Å²	120.6	80%	0.804	66%	0.655	S	S	*	*			trans	-109.8	75.1	131.5	-111.5	-101.6	0	0	0	108.6
975	G	26.9	Very low	27.5	Very low	48 Å²	48	119.2 Å²	119.2	50%	0.495	65%	0.646	S	S	.	*	S	Bend	trans	-128.1	154.4	166.5	0	0	0	0	0	108.2	V977	G975-V977 PolarHBondContact O-N 2.99Å
976	D	27.7	Very low	27.5	Very low	157 Å²	157	122.7 Å²	122.7	84%	0.84	66%	0.656	S	S	*	*			trans	-48.4	112.3	-157.6	-69.5	-80.5	0	0	0	117.2	N978	D976-N978 VanDerWaalsContact C-N 3.28Å; D976-N978 PolarHBondContact O-N 3.41Å
977	V	27.1	Very low	27.7	Very low	142 Å²	142	123 Å²	123	86%	0.861	67%	0.666	S	S	*	*			trans	-79.2	81.3	163.7	-175.2	0	0	0	0	108.8	G975	G975-V977 PolarHBondContact O-N 2.99Å
978	N	25	Very low	27.8	Very low	114 Å²	114	129.1 Å²	129.1	61%	0.61	69%	0.694	S	S	*	*			trans	-155.2	27.5	162.6	-113.7	-6.7	0	0	0	113.3	D976	D976-N978 VanDerWaalsContact C-N 3.28Å; D976-N978 PolarHBondContact O-N 3.41Å
979	S	29	Very low	28.2	Very low	100 Å²	100	133 Å²	133	70%	0.699	71%	0.711	S	S	*	*			trans	-90.1	109.1	169.1	44.2	0	0	0	0	110.8	H981	S979-H981 PolarHBondContact O-N 2.74Å
980	Y	26.8	Very low	28.4	Very low	219 Å²	219	132.9 Å²	132.9	86%	0.859	71%	0.705	S	S	*	*			trans	-78.4	116.5	172.2	-84.1	-96.7	0	0	0	110.3
981	H	29.6	Very low	28.6	Very low	122 Å²	122	132.7 Å²	132.7	57%	0.565	71%	0.705	S	S	*	*			trans	-123.1	105	174.7	-116.8	-69.9	0	0	0	112.7	S979	S979-H981 PolarHBondContact O-N 2.74Å
982	T	29.1	Very low	28.9	Very low	84 Å²	84	133.4 Å²	133.4	52%	0.515	70%	0.7	S	S	.	*			trans	34.8	121.6	138.4	57.6	0	0	0	0	121.4
983	N	29.3	Very low	29.1	Very low	131 Å²	131	135 Å²	135	70%	0.701	71%	0.707	S	S	*	*			trans	66.5	115.1	131.4	-53.1	2.8	0	0	0	120.3
984	N	28.4	Very low	29.1	Very low	123 Å²	123	131.3 Å²	131.3	66%	0.658	70%	0.699	S	S	*	*				167.8	130.2	99.5	-91.1	-33.8	0	0	0	114.6	T510	T510-N984 PolarHBondContact OG1-O 3.45Å
985	S	31	Very low	29.4	Very low	50 Å²	50	127.4 Å²	127.4	35%	0.35	70%	0.697	S	S	.	*			trans	178	117.2	139.3	27.9	0	0	0	0	108.6
986	F	29.3	Very low	29.3	Very low	208 Å²	208	131.1 Å²	131.1	91%	0.912	71%	0.71	S	S	*	*				60.5	98.6	77.7	-97.8	-85	0	0	0	115.9
987	S	31	Very low	29.5	Very low	98 Å²	98	130.3 Å²	130.3	69%	0.685	71%	0.71	S	S	*	*			trans	-166.2	129.4	130	-161.9	0	0	0	0	113
988	N	30.5	Very low	29.5	Very low	143 Å²	143	130.1 Å²	130.1	77%	0.765	71%	0.705	S	S	*	*			trans	42.4	111	157.6	-68.5	-6.5	0	0	0	120.9
989	N	32.9	Very low	29.8	Very low	144 Å²	144	131.7 Å²	131.7	77%	0.77	71%	0.713	S	S	*	*				-154.1	126.3	103.7	-104.5	-29	0	0	0	112.8
990	N	30.5	Very low	29.8	Very low	127 Å²	127	134.1 Å²	134.1	68%	0.679	71%	0.713	S	S	*	*			trans	39.1	102.3	149.6	-52.6	-20.4	0	0	0	119.8
991	N	32.1	Very low	29.8	Very low	141 Å²	141	131.4 Å²	131.4	75%	0.754	71%	0.706	S	S	*	*				169.1	132.6	100.7	-82.5	-34.1	0	0	0	114.3
992	N	30.9	Very low	29.9	Very low	136 Å²	136	132.8 Å²	132.8	73%	0.727	72%	0.715	S	S	*	*			trans	60.9	116.3	143.1	-58.8	-11.6	0	0	0	122.8
993	H	31.8	Very low	29.7	Very low	180 Å²	180	136 Å²	136	83%	0.833	73%	0.727	S	S	*	*			trans	63.9	151.7	150.2	-75.3	-86.7	0	0	0	120.4
994	S	28.1	Very low	29.9	Very low	85 Å²	85	136.7 Å²	136.7	59%	0.594	74%	0.736	S	S	*	*			cis	-172.9	154.5	-36.2	45.6	0	0	0	0	110.1
995	T	30.7	Very low	29.8	Very low	124 Å²	124	137.9 Å²	137.9	76%	0.761	74%	0.743	S	S	*	*			trans	60.2	125.4	170.5	53.5	0	0	0	0	117.6
996	T	25.2	Very low	29.9	Very low	125 Å²	125	142.6 Å²	142.6	77%	0.767	77%	0.769	S	S	*	*			cis	79.3	118.3	38.3	69.8	0	0	0	0	116.7
997	V	31.6	Very low	29.9	Very low	141 Å²	141	144.2 Å²	144.2	86%	0.855	77%	0.77	S	S	*	*			trans	-174.2	143	141	139.9	0	0	0	0	110.1
998	D	26.8	Very low	29.7	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	76%	0.764	S	S	*	*			trans	-105.5	170.2	-179.1	-60.8	-86.3	0	0	0	113.7
999	N	32.3	Very low	29.7	Very low	146 Å²	146	146.4 Å²	146.4	78%	0.781	77%	0.766	S	S	*	*			trans	170.2	117.1	144.6	-84.6	-34.8	0	0	0	108.4
1000	Q	27.8	Very low	29.6	Very low	151 Å²	151	144.5 Å²	144.5	71%	0.706	76%	0.759	S	S	*	*				63.2	115.3	58.9	-60.5	-165.2	-5.3	0	0	115.8
1001	F	28.2	Very low	29.6	Very low	163 Å²	163	144 Å²	144	72%	0.715	76%	0.761	S	S	*	*				178	138	103.8	-110.9	-93.9	0	0	0	117.1
1002	M	30.1	Very low	29.4	Very low	151 Å²	151	146.1 Å²	146.1	74%	0.744	77%	0.766	S	S	*	*			trans	13.5	114.8	157.8	-64.3	178.5	177.9	0	0	125.5
1003	I	26.3	Very low	29.5	Very low	150 Å²	150	148.2 Å²	148.2	77%	0.769	78%	0.776	S	S	*	*				24.1	126.7	104.2	-53.9	169.1	0	0	0	119.4
1004	T	31.8	Very low	29.4	Very low	147 Å²	147	145.1 Å²	145.1	90%	0.902	78%	0.775	S	S	*	*			trans	-162	160.8	131.1	-0.7	0	0	0	0	114.6
1005	N	27.9	Very low	29.5	Very low	147 Å²	147	144.3 Å²	144.3	79%	0.786	78%	0.78	S	S	*	*			trans	-98	152.2	-170	-87	-74	0	0	0	115.1
1006	T	33.2	Very low	29.5	Very low	149 Å²	149	147.8 Å²	147.8	91%	0.914	79%	0.787	S	S	*	*			trans	-146	159.4	144.1	22.2	0	0	0	0	111.8
1007	R	27.5	Very low	29.8	Very low	243 Å²	243	146.7 Å²	146.7	92%	0.917	79%	0.785	S	S	*	*			trans	-143.3	166.1	-166.3	176.4	-179.5	175	-172.3	1.5	110.9
1008	S	28.8	Very low	29.7	Very low	81 Å²	81	148 Å²	148	57%	0.566	78%	0.784	S	S	*	*			trans	88.4	148.1	178.4	-152.3	0	0	0	0	112.3
1009	Y	30.4	Very low	29.8	Very low	206 Å²	206	149 Å²	149	81%	0.808	79%	0.789	S	S	*	*			cis	-133.9	139.5	29.8	-88.6	-101.6	0	0	0	112
1010	V	30.3	Very low	29.8	Very low	104 Å²	104	147.4 Å²	147.4	63%	0.63	79%	0.787	S	S	*	*				66.3	104.9	83.3	175.1	0	0	0	0	112.7
1011	T	29.4	Very low	29.9	Very low	117 Å²	117	145 Å²	145	72%	0.718	79%	0.787	S	S	*	*				57.8	134.1	89.3	-14.9	0	0	0	0	116.6
1012	Q	28.1	Very low	30.1	Very low	184 Å²	184	146.1 Å²	146.1	86%	0.86	79%	0.792	S	S	*	*			trans	61.3	119	166.1	-64.5	-179.5	-18.5	0	0	118.7
1013	L	33.4	Very low	30.1	Very low	180 Å²	180	143.2 Å²	143.2	94%	0.942	79%	0.786	S	S	*	*				-158.3	130	129.7	-114.2	167.5	0	0	0	110.9
1014	S	29.9	Very low	30.1	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	78%	0.783	S	S	*	*			trans	-135.8	126.9	177	59.5	0	0	0	0	109.4
1015	G	30.1	Very low	30	Very low	68 Å²	68	142.1 Å²	142.1	70%	0.701	78%	0.78	S	S	*	*			trans	137.9	112.7	168.4	0	0	0	0	0	115.1
1016	H	30.6	Very low	30.2	Very low	196 Å²	196	139.3 Å²	139.3	91%	0.907	77%	0.771	S	S	*	*			trans	25.2	126.9	150.9	-50.6	-39.7	0	0	0	121
1017	S	30.7	Very low	29.9	Very low	102 Å²	102	137.6 Å²	137.6	71%	0.713	77%	0.766	S	S	*	*				-162.7	147.3	102.1	-160.9	0	0	0	0	113.1
1018	M	30.1	Very low	30	Very low	169 Å²	169	131.1 Å²	131.1	83%	0.833	76%	0.757	S	S	*	*			trans	5.3	134.7	158.6	-57.2	167.4	-169	0	0	118.2
1019	N	29.9	Very low	29.9	Very low	159 Å²	159	134.7 Å²	134.7	85%	0.85	77%	0.769	S	S	*	*				-159.1	142.3	55	-141	4.9	0	0	0	113.7
1020	P	31.6	Very low	29.9	Very low	112 Å²	112	132.1 Å²	132.1	73%	0.727	77%	0.77	S	S	*	*			trans	-117.5	139.3	178.9	38.3	-27.4	0	0	0	115.1
1021	S	29.8	Very low	29.7	Very low	101 Å²	101	132.5 Å²	132.5	71%	0.706	78%	0.777	S	S	*	*			trans	-167.4	151	165.5	54.6	0	0	0	0	112.5
1022	F	32.5	Very low	30	Very low	187 Å²	187	129.6 Å²	129.6	82%	0.82	76%	0.76	S	S	*	*			trans	61.8	98.5	178.6	-61.1	-77.2	0	0	0	114.1
1023	S	29.1	Very low	30.2	Very low	89 Å²	89	130 Å²	130	62%	0.622	76%	0.762	S	S	*	*			cis	61.3	137.8	32.5	115.3	0	0	0	0	111.1
1024	T	27.7	Very low	29.9	Very low	114 Å²	114	129.4 Å²	129.4	70%	0.699	75%	0.751	S	S	*	*			cis	172.3	130.6	7.6	19.1	0	0	0	0	104.9
1025	L	30.1	Very low	29.7	Very low	160 Å²	160	129.6 Å²	129.6	84%	0.838	75%	0.753	S	S	*	*				-172.5	152.8	121.5	-129.5	66.5	0	0	0	113.9
1026	S	30.8	Very low	29.6	Very low	88 Å²	88	131.2 Å²	131.2	62%	0.615	75%	0.753	S	S	*	*			trans	19.3	123.8	154.7	55.1	0	0	0	0	120.4
1027	S	27.3	Very low	29.4	Very low	114 Å²	114	130.2 Å²	130.2	80%	0.797	75%	0.751	S	S	*	*			cis	72.9	102.3	36.3	91.1	0	0	0	0	116.6
1028	S	28.6	Very low	29.2	Very low	106 Å²	106	132.5 Å²	132.5	74%	0.741	76%	0.755	S	S	*	*			trans	-168.2	111.2	143.3	56.5	0	0	0	0	113.6
1029	L	28.4	Very low	29.3	Very low	156 Å²	156	132.8 Å²	132.8	82%	0.817	75%	0.754	S	S	*	*				58.4	135.6	128	-67.8	159.6	0	0	0	122.5
1030	N	29.6	Very low	29.4	Very low	153 Å²	153	132.4 Å²	132.4	82%	0.818	75%	0.751	S	S	*	*			trans	92.4	120.1	147.5	-59.5	-12.8	0	0	0	120.7
1031	S	25.9	Very low	29.4	Very low	111 Å²	111	132.5 Å²	132.5	78%	0.776	75%	0.745	S	S	*	*			trans	-117.2	170.6	161.9	169.8	0	0	0	0	106.9
1032	P	36.7	Very low	29.5	Very low	57 Å²	57	134.1 Å²	134.1	37%	0.37	75%	0.746	S	S	.	*			cis	-120.7	163.7	-41.2	34.6	-22.3	0	0	0	111.1
1033	H	32.3	Very low	29.7	Very low	192 Å²	192	130.9 Å²	130.9	89%	0.889	74%	0.737	S	S	*	*			trans	-147.3	133.5	169.2	-106.5	-86.6	0	0	0	114.9
1034	K	25.7	Very low	30	Very low	167 Å²	167	132.5 Å²	132.5	73%	0.726	74%	0.739	S	S	*	*			trans	-74.6	136.4	153	-71.2	177.6	175.4	177.1	0	108.3
1035	S	26.6	Very low	30.3	Very low	120 Å²	120	133 Å²	133	84%	0.839	74%	0.737	S	S	*	*			trans	171.3	147.3	130.3	-76.5	0	0	0	0	113
1036	S	27	Very low	30.6	Very low	102 Å²	102	131.2 Å²	131.2	71%	0.713	73%	0.728	S	S	*	*			trans	-50.6	152.8	170.8	51.9	0	0	0	0	117
1037	M	27.1	Very low	30.7	Very low	175 Å²	175	133.9 Å²	133.9	86%	0.862	74%	0.736	S	S	*	*				-169.6	165	115.3	-106.2	-60.2	176	0	0	114.5
1038	L	25.8	Very low	31	Very low	150 Å²	150	134.2 Å²	134.2	79%	0.785	74%	0.738	S	S	*	*			trans	-95.9	156	-175.2	-73.5	124.4	0	0	0	114.6
1039	H	32.1	Very low	31.1	Very low	175 Å²	175	134 Å²	134	81%	0.81	74%	0.737	S	S	*	*			trans	-161.7	144.2	157.2	-83.7	-58	0	0	0	106.8
1040	L	32.6	Very low	31.2	Very low	151 Å²	151	133.8 Å²	133.8	79%	0.791	74%	0.736	S	S	*	*			cis	-158.2	163.4	-12.7	-84.4	169.4	0	0	0	106
1041	N	30.6	Very low	31.2	Very low	115 Å²	115	132.8 Å²	132.8	62%	0.615	73%	0.73	S	S	*	*			cis	-177.8	124.8	-27.2	166.4	92.3	0	0	0	109.2
1042	N	33.5	Very low	31.4	Very low	135 Å²	135	133.7 Å²	133.7	72%	0.722	73%	0.725	S	S	*	*			trans	-171.3	120.2	143.9	-106.8	-29.5	0	0	0	114
1043	N	35.2	Very low	31.1	Very low	119 Å²	119	136 Å²	136	64%	0.636	74%	0.739	S	S	*	*				36.5	133.2	123.4	-61.2	-15.2	0	0	0	119.5
1044	N	35.6	Very low	31.1	Very low	122 Å²	122	133.2 Å²	133.2	65%	0.652	73%	0.73	S	S	*	*			cis	-160.7	145.8	22.1	-110.6	-21.9	0	0	0	113.2
1045	N	35.2	Very low	31.5	Very low	124 Å²	124	132.9 Å²	132.9	66%	0.663	74%	0.736	S	S	*	*			trans	37.6	132	131.7	-60.1	-9.3	0	0	0	119.9
1046	N	35.9	Very low	31.8	Very low	123 Å²	123	135.1 Å²	135.1	66%	0.658	73%	0.733	S	S	*	*			cis	-172	150.5	29.4	-103.7	-21.5	0	0	0	112.1
1047	N	33.8	Very low	32.1	Very low	144 Å²	144	135.5 Å²	135.5	77%	0.77	74%	0.736	S	S	*	*			trans	53.1	149.1	139	-55.7	-22.7	0	0	0	121.4
1048	S	33.7	Very low	32.3	Very low	122 Å²	122	131.5 Å²	131.5	85%	0.853	73%	0.725	S	S	*	*			cis	-154.5	176.4	4.1	29.9	0	0	0	0	111.5
1049	S	30.2	Very low	32.4	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	73%	0.727	S	S	*	*			trans	-123	-167.4	-161.9	53.3	0	0	0	0	114.9
1050	L	30.2	Very low	32.2	Very low	151 Å²	151	128.5 Å²	128.5	79%	0.791	72%	0.722	S	S	*	*			trans	81.3	148.1	171.8	-85.4	79.8	0	0	0	117.9
1051	N	29.1	Very low	32	Very low	131 Å²	131	127.9 Å²	127.9	70%	0.701	73%	0.725	S	S	*	*			cis	-171.5	179.1	-21.8	-144.1	-12.9	0	0	0	113.3
1052	I	30	Very low	32.1	Very low	130 Å²	130	126.1 Å²	126.1	67%	0.667	73%	0.734	S	S	*	*			trans	84.6	100.3	143.8	-74.3	160.9	0	0	0	122.6
1053	T	30.2	Very low	31.8	Very low	107 Å²	107	127.6 Å²	127.6	66%	0.656	74%	0.74	S	S	*	*				55.8	132.7	129.3	73.7	0	0	0	0	127.4
1054	N	31.9	Very low	31.4	Very low	133 Å²	133	127.1 Å²	127.1	71%	0.711	75%	0.746	S	S	*	*				59.8	131	128.1	-56.9	0.8	0	0	0	123.8
1055	N	34.3	Very low	31.2	Very low	160 Å²	160	126.1 Å²	126.1	86%	0.856	75%	0.748	S	S	*	*				-171.3	178.9	108.7	-99.6	-37.9	0	0	0	115.3
1056	H	34.6	Very low	30.9	Very low	166 Å²	166	126 Å²	126	77%	0.769	76%	0.757	S	S	*	*			trans	-108.5	169	-159.7	-82.9	-115.7	0	0	0	116.7
1057	S	32.5	Very low	30.6	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	76%	0.763	S	S	*	*			trans	69.5	155.5	142.3	50	0	0	0	0	119.9
1058	S	30.8	Very low	30.3	Very low	91 Å²	91	125 Å²	125	64%	0.636	77%	0.768	S	S	*	*			cis	179.5	151.9	-16.8	54.2	0	0	0	0	111.1
1059	I	28.4	Very low	29.9	Very low	163 Å²	163	124 Å²	124	84%	0.836	76%	0.761	S	S	*	*			trans	63.6	145.7	145.7	-66.1	165.4	0	0	0	116
1060	S	28.6	Very low	29.8	Very low	99 Å²	99	124.5 Å²	124.5	69%	0.692	76%	0.764	S	S	*	*			cis	-154.7	161.2	15.1	36	0	0	0	0	113.3
1061	T	28.5	Very low	29.6	Very low	139 Å²	139	120.6 Å²	120.6	85%	0.853	76%	0.761	S	S	*	*			trans	-7.8	141.4	155	58	0	0	0	0	121.7
1062	G	31.3	Very low	29.6	Very low	78 Å²	78	123.5 Å²	123.5	80%	0.804	77%	0.77	S	S	*	*			trans	-160	140.3	156.8	0	0	0	0	0	112.1
1063	I	26.9	Very low	29.5	Very low	166 Å²	166	123.8 Å²	123.8	85%	0.851	77%	0.772	S	S	*	*			trans	-124.5	130.6	-173.6	-61.3	168.9	0	0	0	110.3
1064	S	27.8	Very low	29.5	Very low	109 Å²	109	125.9 Å²	125.9	76%	0.762	78%	0.779	S	S	*	*			trans	176.8	124.1	135.1	34.6	0	0	0	0	116
1065	S	30.5	Very low	29.3	Very low	101 Å²	101	127.8 Å²	127.8	71%	0.706	79%	0.789	S	S	*	*			trans	34.9	123.1	141.2	60.2	0	0	0	0	124.4
1066	S	30.2	Very low	28.9	Very low	121 Å²	121	123.8 Å²	123.8	85%	0.846	79%	0.785	S	S	*	*			trans	69.8	130.5	130.3	65.5	0	0	0	0	121.9
1067	G	28.2	Very low	28.5	Very low	75 Å²	75	123.5 Å²	123.5	77%	0.773	79%	0.789	S	S	*	*			trans	169	48.5	168.4	0	0	0	0	0	119.3
1068	I	27.7	Very low	28.4	Very low	170 Å²	170	124.6 Å²	124.6	87%	0.872	79%	0.791	S	S	*	*			trans	32.9	109.9	153.9	-50.8	164.9	0	0	0	118.4
1069	S	26.6	Very low	28.1	Very low	101 Å²	101	132 Å²	132	71%	0.706	81%	0.805	S	S	*	*				172.1	141.3	110	-162.3	0	0	0	0	114
1070	S	27.6	Very low	28.1	Very low	113 Å²	113	131.5 Å²	131.5	79%	0.79	81%	0.81	S	S	*	*			trans	24.2	108.6	150.3	60.7	0	0	0	0	120.8
1071	G	26.9	Very low	28.1	Very low	70 Å²	70	129.6 Å²	129.6	72%	0.722	81%	0.805	S	S	*	*			trans	170.4	95.6	160.1	0	0	0	0	0	118
1072	Q	27.7	Very low	28.1	Very low	191 Å²	191	128.2 Å²	128.2	89%	0.893	80%	0.802	S	S	*	*			trans	61.1	174.5	152.4	-56.7	177.6	-58.3	0	0	120.2
1073	I	29.1	Very low	27.9	Very low	137 Å²	137	131.6 Å²	131.6	70%	0.703	80%	0.8	S	S	*	*			trans	77.4	93.1	160.4	-47.1	-169.6	0	0	0	119.3
1074	N	29.1	Very low	28	Very low	151 Å²	151	132.1 Å²	132.1	81%	0.807	80%	0.796	S	S	*	*			trans	62.5	134.6	132.7	-54.9	-4.5	0	0	0	122.9
1075	D	27.6	Very low	28.1	Very low	172 Å²	172	133.2 Å²	133.2	92%	0.92	80%	0.798	S	S	*	*			trans	-69.5	152.4	172.6	-56.5	-82.1	0	0	0	114.6
1076	G	25.9	Very low	28	Very low	76 Å²	76	131.6 Å²	131.6	78%	0.784	80%	0.798	S	S	*	*			trans	-166.4	61.2	176.5	0	0	0	0	0	115.1
1077	L	27.7	Very low	27.8	Very low	161 Å²	161	131 Å²	131	84%	0.843	79%	0.794	S	S	*	*			trans	-157.4	101.7	174.2	-116.7	160.5	0	0	0	114.3
1078	T	29.1	Very low	27.6	Very low	133 Å²	133	136.5 Å²	136.5	82%	0.816	80%	0.799	S	S	*	*				166.1	91.1	126.9	35.8	0	0	0	0	112.2
1079	R	25.2	Very low	27.8	Very low	247 Å²	247	136.9 Å²	136.9	93%	0.932	80%	0.802	S	S	*	*			trans	-134.9	78.3	165.2	-167.6	-175.6	-174.1	-165.9	2.4	110.9	G1081	R1079-G1081 PolarHBondContact O-N 3.39Å
1080	T	27	Very low	27.7	Very low	152 Å²	152	139 Å²	139	93%	0.933	81%	0.805	S	S	*	*			trans	-89.3	74.4	177.6	35.7	0	0	0	0	111.7
1081	G	29.3	Very low	27.5	Very low	58 Å²	58	137.7 Å²	137.7	60%	0.598	80%	0.797	S	S	*	*			trans	-113.6	114	167.1	0	0	0	0	0	110.5	R1079 I1083	R1079-G1081 PolarHBondContact O-N 3.39Å; G1081-I1083 PolarHBondContact O-N 3.29Å
1082	S	28.2	Very low	27.4	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	80%	0.798	S	S	*	*			trans	-4.9	97.4	170.2	54.6	0	0	0	0	117.8
1083	I	26.7	Very low	27.3	Very low	148 Å²	148	137.4 Å²	137.4	76%	0.759	79%	0.793	S	S	*	*				29.6	101.2	109.9	-46.8	170.4	0	0	0	114.7	G1081	G1081-I1083 PolarHBondContact O-N 3.29Å
1084	F	29.3	Very low	27.1	Very low	177 Å²	177	138.1 Å²	138.1	78%	0.776	80%	0.797	S	S	*	*				-172.3	120.5	111.7	-115.3	-83.7	0	0	0	112.5
1085	T	29.7	Very low	27.2	Very low	132 Å²	132	136 Å²	136	81%	0.81	79%	0.794	S	S	*	*			trans	50.8	136.8	153	48.6	0	0	0	0	122.8
1086	G	28.2	Very low	27.4	Very low	67 Å²	67	133.3 Å²	133.3	69%	0.691	79%	0.786	S	S	*	*			trans	114.1	51.3	155.1	0	0	0	0	0	116.1
1087	S	26.4	Very low	27.4	Very low	110 Å²	110	138.3 Å²	138.3	77%	0.769	79%	0.786	S	S	*	*				59.4	101.6	94.9	71.6	0	0	0	0	115.6
1088	E	25.5	Very low	27.3	Very low	189 Å²	189	138 Å²	138	88%	0.883	79%	0.785	S	S	*	*			trans	27.3	127.9	148.3	-56.8	-176.3	156	0	0	120.8
1089	L	30.5	Very low	27.1	Very low	178 Å²	178	140.6 Å²	140.6	93%	0.932	79%	0.791	S	S	*	*				-152.8	155.4	114.8	-111.6	168.6	0	0	0	111.3
1090	N	24.1	Very low	27.2	Very low	145 Å²	145	135.4 Å²	135.4	78%	0.775	78%	0.781	S	S	*	*			trans	-99.8	179.7	-173.3	-166.8	7.4	0	0	0	110.9
1091	S	25.2	Very low	27.1	Very low	87 Å²	87	136 Å²	136	61%	0.608	77%	0.767	S	S	*	*			trans	79.5	124.3	162.2	76.6	0	0	0	0	120.1
1092	N	24.2	Very low	26.9	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	77%	0.772	S	S	*	*				53.3	113.1	123.5	-52.6	1.1	0	0	0	121
1093	S	24.8	Very low	27	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	78%	0.778	S	S	*	*			trans	67.7	-172.5	134.7	75.2	0	0	0	0	119.1
1094	I	25.6	Very low	26.9	Very low	152 Å²	152	145.8 Å²	145.8	78%	0.779	79%	0.786	S	S	*	*			trans	74.6	87.1	-179.1	-47.8	175.9	0	0	0	114.8
1095	S	30.2	Very low	26.9	Very low	106 Å²	106	141 Å²	141	74%	0.741	79%	0.787	S	S	*	*			trans	-68.2	146.9	155.5	173	0	0	0	0	111.2
1096	P	32.1	Very low	26.8	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	78%	0.784	S	S	*	*			trans	-120.7	105.1	156.5	31.8	-17.3	0	0	0	112.1
1097	K	25.6	Very low	26.9	Very low	181 Å²	181	148.1 Å²	148.1	79%	0.787	79%	0.793	S	S	*	*			trans	-65.4	161.5	145.4	-74	-178	175.1	-179.8	0	109.2
1098	N	26.2	Very low	26.8	Very low	154 Å²	154	153.7 Å²	153.7	82%	0.824	80%	0.797	S	S	*	*			trans	81	105.8	178.5	-46.9	-48.9	0	0	0	116.4
1099	M	26.2	Very low	26.8	Very low	189 Å²	189	149.3 Å²	149.3	93%	0.931	79%	0.787	S	S	*	*				-158.5	61.9	122.5	-159.6	66.9	178.8	0	0	111.6
1100	D	26	Very low	26.7	Very low	138 Å²	138	150.1 Å²	150.1	74%	0.738	78%	0.784	S	S	*	*			trans	-70	169.5	162.4	-87.9	-58.6	0	0	0	112
1101	Y	24.6	Very low	26.7	Very low	163 Å²	163	152.6 Å²	152.6	64%	0.639	79%	0.788	S	S	*	*			trans	95.5	140.2	171	-69.2	-94.5	0	0	0	118.4
1102	Y	25.2	Very low	27	Very low	180 Å²	180	156.3 Å²	156.3	71%	0.706	80%	0.8	S	S	*	*			trans	72	88.8	173.3	-59.5	-76	0	0	0	118
1103	L	31.4	Very low	27	Very low	171 Å²	171	156.8 Å²	156.8	90%	0.895	80%	0.802	S	S	*	*				-167.5	94.7	97.6	-99.8	161.2	0	0	0	112.3
1104	N	25.1	Very low	27.3	Very low	172 Å²	172	154.8 Å²	154.8	92%	0.92	80%	0.8	S	S	*	*			trans	-85.6	137.7	157.4	-96.1	-15.4	0	0	0	108.8
1105	G	28.4	Very low	27.4	Very low	78 Å²	78	152.7 Å²	152.7	80%	0.804	80%	0.798	S	S	*	*			trans	-145.4	104.3	173.6	0	0	0	0	0	110.6
1106	E	27.8	Very low	27.3	Very low	160 Å²	160	157 Å²	157	75%	0.748	81%	0.807	S	S	*	*			trans	-69.1	143	175.8	-74.4	-174.6	85	0	0	112
1107	Q	30.2	Very low	27.2	Very low	188 Å²	188	155.9 Å²	155.9	88%	0.879	81%	0.807	S	S	*	*			trans	-141.1	101.3	141.5	-107.5	-176	4.3	0	0	110.9
1108	R	23.2	Very low	27.3	Very low	226 Å²	226	153.3 Å²	153.3	85%	0.853	81%	0.806	S	S	*	*			trans	-90.7	121.1	165.3	-83	173.6	157.3	178	-3.4	109.6
1109	S	26.5	Very low	27.6	Very low	97 Å²	97	151.1 Å²	151.1	68%	0.678	80%	0.799	S	S	*	*			trans	-147.8	114.6	162.8	-23.6	0	0	0	0	112.9
1110	F	28.1	Very low	27.8	Very low	196 Å²	196	147.8 Å²	147.8	86%	0.86	79%	0.789	S	S	*	*			trans	44	110.9	148	-72.9	-90.8	0	0	0	121.4
1111	K	24.6	Very low	28.1	Very low	197 Å²	197	147 Å²	147	86%	0.857	79%	0.79	S	S	*	*			trans	-69	147	142.3	-79.9	179.8	173.1	176.4	0	110.1
1112	L	30.3	Very low	28.6	Very low	164 Å²	164	144.6 Å²	144.6	86%	0.859	79%	0.792	S	S	*	*			trans	-138.9	134.6	162	-111.9	164.7	0	0	0	109
1113	N	26.2	Very low	28.9	Very low	153 Å²	153	141.9 Å²	141.9	82%	0.818	80%	0.795	S	S	*	*			trans	-99.3	147.6	-175.4	-82	-9.6	0	0	0	112.1
1114	G	30.7	Very low	29.2	Very low	70 Å²	70	139.9 Å²	139.9	72%	0.722	79%	0.792	S	S	*	*			trans	163.8	99.2	171.5	0	0	0	0	0	108.8
1115	S	26.3	Very low	29.7	Very low	107 Å²	107	135.4 Å²	135.4	75%	0.748	78%	0.778	S	S	*	*			cis	79.8	119.2	44.8	-56.2	0	0	0	0	114.5
1116	Q	28	Very low	29.9	Very low	198 Å²	198	137.7 Å²	137.7	93%	0.925	78%	0.777	S	S	*	*			trans	71	150.2	171.3	-52.9	176.6	-0.3	0	0	114.8
1117	A	30.6	Very low	30.2	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	78%	0.776	S	S	*	*			cis	-143.2	178.4	9.3	0	0	0	0	0	114.4
1118	T	27.5	Very low	30.3	Very low	126 Å²	126	134.5 Å²	134.5	77%	0.773	78%	0.775	S	S	*	*			trans	-41.3	171.5	173.1	33.8	0	0	0	0	118
1119	T	32.6	Very low	30.6	Very low	108 Å²	108	131 Å²	131	66%	0.663	77%	0.772	S	S	*	*			cis	-171.8	144.4	46.6	-23.7	0	0	0	0	114.2
1120	T	30.5	Very low	31	Very low	119 Å²	119	131.9 Å²	131.9	73%	0.73	78%	0.776	S	S	*	*			trans	47.5	146.8	145.2	52.9	0	0	0	0	121.9
1121	T	33	Very low	31	Very low	122 Å²	122	128.1 Å²	128.1	75%	0.748	77%	0.768	S	S	*	*			cis	-170.9	-177.1	6.1	14.7	0	0	0	0	107.4
1122	T	34.2	Very low	31.4	Very low	112 Å²	112	126.3 Å²	126.3	69%	0.687	77%	0.766	S	S	*	*			cis	-165.9	156	1.5	13.8	0	0	0	0	104.6
1123	T	33	Very low	31.3	Very low	124 Å²	124	125 Å²	125	76%	0.761	76%	0.761	S	S	*	*			cis	70.3	150.7	26.4	65.1	0	0	0	0	116.5
1124	P	36.5	Very low	31.4	Very low	128 Å²	128	128.7 Å²	128.7	83%	0.831	76%	0.764	S	S	*	*			cis	-96.2	-152.3	-4.2	42.3	-34.9	0	0	0	112.2
1125	A	34.9	Very low	31.3	Very low	78 Å²	78	130.7 Å²	130.7	65%	0.645	76%	0.759	S	S	*	*			cis	-147.2	177.9	1.2	0	0	0	0	0	109.9
1126	T	32.8	Very low	31.5	Very low	126 Å²	126	133.5 Å²	133.5	77%	0.773	75%	0.753	S	S	*	*			cis	74.2	138.2	25.6	-3.2	0	0	0	0	114.6
1127	T	34.4	Very low	31.7	Very low	119 Å²	119	131.8 Å²	131.8	73%	0.73	75%	0.745	S	S	*	*			cis	-151.7	171	24.4	44.9	0	0	0	0	108.8
1128	L	33.5	Very low	31.6	Very low	163 Å²	163	133.6 Å²	133.6	85%	0.853	74%	0.74	S	S	*	*			cis	-172	171.1	-10.8	-102.5	168	0	0	0	107.8
1129	L	28	Very low	31.7	Very low	151 Å²	151	135.1 Å²	135.1	79%	0.791	74%	0.743	S	S	*	*			trans	-84	160.7	-179.4	-103.4	139.8	0	0	0	113.4
1130	P	35.4	Very low	31.6	Very low	116 Å²	116	138.3 Å²	138.3	75%	0.753	75%	0.751	S	S	*	*				-150.9	146.8	79.7	38.4	-18.3	0	0	0	119.8
1131	V	29	Very low	31.6	Very low	117 Å²	117	137.3 Å²	137.3	71%	0.709	75%	0.749	S	S	*	*			trans	31.2	127.5	131.2	-158.5	0	0	0	0	120.9
1132	I	31.7	Very low	31.4	Very low	159 Å²	159	138.4 Å²	138.4	82%	0.815	75%	0.75	S	S	*	*				171.4	145.2	123.5	-88.9	166.6	0	0	0	110.9
1133	N	28.2	Very low	31.3	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	76%	0.757	S	S	*	*			trans	-69.6	152.5	176.8	-63.3	-25.8	0	0	0	113.2
1134	Y	29	Very low	31.1	Very low	229 Å²	229	144.5 Å²	144.5	90%	0.898	76%	0.757	S	S	*	*				-168.1	165.4	102	-120.3	-93.4	0	0	0	113.7
1135	D	28.8	Very low	30.8	Very low	112 Å²	112	147.7 Å²	147.7	60%	0.599	75%	0.753	S	S	*	*			trans	-128.3	160.9	-173	179.1	30.4	0	0	0	110.9
1136	R	30.2	Very low	30.7	Very low	166 Å²	166	150.2 Å²	150.2	63%	0.626	76%	0.755	S	S	*	*			trans	67	135	167.6	-41.2	-172.7	-174.5	178	-4.4	120.1
1137	H	31	Very low	30.6	Very low	163 Å²	163	150.3 Å²	150.3	76%	0.755	75%	0.751	S	S	*	*				-175.4	146.6	92.6	-103.8	-92.6	0	0	0	107.9
1138	I	30.4	Very low	30.5	Very low	130 Å²	130	152.7 Å²	152.7	67%	0.667	75%	0.754	S	S	*	*			cis	75	95	25.3	-50.9	-178.8	0	0	0	114.6
1139	D	28.5	Very low	30.2	Very low	157 Å²	157	149.1 Å²	149.1	84%	0.84	74%	0.743	S	S	*	*			trans	-130.2	157.7	156.8	-105.1	-40.2	0	0	0	107.2
1140	E	30.2	Very low	30.4	Very low	176 Å²	176	149.9 Å²	149.9	82%	0.822	75%	0.746	S	S	*	*			cis	-120.9	146.3	2.9	-61.5	178.5	103.9	0	0	111.4
1141	S	31.2	Very low	29.8	Very low	97 Å²	97	150.3 Å²	150.3	68%	0.678	75%	0.75	S	S	*	*				163.6	145	107.2	56.1	0	0	0	0	112.8
1142	N	29	Very low	30	Very low	146 Å²	146	151.8 Å²	151.8	78%	0.781	76%	0.759	S	S	*	*			trans	61.7	77.3	164.4	-55.2	-54.8	0	0	0	118.3
1143	L	30.7	Very low	30	Very low	158 Å²	158	150.9 Å²	150.9	83%	0.827	76%	0.756	S	S	*	*				-171.3	124.8	102.5	-122.2	68.1	0	0	0	115.9
1144	R	30.2	Very low	30.1	Very low	205 Å²	205	150.9 Å²	150.9	77%	0.774	76%	0.756	S	S	*	*			trans	30.1	115.5	143.3	-80	177.4	160.9	171.4	-5.5	121.3
1145	R	30.5	Very low	30.2	Very low	196 Å²	196	149 Å²	149	74%	0.74	76%	0.755	S	S	*	*			trans	93.2	108.3	134.1	-67.3	178	-66.9	-169	-0.4	120.8
1146	N	31.2	Very low	30	Very low	130 Å²	130	151.5 Å²	151.5	70%	0.695	76%	0.761	S	S	*	*				85.4	112.9	121.8	-63.7	17.6	0	0	0	121.4
1147	N	31.7	Very low	30	Very low	129 Å²	129	151.8 Å²	151.8	69%	0.69	77%	0.773	S	S	*	*				95.3	119.4	126.7	-67.7	11.4	0	0	0	121.7
1148	H	32.6	Very low	29.9	Very low	168 Å²	168	149.2 Å²	149.2	78%	0.778	77%	0.774	S	S	*	*			trans	57.2	119.5	143.7	-71.4	-79.6	0	0	0	119.5
1149	S	27.1	Very low	29.8	Very low	89 Å²	89	148.2 Å²	148.2	62%	0.622	77%	0.77	S	S	*	*			cis	106.4	125.1	30.3	68.9	0	0	0	0	113
1150	I	31.1	Very low	29.9	Very low	167 Å²	167	150 Å²	150	86%	0.856	78%	0.776	S	S	*	*			trans	176	152.4	145.5	-95.1	153.6	0	0	0	109.9
1151	C	23.2	Very low	30	Very low	125 Å²	125	148.5 Å²	148.5	85%	0.845	77%	0.771	S	S	*	*			trans	-131.2	144.8	-170.2	-51.9	0	0	0	0	113.9
1152	V	32.6	Very low	29.8	Very low	147 Å²	147	150.7 Å²	150.7	89%	0.891	78%	0.776	S	S	*	*			trans	-155.5	152	164.4	-171.1	0	0	0	0	108.4
1153	N	32	Very low	29.9	Very low	141 Å²	141	152.1 Å²	152.1	75%	0.754	78%	0.777	S	S	*	*				-153.1	171.7	-54.5	-166.1	2.6	0	0	0	107.8
1154	N	30.8	Very low	29.9	Very low	138 Å²	138	152.7 Å²	152.7	74%	0.738	78%	0.781	S	S	*	*			trans	-77.2	147.5	-170	-60.6	-92.6	0	0	0	115.2
1155	Q	30.4	Very low	29.9	Very low	188 Å²	188	153.7 Å²	153.7	88%	0.879	79%	0.785	S	S	*	*				173.2	98.5	128.6	-98.9	174.3	-23.9	0	0	113.8
1156	F	26	Very low	30.1	Very low	165 Å²	165	153.3 Å²	153.3	72%	0.724	79%	0.789	S	S	*	*			trans	-166.8	48.5	138.1	-135.9	-96.8	0	0	0	115.5	N1159	F1156-N1159 HydrophobicContact CE1-CB 3.63Å; F1156-N1159 HydrophobicContact CE2-CB 4.47Å; F1156-N1159 HydrophobicContact CZ-CB 3.53Å
1157	I	30.1	Very low	30.3	Very low	172 Å²	172	154 Å²	154	88%	0.882	79%	0.793	S	S	*	*	S	Bend	trans	-94.5	148.8	152.1	-70.1	-180	0	0	0	107
1158	S	28.7	Very low	30.4	Very low	109 Å²	109	155 Å²	155	76%	0.762	80%	0.798	S	S	*	*	S	Bend	trans	78.4	50.7	-179.4	-163.2	0	0	0	0	116.8
1159	N	28.6	Very low	30.3	Very low	110 Å²	110	155 Å²	155	59%	0.588	80%	0.803	S	S	*	*			trans	-156	73	154.7	-108.8	-21.4	0	0	0	114	F1156	F1156-N1159 HydrophobicContact CE1-CB 3.63Å; F1156-N1159 HydrophobicContact CE2-CB 4.47Å; F1156-N1159 HydrophobicContact CZ-CB 3.53Å
1160	M	29.5	Very low	30.6	Very low	195 Å²	195	156.4 Å²	156.4	96%	0.961	81%	0.813	S	S	*	*	S	Bend	trans	-147.5	32.2	153.8	-135.1	-169.6	-63	0	0	112.1
1161	I	31.8	Very low	30.6	Very low	143 Å²	143	155.9 Å²	155.9	73%	0.733	81%	0.811	S	S	*	*	S	Bend	trans	-131.5	129.8	172.1	-64.4	175	0	0	0	105.6
1162	N	28.9	Very low	31	Very low	144 Å²	144	156.1 Å²	156.1	77%	0.77	81%	0.808	S	S	*	*	S	Bend	trans	47.3	100.8	173.8	-65.6	-17.9	0	0	0	117.3
1163	E	31	Very low	31.1	Very low	175 Å²	175	161.8 Å²	161.8	82%	0.818	83%	0.825	S	S	*	*				174.3	103.9	111	-86	-113.5	112.4	0	0	111.2
1164	N	31	Very low	31.1	Very low	170 Å²	170	162.8 Å²	162.8	91%	0.909	83%	0.828	S	S	*	*			trans	-159.6	91	132	-118.2	-50.4	0	0	0	109.5
1165	R	30.2	Very low	31.1	Very low	226 Å²	226	164.1 Å²	164.1	85%	0.853	83%	0.833	S	S	*	*			trans	-121.4	76.8	-168.9	-173.6	-164.3	-169.6	-175.8	5.1	110.1
1166	K	33	Very low	31.1	Very low	189 Å²	189	162.8 Å²	162.8	82%	0.822	83%	0.83	S	S	*	*			trans	-159.9	150.9	168.6	-103	143.7	-173.7	177.6	0	110.6
1167	N	35.6	Very low	31.4	Very low	145 Å²	145	162.6 Å²	162.6	78%	0.775	84%	0.837	S	S	*	*	S	Bend	trans	64.7	117.8	176.8	-44	-10.4	0	0	0	115
1168	N	35.3	Very low	31.5	Very low	148 Å²	148	162.1 Å²	162.1	79%	0.791	83%	0.834	S	S	*	*			cis	-137.1	133.5	-15.2	-67.5	-43.4	0	0	0	105
1169	L	30.1	Very low	31.7	Very low	169 Å²	169	165.6 Å²	165.6	89%	0.885	84%	0.839	S	S	*	*				75.5	57.5	51.2	-156.8	89.8	0	0	0	115.7
1170	S	33.6	Very low	31.9	Very low	119 Å²	119	169.6 Å²	169.6	83%	0.832	86%	0.857	S	S	*	*			trans	-176.6	163.1	142.6	54.6	0	0	0	0	110.9
1171	L	29.4	Very low	32.1	Very low	156 Å²	156	167.6 Å²	167.6	82%	0.817	85%	0.849	S	S	*	*			cis	-165.7	114.7	-44.6	-172.4	83.8	0	0	0	107.4
1172	V	32.5	Very low	32.2	Very low	130 Å²	130	169.7 Å²	169.7	79%	0.788	86%	0.858	S	S	*	*			trans	68.5	146.3	167	170.7	0	0	0	0	117.8
1173	Q	35.5	Very low	32.5	Very low	265 Å²	265	172 Å²	172	100%	1.238	87%	0.866	S	S	*	*			trans	70.7	0	-167.7	-67.2	-171.1	-11	0	0	116.2

Retrieved 1,173 of 1,173 residues in 1923.8 ms (Link to these results)

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