A0A087XNP7_POEFO Loading...

Glutamate receptor, metabotropic 6b

AlphaFold DB , UniProt , Accession A0A087XNP7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 882 aa.

						>A0A087XNP7_POEFO|A0A087XNP7
WLRALWLLLVGFSPLSLGTQPQSSLKIEGDITLGGLFPVHSRGPAGVPCGEIKREKGIHRLEAMLYALDQINSDPDLLPNITLGARILDTCSRDTYALEQSLTFVQALIQKDNSGVRCSNGETPIIPKPERVVGVIGASGSSVSIMVANVLRLFAIPQISYASTAPELSDNSRYEFFSRVVPPDSYQAQAMLDIVKAMGWNYVSTLASEGNYGESGVDAFVQISREAGGLCIAQSIKIPREPRRGEFDKIIKRLMETSNARGVIIFANEDDIKRVLQAAKKANLTGHFLFVGSDSWGAKSSPIEDQEEVAEGAVTILPKRASIDGFDQYFTSRSLENNRRNIWFAEFWEDDFKCKLTRPGIKYDPDRRKCTGEERISRDSQYEQEGKVQFVIDAVYAMAHALHSMHMDLCPGSMGVCEKMDPVEGRMLLQYIRSVNFNVFLQTTGSAGTAVMFNENGDAPGRYDIFQYQMSNVSNPGYRVIGQWTNHLRLNLEEMQWSGGDRKIPESVCSFPCEPGERKKMVKGVPCCWHCELCDGYQFLLDEFTCDMCPFDMRPLKNRTGCRPTPIIKLEWSSPWAIIPVFLAILGILATTGVITTFVRFNDTPIVRASGRELSYVLLTGIFLIYLITFFMIAEPSAGVCTIRRLLLGLGMCISYAAMLTKTNRIYRIFEQGKKSVTPPKFISPTSQLIITFILISVQLLGVFVWFGVVPPHTTIDYDELKPPNPEFARGILKCDMSDLSLILCLSYSIVLMITCTVYAIKSRGVPETFNEAKPIGFTMYTTCIIWLAFVPIFFGTAQSTEKMFIQTTTLTVSMSLSATVSLGMLYIPKVYVIIFHPEQNVQKRKRSFKAVVQAATVSTRLSQKVNDKQNGESKMEPDRSQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	W	48.1	Very low	39.7	Very low	281 Å²	281	148.2 Å²	148.2	100%	1.064	73%	0.734	S	S	*	*				0	-44.2	0	-82	76	0	0	0	113.7	R3 A4	W1-R3 PolarHBondContact O-N 2.85Å; W1-A4 PolarHBondContact O-N 2.88Å
2	L	46.2	Very low	38.8	Very low	164 Å²	164	152.6 Å²	152.6	86%	0.859	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-14.3	174.6	-92	135.4	0	0	0	116.6
3	R	38.1	Very low	37.7	Very low	228 Å²	228	148.6 Å²	148.6	86%	0.86	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.5	-14	171.8	-79.5	-174.9	175.1	179.3	-1.6	114.6	W1	W1-R3 PolarHBondContact O-N 2.85Å
4	A	40.6	Very low	36.9	Very low	62 Å²	62	146.7 Å²	146.7	51%	0.512	75%	0.747	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.6	-26.4	177	0	0	0	0	0	112.2	W1	W1-A4 PolarHBondContact O-N 2.88Å
5	L	41.1	Very low	36.1	Very low	111 Å²	111	147.8 Å²	147.8	58%	0.581	75%	0.754	S	S	*	*	H	α-helix	trans	-73.8	-26.8	178.4	-123.8	94.6	0	0	0	113.1
6	W	39.2	Very low	35.4	Very low	195 Å²	195	144.9 Å²	144.9	74%	0.739	75%	0.751	S	S	*	*	H	α-helix	trans	-78.5	-20.8	-178.2	-124.7	83.7	0	0	0	113.6	V10	W6-V10 HydrophobicContact CE3-CG2 3.92Å; W6-V10 HydrophobicContact CZ3-CG2 3.83Å
7	L	37.2	Very low	34.7	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	76%	0.758	S	S	*	*	H	α-helix	trans	-84.2	-15.9	174.9	-78.2	161.6	0	0	0	113.1
8	L	39.3	Very low	34.1	Very low	142 Å²	142	141 Å²	141	74%	0.743	75%	0.746	S	S	*	*	H	α-helix	trans	-88.2	-15.2	176	-86.2	156.8	0	0	0	113.5
9	L	37.2	Very low	33.7	Very low	141 Å²	141	140.6 Å²	140.6	74%	0.738	75%	0.75	S	S	*	*	S	Bend	trans	-104.9	-5.9	-174.6	-84.1	157.1	0	0	0	115
10	V	37.8	Very low	33.4	Very low	100 Å²	100	142.5 Å²	142.5	61%	0.606	75%	0.754	S	S	*	*	S	Bend	trans	-111.2	3.5	179.9	-172.2	0	0	0	0	112.3	W6 F12	W6-V10 HydrophobicContact CE3-CG2 3.92Å; W6-V10 HydrophobicContact CZ3-CG2 3.83Å; V10-F12 PolarHBondContact O-N 3.33Å
11	G	31.8	Very low	33.6	Very low	57 Å²	57	141 Å²	141	59%	0.588	75%	0.753	S	S	*	*			trans	-95.3	27.4	-176.1	0	0	0	0	0	116.1
12	F	28.7	Very low	33.6	Very low	201 Å²	201	135 Å²	135	88%	0.882	74%	0.737	S	S	*	*			trans	-128.2	78.3	168	-82.4	-84.9	0	0	0	109.1	V10	V10-F12 PolarHBondContact O-N 3.33Å
13	S	24.7	Very low	34.6	Very low	101 Å²	101	130.1 Å²	130.1	71%	0.706	72%	0.716	S	S	*	*			trans	-58.2	135.4	148.9	-65.2	0	0	0	0	106.8	L15	S13-L15 PolarHBondContact O-N 3.07Å
14	P	26.8	Very low	36.8	Very low	122 Å²	122	120.7 Å²	120.7	79%	0.792	69%	0.686	S	S	*	*			trans	-57.9	115.4	168.8	25.5	-29.4	0	0	0	105.4	S16	P14-S16 VanDerWaalsContact C-N 3.33Å; P14-S16 PolarHBondContact O-N 3.18Å
15	L	25.2	Very low	39.2	Very low	163 Å²	163	117.9 Å²	117.9	85%	0.853	66%	0.662	S	S	*	*			trans	-48.8	112.1	161	-154.3	84.3	0	0	0	103.6	S13 L17	S13-L15 PolarHBondContact O-N 3.07Å; L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.47Å
16	S	24.1	Very low	41.5	Very low	101 Å²	101	117.5 Å²	117.5	71%	0.706	66%	0.655	S	S	*	*			trans	-42	108.1	168.1	148.1	0	0	0	0	105.2	P14 G18	P14-S16 VanDerWaalsContact C-N 3.33Å; P14-S16 PolarHBondContact O-N 3.18Å; S16-G18 PolarHBondContact O-N 3.25Å
17	L	24.3	Very low	44.1	Very low	166 Å²	166	110 Å²	110	87%	0.869	63%	0.629	S	S	*	*			trans	-58.2	98.2	168.2	-144.1	83.9	0	0	0	102.5	L15 T19	L15-L17 VanDerWaalsContact C-N 3.32Å; L15-L17 PolarHBondContact O-N 3.47Å; L17-T19 PolarHBondContact O-N 3.34Å
18	G	24.4	Very low	46.7	Very low	54 Å²	54	109.8 Å²	109.8	56%	0.557	63%	0.625	S	S	*	*			trans	-49.5	117.6	175.3	0	0	0	0	0	104.8	S16 Q20	S16-G18 PolarHBondContact O-N 3.25Å; G18-Q20 PolarHBondContact O-N 3.28Å
19	T	25	Very low	49.2	Very low	133 Å²	133	104.3 Å²	104.3	82%	0.816	60%	0.602	S	S	*	*			trans	-47	109.5	178.6	-34.4	0	0	0	0	105.7	L17 P21	L17-T19 PolarHBondContact O-N 3.34Å; T19-P21 VanDerWaalsContact O-CD 3.23Å; T19-P21 WeakPolarHBondContact O-CD 3.36Å
20	Q	29.4	Very low	51.7	Low	178 Å²	178	102.4 Å²	102.4	83%	0.832	59%	0.593	S	S	*	*			trans	-54.2	117	176.2	-89.5	-168.8	-19.9	0	0	105.8	G18 Q22	G18-Q20 PolarHBondContact O-N 3.28Å; Q20-Q22 PolarHBondContact O-N 3.41Å
21	P	37.4	Very low	54.4	Low	112 Å²	112	97.9 Å²	97.9	73%	0.727	57%	0.565	S	S	*	*			trans	-58.9	136	176.5	22.5	-29.2	0	0	0	107.2	T19 S23	T19-P21 VanDerWaalsContact O-CD 3.23Å; T19-P21 WeakPolarHBondContact O-CD 3.36Å; P21-S23 PolarHBondContact O-N 2.75Å
22	Q	47.3	Very low	57.4	Low	154 Å²	154	95.7 Å²	95.7	72%	0.72	54%	0.54	S	S	*	.			trans	-45.6	117.4	180	-71.4	-178.8	-31.3	0	0	109.4	Q20 S24 I342	Q20-Q22 PolarHBondContact O-N 3.41Å; Q22-S24 PolarHBondContact O-N 3.13Å; Q22-I342 WeakPolarHBondContact O-CD1 3.09Å
23	S	67.4	Low	60.6	Low	62 Å²	62	86.1 Å²	86.1	43%	0.434	50%	0.498	S	S	.	.			trans	-82.4	6.2	-166.4	56.6	0	0	0	0	114.3	P21	P21-S23 PolarHBondContact O-N 2.75Å
24	S	83.8	Confident	64	Low	31 Å²	31	81.3 Å²	81.3	22%	0.217	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.8	139.2	-174.4	65.8	0	0	0	0	111.8	Q22 I87	Q22-S24 PolarHBondContact O-N 3.13Å; S24-I87 WeakPolarHBondContact CA-O 3.34Å
25	L	90.1	Very high	67.3	Low	3 Å²	3	75.5 Å²	75.5	2%	0.016	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	130.5	169.2	178.3	170	0	0	0	108.9	I27 L61 L65 R86 I87 R340 N341 W343	L25-I27 HydrophobicContact CD2-CD1 3.93Å; L25-I27 HydrophobicContact CD2-CG1 3.76Å; L25-L61 HydrophobicContact CD1-CD2 4.05Å; L25-L65 HydrophobicContact CD1-CD1 4.26Å; L25-L65 HydrophobicContact CD2-CD2 4.23Å; L25-R86 CarbonylContact O-C 3.56Å; L25-R86 WeakPolarHBondContact O-CA 3.43Å; L25-I87 HydrophobicContact CB-CB 4.2Å; L25-I87 HydrophobicContact CD2-CB 4.48Å; L25-I87 HydrophobicContact CD2-CD1 4.15Å; L25-I87 HydrophobicContact CD2-CG1 4.41Å; L25-I87 PolarHBondContact N-O 3.42Å; L25-I87 PolarHBondContact O-N 3.41Å; L25-R340 WeakPolarHBondContact CG-O 3.32Å; L25-N341 HydrophobicContact CD1-CB 4.07Å; L25-W343 HydrophobicContact CB-CH2 4.35Å; L25-W343 HydrophobicContact CB-CZ3 3.85Å; L25-W343 HydrophobicContact CD1-CZ3 4.4Å
26	K	91.2	Very high	70.7	Confident	102 Å²	102	67.7 Å²	67.7	44%	0.443	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	131.7	179.6	-175.3	-176	171.6	-170.2	0	111.3	E28 A85 E130	K26-E28 WeakPolarHBondContact CE-OE1 3.28Å; K26-E28 IonicContact NZ-OE1 3.11Å; K26-E28 PolarHBondContact NZ-OE1 3.18Å; K26-A85 CarbonylContact C-O 3.46Å; K26-A85 WeakPolarHBondContact CA-O 3.4Å; K26-E130 WeakPolarHBondContact CD-OE2 3.49Å; K26-E130 VanDerWaalsContact CE-CD 3.42Å; K26-E130 WeakPolarHBondContact CE-OE1 3.38Å; K26-E130 WeakPolarHBondContact CE-OE2 3.4Å; K26-E130 IonicContact NZ-OE2 2.68Å
27	I	93.1	Very high	74.1	Confident	37 Å²	37	62.9 Å²	62.9	19%	0.19	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	122.8	169.9	-55.5	-60.7	0	0	0	107.2	L25 L65 G84 A85 R340	L25-I27 HydrophobicContact CD2-CD1 3.93Å; L25-I27 HydrophobicContact CD2-CG1 3.76Å; I27-L65 HydrophobicContact CD1-CD2 4.33Å; I27-L65 HydrophobicContact CG1-CD2 3.89Å; I27-G84 CarbonylContact O-C 3.46Å; I27-G84 VanDerWaalsContact O-CA 3.31Å; I27-G84 WeakPolarHBondContact O-CA 3.46Å; I27-A85 HydrophobicContact CB-CB 4.31Å; I27-A85 HydrophobicContact CG1-CB 4.46Å; I27-A85 PolarHBondContact N-O 3.33Å; I27-A85 PolarHBondContact O-N 2.95Å; I27-R340 HydrophobicContact CD1-CB 4.18Å
28	E	91.1	Very high	77.4	Confident	146 Å²	146	55.3 Å²	55.3	68%	0.682	31%	0.313	S	S	*	.			trans	-70	144.4	178.1	-60.7	-94.3	141	0	0	110.5	K26	K26-E28 WeakPolarHBondContact CE-OE1 3.28Å; K26-E28 IonicContact NZ-OE1 3.11Å; K26-E28 PolarHBondContact NZ-OE1 3.18Å
29	G	91.6	Very high	80.7	Confident	27 Å²	27	52.7 Å²	52.7	28%	0.278	29%	0.287	S	S	.	.			trans	-174.1	169.6	173.6	0	0	0	0	0	111	I31 T82	G29-I31 VanDerWaalsContact C-N 3.32Å; G29-T82 CarbonylContact C-O 3.6Å; G29-T82 WeakPolarHBondContact CA-OG1 3.26Å
30	D	91.7	Very high	83.8	Confident	100 Å²	100	47 Å²	47	54%	0.535	25%	0.251	S	S	.	.	S	Bend	trans	-66.8	-35.3	178.9	-58.4	-56.4	0	0	0	111.9	I81 T82 V416	D30-I81 HydrophobicContact CB-CG2 4.33Å; D30-T82 PolarHBondContact N-O 3.4Å; D30-T82 PolarHBondContact N-OG1 3.01Å; D30-T82 VanDerWaalsContact N-OG1 3.1Å; D30-T82 PolarHBondContact OD2-N 2.67Å; D30-T82 PolarHBondContact OD2-OG1 3.06Å; D30-V416 HydrophobicContact CB-CG2 4.15Å
31	I	93.9	Very high	86.5	Confident	6 Å²	6	40 Å²	40	3%	0.031	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	120.1	176.3	-61.2	178.9	0	0	0	109.2	G29 I81 T82 L83 G84 V133 L402 V416 V423	G29-I31 VanDerWaalsContact C-N 3.32Å; I31-I81 HydrophobicContact CD1-CG2 3.95Å; I31-I81 HydrophobicContact CG1-CG2 4.25Å; I31-T82 PolarHBondContact N-O 3.45Å; I31-L83 HydrophobicContact CB-CD2 3.95Å; I31-L83 HydrophobicContact CG2-CD2 4.23Å; I31-L83 WeakPolarHBondContact O-CA 3.48Å; I31-G84 PolarHBondContact O-N 2.81Å; I31-V133 HydrophobicContact CG2-CB 4.28Å; I31-V133 HydrophobicContact CG2-CG1 3.93Å; I31-V133 HydrophobicContact CG2-CG2 3.36Å; I31-L402 HydrophobicContact CD1-CD2 4.34Å; I31-L402 HydrophobicContact CG2-CD1 4.14Å; I31-V416 HydrophobicContact CD1-CG2 4Å; I31-V416 HydrophobicContact CG1-CG2 3.96Å; I31-V423 HydrophobicContact CD1-CG2 4.44Å
32	T	94.4	Very high	88.6	Confident	10 Å²	10	40 Å²	40	6%	0.061	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	127.2	-179	-53.4	0	0	0	0	112.4	R86 E130 V132 V133	T32-R86 HydrophobicContact CG2-CB 4.05Å; T32-E130 WeakPolarHBondContact CB-OE1 3.44Å; T32-E130 HydrophobicContact CG2-CG 4Å; T32-E130 WeakPolarHBondContact CG2-OE1 3.28Å; T32-E130 WeakPolarHBondContact OG1-CG 3.41Å; T32-E130 PolarHBondContact OG1-OE1 3.11Å; T32-V132 HydrophobicContact CG2-CG2 4.4Å; T32-V132 WeakPolarHBondContact O-CA 3.39Å; T32-V133 PolarHBondContact O-N 3.09Å; T32-V133 VanDerWaalsContact O-N 3.1Å
33	L	96.7	Very high	90.2	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.5	170.2	-57.5	-174.5	0	0	0	111.9	M64 L68 G84 A85 R86 V133 M398	L33-M64 HydrophobicContact CB-CE 3.98Å; L33-L68 HydrophobicContact CD1-CD2 4.39Å; L33-G84 PolarHBondContact N-O 3.23Å; L33-A85 CarbonylContact O-C 3.34Å; L33-A85 WeakPolarHBondContact O-CA 3.09Å; L33-R86 PolarHBondContact O-N 3.2Å; L33-V133 HydrophobicContact CD2-CG2 3.69Å; L33-M398 HydrophobicContact CD1-CB 4.4Å; L33-M398 HydrophobicContact CD1-CG 4Å; L33-M398 HydrophobicContact CD2-CG 3.69Å
34	G	95.8	Very high	90.8	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	142.2	171.5	0	0	0	0	0	110.5	R86 G134 V135 I136	G34-R86 CarbonylContact C-O 3.59Å; G34-R86 WeakPolarHBondContact CA-O 3.34Å; G34-G134 PolarHBondContact N-O 3.11Å; G34-V135 CarbonylContact O-C 3.59Å; G34-V135 WeakPolarHBondContact O-CA 3.21Å; G34-I136 PolarHBondContact O-N 2.94Å
35	G	96.3	Very high	90.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	133.2	173.2	0	0	0	0	0	111.4	R86 I87 L88	G35-R86 PolarHBondContact N-O 3Å; G35-I87 CarbonylContact O-C 3.59Å; G35-I87 WeakPolarHBondContact O-CA 3.4Å; G35-L88 PolarHBondContact O-N 2.99Å
36	L	96.4	Very high	89.6	Confident	0 Å²	0	42 Å²	42	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	100.8	176.9	-69.9	177.9	0	0	0	110.6	L88 T90 F104 V135 I136 A138 V147 Y161	L36-L88 HydrophobicContact CD2-CB 3.99Å; L36-L88 HydrophobicContact CD2-CD1 4.33Å; L36-T90 HydrophobicContact CB-CG2 3.82Å; L36-T90 HydrophobicContact CD2-CG2 4.11Å; L36-T90 HydrophobicContact CG-CG2 4.49Å; L36-F104 HydrophobicContact CD1-CE2 4.27Å; L36-F104 HydrophobicContact CD2-CE2 3.73Å; L36-F104 HydrophobicContact CD2-CZ 4.05Å; L36-F104 HydrophobicContact CG-CE2 3.9Å; L36-F104 HydrophobicContact CG-CZ 4.35Å; L36-V135 HydrophobicContact CD1-CG1 3.85Å; L36-V135 HydrophobicContact CG-CG1 4.01Å; L36-I136 PolarHBondContact N-O 2.82Å; L36-A138 HydrophobicContact CB-CB 4.01Å; L36-A138 HydrophobicContact CD1-CB 4.3Å; L36-V147 HydrophobicContact CD1-CB 4.31Å; L36-V147 HydrophobicContact CD1-CG1 3.64Å; L36-V147 HydrophobicContact CD1-CG2 3.98Å; L36-Y161 PolarHBondContact O-OH 3.43Å
37	F	95.6	Very high	89.3	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	146.6	-178.7	-61.7	-84.3	0	0	0	111.6	V39 R60 L61 M64 I87 L88 D89 T90 Y161 V391	F37-V39 VanDerWaalsContact C-N 3.27Å; F37-V39 HydrophobicContact CB-CG2 4.31Å; F37-V39 PolarHBondContact O-N 2.89Å; F37-V39 VanDerWaalsContact O-N 3.09Å; F37-R60 HydrophobicContact CD1-CB 3.69Å; F37-R60 HydrophobicContact CE1-CB 3.96Å; F37-R60 VanDerWaalsContact CE1-O 3.31Å; F37-R60 WeakPolarHBondContact CE1-O 3.32Å; F37-L61 HydrophobicContact CB-CB 4.39Å; F37-L61 HydrophobicContact CD2-CB 4.23Å; F37-L61 HydrophobicContact CD2-CG 4.43Å; F37-L61 HydrophobicContact CG-CB 4.12Å; F37-M64 HydrophobicContact CE2-CB 4.16Å; F37-M64 HydrophobicContact CE2-SD 3.54Å; F37-M64 VanDerWaalsContact CE2-SD 3.54Å; F37-M64 HydrophobicContact CZ-CB 3.71Å; F37-M64 HydrophobicContact CZ-CG 4.32Å; F37-M64 HydrophobicContact CZ-SD 3.72Å; F37-I87 HydrophobicContact CD2-CG2 3.57Å; F37-I87 HydrophobicContact CE2-CD1 4.31Å; F37-I87 HydrophobicContact CE2-CG1 4.47Å; F37-I87 HydrophobicContact CE2-CG2 4.09Å; F37-L88 PolarHBondContact N-O 3.17Å; F37-D89 WeakPolarHBondContact O-CA 3.27Å; F37-T90 PolarHBondContact O-N 3.5Å; F37-T90 PolarHBondContact O-OG1 3.16Å; F37-Y161 AromaticContact CD1-CE1 3.99Å; F37-Y161 HydrophobicContact CD1-CE1 3.99Å; F37-Y161 AromaticContact CD1-CZ 3.76Å; F37-Y161 WeakPolarHBondContact CD1-OH 3.43Å; F37-Y161 HydrophobicContact CE1-CD1 4.43Å; F37-Y161 AromaticContact CE1-CE1 3.6Å; F37-Y161 HydrophobicContact CE1-CE1 3.6Å; F37-Y161 AromaticContact CE1-CZ 3.78Å; F37-Y161 HydrophobicContact CZ-CE1 4.3Å; F37-V391 HydrophobicContact CE1-CG1 3.96Å; F37-V391 HydrophobicContact CE1-CG2 4.23Å; F37-V391 HydrophobicContact CZ-CG1 4.11Å
38	P	93.1	Very high	88.6	Confident	6 Å²	6	41.6 Å²	41.6	4%	0.039	27%	0.265	C	S	.	.			trans	-83.9	72.6	173	34.7	-33.5	0	0	0	109.6	H40 G57 T90	P38-H40 VanDerWaalsContact C-N 3.27Å; P38-H40 PolarHBondContact O-N 3.25Å; P38-G57 WeakPolarHBondContact O-CA 3.22Å; P38-T90 WeakPolarHBondContact CA-OG1 3.32Å
39	V	93.3	Very high	88.5	Confident	0 Å²	0	36 Å²	36	0%	0	24%	0.242	C	C	.	.			trans	-63.1	-40.4	-179.3	-176.7	0	0	0	0	109.5	F37 I52 K53 I58 L61 D89 W343	F37-V39 VanDerWaalsContact C-N 3.27Å; F37-V39 HydrophobicContact CB-CG2 4.31Å; F37-V39 PolarHBondContact O-N 2.89Å; F37-V39 VanDerWaalsContact O-N 3.09Å; V39-I52 HydrophobicContact CG1-CD1 4.36Å; V39-I52 HydrophobicContact CG1-CG1 4.23Å; V39-K53 PolarHBondContact O-N 3Å; V39-I58 HydrophobicContact CG1-CD1 3.87Å; V39-L61 HydrophobicContact CG2-CD1 3.86Å; V39-D89 HydrophobicContact CB-CB 4.22Å; V39-D89 HydrophobicContact CG2-CB 4.22Å; V39-D89 PolarHBondContact N-OD1 2.78Å; V39-W343 HydrophobicContact CG1-CB 3.86Å; V39-W343 HydrophobicContact CG1-CD2 3.93Å; V39-W343 HydrophobicContact CG1-CE3 4.38Å; V39-W343 HydrophobicContact CG1-CG 3.7Å; V39-W343 HydrophobicContact CG2-CD2 4.29Å; V39-W343 HydrophobicContact CG2-CE3 4.07Å; V39-W343 HydrophobicContact CG2-CZ3 4.24Å
40	H	91	Very high	88.3	Confident	13 Å²	13	35.9 Å²	35.9	6%	0.06	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	156.1	173.6	-62.3	88.9	0	0	0	113.4	P38 C49 G50 D89 C91 S92 W343 E346	P38-H40 VanDerWaalsContact C-N 3.27Å; P38-H40 PolarHBondContact O-N 3.25Å; H40-C49 HydrophobicContact CB-CB 3.88Å; H40-G50 PolarHBondContact CD2-O 3.41Å; H40-G50 VanDerWaalsContact CD2-O 3.28Å; H40-D89 IonicContact CE1-OD2 3.29Å; H40-D89 IonicContact CG-OD2 3.97Å; H40-D89 PolarHBondContact N-OD1 3.02Å; H40-D89 PolarHBondContact N-OD2 3.15Å; H40-D89 IonicContact ND1-OD2 2.71Å; H40-D89 PolarHBondContact ND1-OD2 2.71Å; H40-C91 CarbonylContact O-C 3.57Å; H40-C91 WeakPolarHBondContact O-CA 3.29Å; H40-S92 PolarHBondContact O-OG 2.77Å; H40-S92 VanDerWaalsContact O-OG 3.09Å; H40-W343 AromaticContact CE1-CD1 3.71Å; H40-W343 AromaticContact CE1-NE1 3.95Å; H40-E346 IonicContact CD2-OE1 3.18Å; H40-E346 IonicContact CE1-OE2 3.77Å; H40-E346 IonicContact NE2-OE1 2.71Å; H40-E346 PolarHBondContact NE2-OE1 2.92Å; H40-E346 IonicContact NE2-OE2 3.86Å; H40-E346 PolarHBondContact NE2-OE2 2.76Å
41	S	85	Confident	88.1	Confident	32 Å²	32	38.6 Å²	38.6	22%	0.224	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.2	168.6	165.2	61.7	0	0	0	0	111.4	G43 G50 E51 C91	S41-G43 PolarHBondContact O-N 3.27Å; S41-G50 PolarHBondContact O-N 2.99Å; S41-G50 WeakPolarHBondContact OG-CA 3.11Å; S41-E51 WeakPolarHBondContact CB-O 3.38Å; S41-E51 PolarHBondContact N-O 2.71Å; S41-E51 PolarHBondContact OG-N 3Å; S41-E51 PolarHBondContact OG-O 3.18Å; S41-C91 CarbonylContact C-O 3.57Å
42	R	82.2	Confident	87.9	Confident	112 Å²	112	39 Å²	39	42%	0.423	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	126.9	176.6	-179.1	174	172.7	-164.2	-9.8	109.1	C91 E241	R42-C91 WeakPolarHBondContact CA-O 3.24Å; R42-C91 PolarHBondContact N-O 2.81Å; R42-E241 IonicContact CZ-OE1 3.04Å; R42-E241 IonicContact NH1-OE1 3.13Å; R42-E241 IonicContact NH2-OE1 2.74Å; R42-E241 PolarHBondContact NH2-OE1 3.2Å
43	G	81.3	Confident	87.6	Confident	7 Å²	7	41.3 Å²	41.3	7%	0.072	26%	0.261	C	S	.	.	P	Polyproline II helix	trans	-71.3	159	178.1	0	0	0	0	0	113.4	S41 V47 P48	S41-G43 PolarHBondContact O-N 3.27Å; G43-V47 CarbonylContact C-O 3.59Å; G43-V47 WeakPolarHBondContact CA-O 3.42Å; G43-P48 PolarHBondContact N-O 3.41Å
44	P	78.9	Confident	87.2	Confident	94 Å²	94	46 Å²	46	61%	0.61	28%	0.279	S	S	*	.	S	Bend	trans	-62.5	168	170.8	28.1	-34.4	0	0	0	111.4	G46 V47	P44-G46 PolarHBondContact O-N 2.97Å; P44-G46 VanDerWaalsContact O-N 3.15Å; P44-V47 HydrophobicContact CG-CB 4.47Å; P44-V47 HydrophobicContact CG-CG2 4.48Å; P44-V47 PolarHBondContact O-N 3.21Å; P44-V47 VanDerWaalsContact O-O 3.09Å
45	A	73.8	Confident	86.6	Confident	109 Å²	109	50.6 Å²	50.6	90%	0.901	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.3	123.3	-178.3	0	0	0	0	0	111.9
46	G	76.3	Confident	86.1	Confident	80 Å²	80	53.1 Å²	53.1	83%	0.825	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.6	-14.3	-178	0	0	0	0	0	115.6	P44	P44-G46 PolarHBondContact O-N 2.97Å; P44-G46 VanDerWaalsContact O-N 3.15Å
47	V	84.1	Confident	85.8	Confident	73 Å²	73	53.1 Å²	53.1	44%	0.442	31%	0.311	S	S	.	.			trans	-115.2	128	176.2	-171.3	0	0	0	0	109.2	G43 P44 C49	G43-V47 CarbonylContact C-O 3.59Å; G43-V47 WeakPolarHBondContact CA-O 3.42Å; P44-V47 HydrophobicContact CG-CB 4.47Å; P44-V47 HydrophobicContact CG-CG2 4.48Å; P44-V47 PolarHBondContact O-N 3.21Å; P44-V47 VanDerWaalsContact O-O 3.09Å; V47-C49 VanDerWaalsContact CG1-O 3.27Å; V47-C49 WeakPolarHBondContact CG1-O 3.37Å
48	P	78.6	Confident	85.7	Confident	58 Å²	58	53.1 Å²	53.1	38%	0.377	31%	0.311	S	S	.	.	S	Bend	trans	-67.2	-40.7	-175.6	24.3	-32.2	0	0	0	112.6	G43 Y96	G43-P48 PolarHBondContact N-O 3.41Å; P48-Y96 HydrophobicContact CB-CD2 3.62Å; P48-Y96 HydrophobicContact CB-CE2 3.86Å; P48-Y96 HydrophobicContact CB-CG 4.22Å; P48-Y96 HydrophobicContact CG-CD2 4.48Å; P48-Y96 HydrophobicContact CG-CE2 4.28Å
49	C	88.1	Confident	85.8	Confident	29 Å²	29	53.2 Å²	53.2	20%	0.196	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	144.2	-170.4	-48	0	0	0	0	110.7	H40 V47 C91	H40-C49 HydrophobicContact CB-CB 3.88Å; V47-C49 VanDerWaalsContact CG1-O 3.27Å; V47-C49 WeakPolarHBondContact CG1-O 3.37Å; C49-C91 HydrophobicContact CB-CB 3.76Å; C49-C91 WeakPolarHBondContact CB-SG 3.35Å; C49-C91 WeakPolarHBondContact SG-CB 3.28Å; C49-C91 CovalentContact SG-SG 2.02Å; C49-C91 PolarHBondContact SG-SG 3.27Å
50	G	87.8	Confident	85.8	Confident	25 Å²	25	53.6 Å²	53.6	26%	0.258	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	-146.9	176.4	0	0	0	0	0	111.6	H40 S41	H40-G50 PolarHBondContact CD2-O 3.41Å; H40-G50 VanDerWaalsContact CD2-O 3.28Å; S41-G50 PolarHBondContact O-N 2.99Å; S41-G50 WeakPolarHBondContact OG-CA 3.11Å
51	E	87.9	Confident	86.1	Confident	156 Å²	156	53 Å²	53	73%	0.729	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-65.3	152.6	177.3	-60.4	179.7	166.2	0	0	112.5	S41	S41-E51 WeakPolarHBondContact CB-O 3.38Å; S41-E51 PolarHBondContact N-O 2.71Å; S41-E51 PolarHBondContact OG-N 3Å; S41-E51 PolarHBondContact OG-O 3.18Å
52	I	90.3	Very high	86.6	Confident	14 Å²	14	51.5 Å²	51.5	7%	0.072	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	140.3	178.9	-163.9	164.9	0	0	0	111.8	V39 I58 W343 E346 F347 D350	V39-I52 HydrophobicContact CG1-CD1 4.36Å; V39-I52 HydrophobicContact CG1-CG1 4.23Å; I52-I58 HydrophobicContact CD1-CD1 4.08Å; I52-I58 HydrophobicContact CD1-CG1 4.08Å; I52-I58 HydrophobicContact CG1-CG1 4.26Å; I52-W343 HydrophobicContact CD1-CB 4.37Å; I52-E346 HydrophobicContact CB-CG 4.3Å; I52-E346 HydrophobicContact CD1-CB 3.98Å; I52-E346 HydrophobicContact CD1-CG 3.83Å; I52-E346 HydrophobicContact CG2-CG 4.37Å; I52-F347 HydrophobicContact CD1-CB 3.94Å; I52-D350 HydrophobicContact CG2-CB 3.67Å
53	K	87.9	Confident	87.3	Confident	60 Å²	60	46.1 Å²	46.1	26%	0.261	28%	0.279	S	S	.	.			trans	-98.4	101.7	177.2	-74.3	-179	164.5	178.8	0	110	V39 K56 G57 I58 S92	V39-K53 PolarHBondContact O-N 3Å; K53-K56 HydrophobicContact CD-CB 4.48Å; K53-G57 VanDerWaalsContact O-CA 3.23Å; K53-G57 WeakPolarHBondContact O-CA 3.33Å; K53-G57 PolarHBondContact O-N 2.96Å; K53-G57 VanDerWaalsContact O-N 3.08Å; K53-I58 PolarHBondContact O-N 2.71Å; K53-S92 PolarHBondContact NZ-OG 2.81Å
54	R	87.1	Confident	88	Confident	97 Å²	97	45.8 Å²	45.8	37%	0.366	28%	0.276	S	S	.	.	I	π-helix	trans	-53.8	-68.4	178.4	-67.1	-174.3	-86	151.5	5.8	112.3	I58 H59 F347 D350 D351	R54-I58 WeakPolarHBondContact O-CB 3.38Å; R54-I58 PolarHBondContact O-N 2.98Å; R54-H59 PolarHBondContact O-CD2 3.47Å; R54-H59 PolarHBondContact O-N 3.45Å; R54-F347 HydrophobicContact CB-CD2 4.24Å; R54-F347 HydrophobicContact CB-CE2 3.9Å; R54-F347 HydrophobicContact CG-CD2 3.89Å; R54-F347 HydrophobicContact CG-CE2 3.83Å; R54-D350 WeakPolarHBondContact CD-OD2 3.12Å; R54-D350 WeakPolarHBondContact CG-OD2 3.18Å; R54-D350 IonicContact CZ-OD2 3.22Å; R54-D350 IonicContact NE-OD2 2.87Å; R54-D350 PolarHBondContact NE-OD2 2.02Å; R54-D351 VanDerWaalsContact CD-OD1 3.28Å; R54-D351 WeakPolarHBondContact CD-OD1 3.09Å; R54-D351 IonicContact NH1-OD1 2.73Å; R54-D351 PolarHBondContact NH1-OD1 3.3Å
55	E	84.1	Confident	88.8	Confident	97 Å²	97	41.4 Å²	41.4	45%	0.453	25%	0.247	S	C	.	.	I	π-helix	trans	-72.4	-56.1	-176.4	-65.9	167.1	-159.9	0	0	112.5	G57 H59 E385	E55-G57 VanDerWaalsContact C-N 3.32Å; E55-G57 PolarHBondContact O-N 3.5Å; E55-H59 VanDerWaalsContact O-CB 3.27Å; E55-H59 WeakPolarHBondContact O-CB 3.46Å; E55-E385 HydrophobicContact CB-CB 4.14Å; E55-E385 HydrophobicContact CB-CG 4.01Å
56	K	84.6	Confident	89.9	Confident	53 Å²	53	36.8 Å²	36.8	23%	0.23	21%	0.207	C	C	.	.	I	π-helix	trans	-76.2	-18.4	-170.1	-60.3	179.1	-166.6	174.9	0	114.5	K53 R60 E269	K53-K56 HydrophobicContact CD-CB 4.48Å; K56-R60 VanDerWaalsContact O-CD 3.23Å; K56-R60 WeakPolarHBondContact O-CD 3.33Å; K56-R60 PolarHBondContact O-NH1 2.68Å; K56-E269 WeakPolarHBondContact CE-OE1 3.17Å; K56-E269 WeakPolarHBondContact CE-OE2 3.5Å; K56-E269 IonicContact NZ-OE1 3.16Å; K56-E269 PolarHBondContact NZ-OE1 3.29Å; K56-E269 IonicContact NZ-OE2 2.81Å; K56-E269 PolarHBondContact NZ-OE2 3.32Å
57	G	90.8	Very high	90.7	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.167	C	C	.	.	I	π-helix	trans	-102.6	-71	-179.9	0	0	0	0	0	110.4	P38 K53 E55 R60 L61	P38-G57 WeakPolarHBondContact O-CA 3.22Å; K53-G57 VanDerWaalsContact O-CA 3.23Å; K53-G57 WeakPolarHBondContact O-CA 3.33Å; K53-G57 PolarHBondContact O-N 2.96Å; K53-G57 VanDerWaalsContact O-N 3.08Å; E55-G57 VanDerWaalsContact C-N 3.32Å; E55-G57 PolarHBondContact O-N 3.5Å; G57-R60 PolarHBondContact O-N 2.77Å; G57-L61 WeakPolarHBondContact O-CB 3.41Å; G57-L61 PolarHBondContact O-N 3.45Å
58	I	93.9	Very high	91.3	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	15%	0.147	C	C	.	.	I	π-helix	trans	-70.1	-43.2	-169.3	-61.9	-69.2	0	0	0	112.7	V39 I52 K53 R54 R60 L61 E62 F330 W343 F347	V39-I58 HydrophobicContact CG1-CD1 3.87Å; I52-I58 HydrophobicContact CD1-CD1 4.08Å; I52-I58 HydrophobicContact CD1-CG1 4.08Å; I52-I58 HydrophobicContact CG1-CG1 4.26Å; K53-I58 PolarHBondContact O-N 2.71Å; R54-I58 WeakPolarHBondContact O-CB 3.38Å; R54-I58 PolarHBondContact O-N 2.98Å; I58-R60 VanDerWaalsContact C-N 3.25Å; I58-R60 PolarHBondContact O-N 3.5Å; I58-L61 PolarHBondContact O-N 2.74Å; I58-E62 HydrophobicContact CG2-CG 4.14Å; I58-E62 WeakPolarHBondContact O-CB 3.34Å; I58-E62 WeakPolarHBondContact O-CG 3.08Å; I58-E62 PolarHBondContact O-N 3.2Å; I58-F330 HydrophobicContact CG2-CE2 4.15Å; I58-F330 HydrophobicContact CG2-CZ 4.3Å; I58-W343 HydrophobicContact CD1-CB 3.93Å; I58-F347 HydrophobicContact CB-CD2 4.06Å; I58-F347 HydrophobicContact CB-CG 4.41Å; I58-F347 HydrophobicContact CD1-CB 4.4Å; I58-F347 HydrophobicContact CG1-CB 4.04Å; I58-F347 HydrophobicContact CG1-CD2 4.02Å; I58-F347 HydrophobicContact CG1-CG 4.21Å; I58-F347 HydrophobicContact CG2-CB 4.46Å; I58-F347 HydrophobicContact CG2-CD1 4.35Å; I58-F347 HydrophobicContact CG2-CD2 4.03Å; I58-F347 HydrophobicContact CG2-CE2 4.41Å; I58-F347 HydrophobicContact CG2-CG 4.01Å
59	H	94.1	Very high	92.1	Very high	9 Å²	9	29.2 Å²	29.2	4%	0.042	14%	0.141	C	C	.	.	I	π-helix	trans	-59.8	-40.3	177.3	-61.3	-175.7	0	0	0	111.1	R54 E55 A63 F326 F330 Y382 E383 E385 V388	R54-H59 PolarHBondContact O-CD2 3.47Å; R54-H59 PolarHBondContact O-N 3.45Å; E55-H59 VanDerWaalsContact O-CB 3.27Å; E55-H59 WeakPolarHBondContact O-CB 3.46Å; H59-A63 VanDerWaalsContact O-CB 3.29Å; H59-A63 WeakPolarHBondContact O-CB 3.37Å; H59-A63 PolarHBondContact O-N 3.28Å; H59-F326 HydrophobicContact CB-CE1 4.47Å; H59-F326 HydrophobicContact CB-CZ 4.47Å; H59-F326 VanDerWaalsContact O-CZ 3.29Å; H59-F326 WeakPolarHBondContact O-CZ 3.33Å; H59-F330 AromaticContact CD2-CE1 3.67Å; H59-F330 AromaticContact CD2-CE2 3.75Å; H59-F330 AromaticContact CD2-CZ 3.26Å; H59-F330 WeakPolarHBondContact CD2-CZ 3.46Å; H59-F330 AromaticContact NE2-CE1 3.49Å; H59-F330 WeakPolarHBondContact NE2-CE1 3.33Å; H59-F330 AromaticContact NE2-CZ 3.55Å; H59-Y382 AromaticContact CE1-CD2 3.94Å; H59-Y382 AromaticContact CE1-CE2 3.64Å; H59-Y382 AromaticContact NE2-CE2 3.89Å; H59-E383 PolarHBondContact CE1-O 3.09Å; H59-E385 HydrophobicContact CB-CB 4.22Å; H59-V388 HydrophobicContact CB-CG2 4.06Å
60	R	95.1	Very high	92.4	Very high	8 Å²	8	31.3 Å²	31.3	3%	0.03	15%	0.148	C	C	.	.	H	α-helix	trans	-70.4	-40.9	179.9	-61.3	-168.5	-170.3	154.8	-10.5	112.9	F37 K56 G57 I58 A63 M64 S139 E385 V391	F37-R60 HydrophobicContact CD1-CB 3.69Å; F37-R60 HydrophobicContact CE1-CB 3.96Å; F37-R60 VanDerWaalsContact CE1-O 3.31Å; F37-R60 WeakPolarHBondContact CE1-O 3.32Å; K56-R60 VanDerWaalsContact O-CD 3.23Å; K56-R60 WeakPolarHBondContact O-CD 3.33Å; K56-R60 PolarHBondContact O-NH1 2.68Å; G57-R60 PolarHBondContact O-N 2.77Å; I58-R60 VanDerWaalsContact C-N 3.25Å; I58-R60 PolarHBondContact O-N 3.5Å; R60-A63 WeakPolarHBondContact O-CB 3.06Å; R60-A63 PolarHBondContact O-N 3.46Å; R60-M64 PolarHBondContact O-N 2.89Å; R60-S139 PolarHBondContact NH1-OG 2.81Å; R60-E385 IonicContact CZ-OE1 3.71Å; R60-E385 IonicContact CZ-OE2 2.7Å; R60-E385 IonicContact NE-OE1 3.99Å; R60-E385 IonicContact NE-OE2 3.47Å; R60-E385 PolarHBondContact NE-OE2 3.49Å; R60-E385 IonicContact NH2-OE1 2.79Å; R60-E385 PolarHBondContact NH2-OE1 3.24Å; R60-E385 IonicContact NH2-OE2 3.28Å; R60-V391 HydrophobicContact CB-CG2 4.02Å; R60-V391 HydrophobicContact CG-CG2 4.26Å
61	L	95.8	Very high	92.7	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-62.1	-49.1	174.6	179.7	160.1	0	0	0	110.5	L25 F37 V39 G57 I58 A63 M64 L65 I87 W343	L25-L61 HydrophobicContact CD1-CD2 4.05Å; F37-L61 HydrophobicContact CB-CB 4.39Å; F37-L61 HydrophobicContact CD2-CB 4.23Å; F37-L61 HydrophobicContact CD2-CG 4.43Å; F37-L61 HydrophobicContact CG-CB 4.12Å; V39-L61 HydrophobicContact CG2-CD1 3.86Å; G57-L61 WeakPolarHBondContact O-CB 3.41Å; G57-L61 PolarHBondContact O-N 3.45Å; I58-L61 PolarHBondContact O-N 2.74Å; L61-A63 PolarHBondContact O-N 3.06Å; L61-M64 WeakPolarHBondContact O-CB 3.33Å; L61-M64 PolarHBondContact O-N 3.32Å; L61-M64 VanDerWaalsContact O-N 3.15Å; L61-L65 HydrophobicContact CD2-CD1 3.7Å; L61-L65 HydrophobicContact CD2-CG 4.18Å; L61-L65 PolarHBondContact O-N 3.22Å; L61-I87 HydrophobicContact CD1-CG2 3.88Å; L61-I87 HydrophobicContact CD2-CD1 4.45Å; L61-I87 HydrophobicContact CG-CD1 4.12Å; L61-I87 HydrophobicContact CG-CG2 4.17Å; L61-W343 HydrophobicContact CD1-CE3 3.55Å; L61-W343 HydrophobicContact CD1-CZ3 3.57Å
62	E	95.9	Very high	93.1	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-29.7	177.8	-73.6	-66.7	159.1	0	0	112	I58 L65 Y66 F326 Y329 F330 N338 N341	I58-E62 HydrophobicContact CG2-CG 4.14Å; I58-E62 WeakPolarHBondContact O-CB 3.34Å; I58-E62 WeakPolarHBondContact O-CG 3.08Å; I58-E62 PolarHBondContact O-N 3.2Å; E62-L65 PolarHBondContact O-N 3.17Å; E62-Y66 WeakPolarHBondContact O-CB 3.2Å; E62-Y66 PolarHBondContact O-N 3.43Å; E62-F326 HydrophobicContact CB-CE2 4.19Å; E62-F326 HydrophobicContact CB-CZ 4.2Å; E62-Y329 HydrophobicContact CB-CE1 4.21Å; E62-Y329 PolarHBondContact OE2-OH 3.17Å; E62-F330 HydrophobicContact CB-CD2 3.99Å; E62-F330 HydrophobicContact CB-CE2 4.07Å; E62-F330 HydrophobicContact CG-CD2 4.19Å; E62-F330 HydrophobicContact CG-CE2 3.91Å; E62-N338 PolarHBondContact OE1-ND2 3.36Å; E62-N341 VanDerWaalsContact OE1-CB 3.28Å; E62-N341 WeakPolarHBondContact OE1-CB 3.49Å; E62-N341 PolarHBondContact OE1-ND2 3.39Å
63	A	96.1	Very high	93.3	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.3	-38	174	0	0	0	0	0	112.4	H59 R60 L61 A67 F326 V388 V391 I392	H59-A63 VanDerWaalsContact O-CB 3.29Å; H59-A63 WeakPolarHBondContact O-CB 3.37Å; H59-A63 PolarHBondContact O-N 3.28Å; R60-A63 WeakPolarHBondContact O-CB 3.06Å; R60-A63 PolarHBondContact O-N 3.46Å; L61-A63 PolarHBondContact O-N 3.06Å; A63-A67 WeakPolarHBondContact O-CB 3.16Å; A63-A67 PolarHBondContact O-N 3.17Å; A63-F326 VanDerWaalsContact CA-CE2 3.42Å; A63-F326 HydrophobicContact CB-CD2 4.29Å; A63-F326 HydrophobicContact CB-CE2 3.86Å; A63-F326 HydrophobicContact CB-CZ 4.22Å; A63-V388 HydrophobicContact CB-CB 4.41Å; A63-V388 HydrophobicContact CB-CG1 3.9Å; A63-V388 HydrophobicContact CB-CG2 4.3Å; A63-V391 HydrophobicContact CB-CB 4.16Å; A63-V391 HydrophobicContact CB-CG1 4.1Å; A63-I392 HydrophobicContact CB-CG1 4.21Å
64	M	96.8	Very high	93.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.3	-43.6	172.3	179.1	175.1	-177.6	0	0	111.3	L33 F37 R60 L61 A67 L68 A85 I87 I136 V391 V395	L33-M64 HydrophobicContact CB-CE 3.98Å; F37-M64 HydrophobicContact CE2-CB 4.16Å; F37-M64 HydrophobicContact CE2-SD 3.54Å; F37-M64 VanDerWaalsContact CE2-SD 3.54Å; F37-M64 HydrophobicContact CZ-CB 3.71Å; F37-M64 HydrophobicContact CZ-CG 4.32Å; F37-M64 HydrophobicContact CZ-SD 3.72Å; R60-M64 PolarHBondContact O-N 2.89Å; L61-M64 WeakPolarHBondContact O-CB 3.33Å; L61-M64 PolarHBondContact O-N 3.32Å; L61-M64 VanDerWaalsContact O-N 3.15Å; M64-A67 PolarHBondContact O-N 3.05Å; M64-L68 HydrophobicContact CE-CD1 4.35Å; M64-L68 HydrophobicContact CG-CD1 4.14Å; M64-L68 VanDerWaalsContact O-CG 3.28Å; M64-L68 WeakPolarHBondContact O-CG 3.26Å; M64-L68 PolarHBondContact O-N 3.29Å; M64-A85 HydrophobicContact CE-CB 3.89Å; M64-I87 HydrophobicContact SD-CD1 4.02Å; M64-I87 HydrophobicContact SD-CG1 4.14Å; M64-I136 HydrophobicContact CE-CG1 4.31Å; M64-I136 HydrophobicContact SD-CB 4.44Å; M64-V391 HydrophobicContact CB-CG1 4.06Å; M64-V395 HydrophobicContact CB-CG2 4.3Å; M64-V395 HydrophobicContact CG-CG2 3.86Å
65	L	96.3	Very high	93.6	Very high	1 Å²	1	29.4 Å²	29.4	1%	0.005	16%	0.16	C	C	.	.	H	α-helix	trans	-64.3	-41.3	177.9	-61.8	-179.1	0	0	0	112	L25 I27 L61 E62 L68 D69 I87 R340	L25-L65 HydrophobicContact CD1-CD1 4.26Å; L25-L65 HydrophobicContact CD2-CD2 4.23Å; I27-L65 HydrophobicContact CD1-CD2 4.33Å; I27-L65 HydrophobicContact CG1-CD2 3.89Å; L61-L65 HydrophobicContact CD2-CD1 3.7Å; L61-L65 HydrophobicContact CD2-CG 4.18Å; L61-L65 PolarHBondContact O-N 3.22Å; E62-L65 PolarHBondContact O-N 3.17Å; L65-L68 PolarHBondContact O-N 3.14Å; L65-D69 PolarHBondContact O-N 3.42Å; L65-I87 HydrophobicContact CD2-CD1 3.89Å; L65-I87 HydrophobicContact CG-CD1 4.35Å; L65-R340 HydrophobicContact CD1-CG 4.37Å
66	Y	95.5	Very high	93.9	Very high	13 Å²	13	31.2 Å²	31.2	5%	0.051	17%	0.173	C	C	.	.	H	α-helix	trans	-59.5	-48.5	173.1	170.4	-109	0	0	0	111.5	E62 L68 D69 Q70 F326 Y329 I392	E62-Y66 WeakPolarHBondContact O-CB 3.2Å; E62-Y66 PolarHBondContact O-N 3.43Å; Y66-L68 VanDerWaalsContact C-N 3.33Å; Y66-L68 PolarHBondContact O-N 2.86Å; Y66-D69 PolarHBondContact O-N 2.83Å; Y66-Q70 HydrophobicContact CD2-CG 4.2Å; Y66-Q70 HydrophobicContact CE1-CG 4.11Å; Y66-Q70 HydrophobicContact CE2-CG 3.75Å; Y66-Q70 WeakPolarHBondContact O-CG 3.32Å; Y66-Q70 PolarHBondContact O-N 3.47Å; Y66-F326 HydrophobicContact CD1-CB 4.23Å; Y66-F326 AromaticContact CD1-CD2 3.91Å; Y66-F326 HydrophobicContact CD1-CD2 3.91Å; Y66-F326 HydrophobicContact CE1-CB 4.19Å; Y66-F326 AromaticContact CG-CD2 3.96Å; Y66-F326 HydrophobicContact CG-CD2 3.96Å; Y66-Y329 HydrophobicContact CD2-CD1 4.17Å; Y66-Y329 AromaticContact CD2-CD2 3.48Å; Y66-Y329 HydrophobicContact CD2-CD2 3.48Å; Y66-Y329 VanDerWaalsContact CD2-CD2 3.48Å; Y66-Y329 HydrophobicContact CD2-CE2 4.15Å; Y66-Y329 AromaticContact CD2-CG 3.5Å; Y66-Y329 HydrophobicContact CD2-CG 3.5Å; Y66-Y329 HydrophobicContact CE2-CD2 4.32Å; Y66-Y329 HydrophobicContact CE2-CG 4.25Å; Y66-Y329 HydrophobicContact CG-CD1 4.33Å; Y66-Y329 HydrophobicContact CG-CD2 4.26Å; Y66-Y329 HydrophobicContact CG-CG 4.11Å; Y66-I392 HydrophobicContact CD1-CD1 3.94Å; Y66-I392 HydrophobicContact CD1-CG1 4.48Å; Y66-I392 HydrophobicContact CE1-CD1 4.13Å
67	A	95.2	Very high	94.2	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-60	-43.2	178.8	0	0	0	0	0	111.9	A63 M64 Q70 I71 I392 V395 Y396	A63-A67 WeakPolarHBondContact O-CB 3.16Å; A63-A67 PolarHBondContact O-N 3.17Å; M64-A67 PolarHBondContact O-N 3.05Å; A67-Q70 PolarHBondContact O-N 2.9Å; A67-I71 WeakPolarHBondContact O-CD1 3.49Å; A67-I71 VanDerWaalsContact O-CG1 3.26Å; A67-I71 WeakPolarHBondContact O-CG1 3.32Å; A67-I71 PolarHBondContact O-N 3.38Å; A67-I392 HydrophobicContact CB-CG1 4.38Å; A67-I392 HydrophobicContact CB-CG2 4.28Å; A67-V395 HydrophobicContact CB-CB 3.92Å; A67-V395 HydrophobicContact CB-CG1 3.87Å; A67-V395 HydrophobicContact CB-CG2 4.32Å; A67-Y396 HydrophobicContact CB-CD2 4.49Å; A67-Y396 HydrophobicContact CB-CE2 4.3Å
68	L	96.2	Very high	94.3	Very high	4 Å²	4	29.2 Å²	29.2	2%	0.021	17%	0.165	C	C	.	.	H	α-helix	trans	-61.6	-42.9	175.6	-68.9	166.5	0	0	0	112.1	L33 M64 L65 Y66 Q70 I71 N72 L83 A85 V395	L33-L68 HydrophobicContact CD1-CD2 4.39Å; M64-L68 HydrophobicContact CE-CD1 4.35Å; M64-L68 HydrophobicContact CG-CD1 4.14Å; M64-L68 VanDerWaalsContact O-CG 3.28Å; M64-L68 WeakPolarHBondContact O-CG 3.26Å; M64-L68 PolarHBondContact O-N 3.29Å; L65-L68 PolarHBondContact O-N 3.14Å; Y66-L68 VanDerWaalsContact C-N 3.33Å; Y66-L68 PolarHBondContact O-N 2.86Å; L68-Q70 VanDerWaalsContact C-N 3.31Å; L68-Q70 PolarHBondContact O-N 2.82Å; L68-I71 PolarHBondContact O-N 3.17Å; L68-N72 VanDerWaalsContact O-CB 3.28Å; L68-N72 WeakPolarHBondContact O-CB 3.41Å; L68-N72 PolarHBondContact O-N 3.45Å; L68-N72 PolarHBondContact O-ND2 3.37Å; L68-L83 HydrophobicContact CD2-CB 3.66Å; L68-L83 HydrophobicContact CD2-CD1 4.37Å; L68-A85 HydrophobicContact CD1-CB 3.55Å; L68-V395 HydrophobicContact CD2-CG1 4.18Å; L68-V395 HydrophobicContact CG-CG1 4.41Å
69	D	95	Very high	94.1	Very high	47 Å²	47	31.6 Å²	31.6	25%	0.251	18%	0.18	S	C	.	.	H	α-helix	trans	-62.2	-40	176.6	-66.2	-21.2	0	0	0	111.6	L65 Y66 S73 R340	L65-D69 PolarHBondContact O-N 3.42Å; Y66-D69 PolarHBondContact O-N 2.83Å; D69-S73 WeakPolarHBondContact O-CB 3.38Å; D69-S73 PolarHBondContact O-N 2.84Å; D69-S73 PolarHBondContact O-OG 3.3Å; D69-R340 VanDerWaalsContact CG-NH1 3.27Å; D69-R340 IonicContact OD1-CZ 3.96Å; D69-R340 IonicContact OD1-NH1 2.84Å; D69-R340 PolarHBondContact OD1-NH1 2.7Å; D69-R340 IonicContact OD1-NH2 3.7Å; D69-R340 IonicContact OD2-CZ 3.32Å; D69-R340 VanDerWaalsContact OD2-CZ 3.28Å; D69-R340 IonicContact OD2-NH1 3.85Å; D69-R340 PolarHBondContact OD2-NH1 2.78Å; D69-R340 IonicContact OD2-NH2 3.29Å; D69-R340 PolarHBondContact OD2-NH2 3.33Å
70	Q	94.1	Very high	93.9	Very high	73 Å²	73	36.9 Å²	36.9	34%	0.341	21%	0.209	S	C	.	.	H	α-helix	trans	-66.2	-48.3	177	-65.1	-53.3	-86.2	0	0	111.4	Y66 A67 L68 S73 D74 Y396	Y66-Q70 HydrophobicContact CD2-CG 4.2Å; Y66-Q70 HydrophobicContact CE1-CG 4.11Å; Y66-Q70 HydrophobicContact CE2-CG 3.75Å; Y66-Q70 WeakPolarHBondContact O-CG 3.32Å; Y66-Q70 PolarHBondContact O-N 3.47Å; A67-Q70 PolarHBondContact O-N 2.9Å; L68-Q70 VanDerWaalsContact C-N 3.31Å; L68-Q70 PolarHBondContact O-N 2.82Å; Q70-S73 PolarHBondContact O-N 3.46Å; Q70-S73 VanDerWaalsContact O-N 3.16Å; Q70-D74 PolarHBondContact O-N 2.78Å; Q70-D74 VanDerWaalsContact O-N 3.11Å; Q70-Y396 WeakPolarHBondContact CB-OH 3.2Å
71	I	94.4	Very high	93.9	Very high	2 Å²	2	36.8 Å²	36.8	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-62.9	-45.8	-179.8	-67.1	157.9	0	0	0	111	A67 L68 S73 D74 L77 L78 L83 V395 Y396 A399	A67-I71 WeakPolarHBondContact O-CD1 3.49Å; A67-I71 VanDerWaalsContact O-CG1 3.26Å; A67-I71 WeakPolarHBondContact O-CG1 3.32Å; A67-I71 PolarHBondContact O-N 3.38Å; L68-I71 PolarHBondContact O-N 3.17Å; I71-S73 PolarHBondContact O-N 3.21Å; I71-S73 VanDerWaalsContact O-N 3.17Å; I71-D74 WeakPolarHBondContact O-CB 3.39Å; I71-D74 PolarHBondContact O-N 3.22Å; I71-L77 HydrophobicContact CG1-CD2 4.12Å; I71-L77 HydrophobicContact CG2-CD2 4.11Å; I71-L77 HydrophobicContact CG2-CG 4.35Å; I71-L78 HydrophobicContact CG2-CD1 4.49Å; I71-L83 HydrophobicContact CG2-CD1 3.9Å; I71-V395 HydrophobicContact CD1-CG1 3.73Å; I71-Y396 HydrophobicContact CD1-CD1 4.31Å; I71-Y396 HydrophobicContact CD1-CD2 4.27Å; I71-Y396 HydrophobicContact CD1-CE1 4.37Å; I71-Y396 HydrophobicContact CD1-CE2 4.34Å; I71-Y396 HydrophobicContact CD1-CG 4.27Å; I71-Y396 HydrophobicContact CG1-CD1 4.11Å; I71-Y396 HydrophobicContact CG1-CE1 3.76Å; I71-Y396 HydrophobicContact CG1-CE2 4.26Å; I71-A399 HydrophobicContact CD1-CB 3.8Å; I71-A399 HydrophobicContact CG1-CB 4.35Å; I71-A399 HydrophobicContact CG2-CB 4.07Å
72	N	95.9	Very high	93.8	Very high	61 Å²	61	39.7 Å²	39.7	33%	0.326	23%	0.227	S	C	.	.	H	α-helix	trans	-68	-14.9	179.5	-70	-26.4	0	0	0	113.3	L68 L83	L68-N72 VanDerWaalsContact O-CB 3.28Å; L68-N72 WeakPolarHBondContact O-CB 3.41Å; L68-N72 PolarHBondContact O-N 3.45Å; L68-N72 PolarHBondContact O-ND2 3.37Å; N72-L83 PolarHBondContact ND2-O 3.01Å; N72-L83 PolarHBondContact OD1-N 3.22Å
73	S	94.1	Very high	93.8	Very high	95 Å²	95	39.7 Å²	39.7	66%	0.664	23%	0.227	S	C	*	.	H	α-helix	trans	-97	-9.3	174.7	-54.6	0	0	0	0	112.9	D69 Q70 I71	D69-S73 WeakPolarHBondContact O-CB 3.38Å; D69-S73 PolarHBondContact O-N 2.84Å; D69-S73 PolarHBondContact O-OG 3.3Å; Q70-S73 PolarHBondContact O-N 3.46Å; Q70-S73 VanDerWaalsContact O-N 3.16Å; I71-S73 PolarHBondContact O-N 3.21Å; I71-S73 VanDerWaalsContact O-N 3.17Å
74	D	91	Very high	93.8	Very high	54 Å²	54	39.7 Å²	39.7	29%	0.289	23%	0.227	S	C	.	.			trans	-82.5	120	-177.8	-170.2	-23.8	0	0	0	109.9	Q70 I71 D76 L77	Q70-D74 PolarHBondContact O-N 2.78Å; Q70-D74 VanDerWaalsContact O-N 3.11Å; I71-D74 WeakPolarHBondContact O-CB 3.39Å; I71-D74 PolarHBondContact O-N 3.22Å; D74-D76 VanDerWaalsContact C-N 3.3Å; D74-D76 WeakPolarHBondContact OD1-CB 3.36Å; D74-D76 PolarHBondContact OD1-N 2.86Å; D74-L77 HydrophobicContact CB-CB 4.25Å; D74-L77 PolarHBondContact OD1-N 3.17Å
75	P	90.3	Very high	93.8	Very high	100 Å²	100	39.7 Å²	39.7	65%	0.649	23%	0.227	S	C	*	.	S	Bend	trans	-74.1	-20.1	178.8	31.3	-35.8	0	0	0	113.5
76	D	90.4	Very high	93.7	Very high	135 Å²	135	41.7 Å²	41.7	72%	0.722	23%	0.234	S	C	*	.	S	Bend	trans	-90.1	-32.2	-175.3	-64.8	-34.4	0	0	0	111.5	D74 H403	D74-D76 VanDerWaalsContact C-N 3.3Å; D74-D76 WeakPolarHBondContact OD1-CB 3.36Å; D74-D76 PolarHBondContact OD1-N 2.86Å; D76-H403 PolarHBondContact O-CE1 2.82Å; D76-H403 VanDerWaalsContact O-CE1 3.25Å
77	L	91	Very high	93.6	Very high	6 Å²	6	41 Å²	41	3%	0.031	23%	0.232	C	C	.	.	S	Bend	trans	-101.5	113.5	-178.3	-173.6	62.3	0	0	0	111.7	I71 D74 Y396 A399 H403	I71-L77 HydrophobicContact CG1-CD2 4.12Å; I71-L77 HydrophobicContact CG2-CD2 4.11Å; I71-L77 HydrophobicContact CG2-CG 4.35Å; D74-L77 HydrophobicContact CB-CB 4.25Å; D74-L77 PolarHBondContact OD1-N 3.17Å; L77-Y396 HydrophobicContact CD2-CD1 4.04Å; L77-Y396 HydrophobicContact CD2-CE1 4.14Å; L77-A399 HydrophobicContact CD2-CB 3.97Å; L77-A399 HydrophobicContact CG-CB 4.45Å; L77-H403 HydrophobicContact CD1-CB 3.67Å
78	L	92.3	Very high	93.6	Very high	6 Å²	6	41.1 Å²	41.1	3%	0.031	23%	0.232	C	C	.	.	S	Bend	trans	57.3	56.7	-178.3	-66.4	171.3	0	0	0	114	I71 N80 I81 L83 A399 L402 H403	I71-L78 HydrophobicContact CG2-CD1 4.49Å; L78-N80 PolarHBondContact O-N 3.1Å; L78-I81 HydrophobicContact CB-CB 4.29Å; L78-I81 HydrophobicContact CD2-CD1 4.36Å; L78-I81 PolarHBondContact O-N 3.06Å; L78-I81 VanDerWaalsContact O-N 3.13Å; L78-L83 HydrophobicContact CD1-CD1 3.78Å; L78-L83 HydrophobicContact CD1-CD2 3.88Å; L78-L83 HydrophobicContact CD1-CG 3.89Å; L78-A399 HydrophobicContact CD1-CB 4.17Å; L78-L402 HydrophobicContact CD1-CB 4.31Å; L78-L402 HydrophobicContact CD2-CB 4.12Å; L78-H403 HydrophobicContact CD2-CB 3.94Å; L78-H403 HydrophobicContact CG-CB 4.11Å; L78-H403 PolarHBondContact N-ND1 3.19Å
79	P	91.1	Very high	93.5	Very high	49 Å²	49	41.2 Å²	41.2	32%	0.318	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	132.9	-179.5	25.8	-34.5	0	0	0	111.8	I81	P79-I81 PolarHBondContact O-N 2.76Å
80	N	89.9	Confident	93.4	Very high	120 Å²	120	39 Å²	39	64%	0.642	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.7	22.2	-177.6	-56	-50.5	0	0	0	115	L78	L78-N80 PolarHBondContact O-N 3.1Å
81	I	93.6	Very high	93.2	Very high	6 Å²	6	35.6 Å²	35.6	3%	0.031	21%	0.205	C	C	.	.			trans	-126	123.1	171.1	-62.7	172.7	0	0	0	107.9	D30 I31 L78 P79 H406 V416	D30-I81 HydrophobicContact CB-CG2 4.33Å; I31-I81 HydrophobicContact CD1-CG2 3.95Å; I31-I81 HydrophobicContact CG1-CG2 4.25Å; L78-I81 HydrophobicContact CB-CB 4.29Å; L78-I81 HydrophobicContact CD2-CD1 4.36Å; L78-I81 PolarHBondContact O-N 3.06Å; L78-I81 VanDerWaalsContact O-N 3.13Å; P79-I81 PolarHBondContact O-N 2.76Å; I81-H406 VanDerWaalsContact CD1-CD2 3.49Å; I81-H406 WeakPolarHBondContact CD1-CD2 3.23Å; I81-V416 HydrophobicContact CD1-CG2 4.19Å; I81-V416 HydrophobicContact CG1-CG2 4.16Å; I81-V416 HydrophobicContact CG2-CG2 4.01Å
82	T	95	Very high	92.7	Very high	61 Å²	61	37.3 Å²	37.3	37%	0.374	22%	0.217	S	C	.	.			trans	-96.4	130.5	177.9	57	0	0	0	0	111.3	G29 D30 I31	G29-T82 CarbonylContact C-O 3.6Å; G29-T82 WeakPolarHBondContact CA-OG1 3.26Å; D30-T82 PolarHBondContact N-O 3.4Å; D30-T82 PolarHBondContact N-OG1 3.01Å; D30-T82 VanDerWaalsContact N-OG1 3.1Å; D30-T82 PolarHBondContact OD2-N 2.67Å; D30-T82 PolarHBondContact OD2-OG1 3.06Å; I31-T82 PolarHBondContact N-O 3.45Å
83	L	96.5	Very high	92.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	119.4	172.3	-63.2	-174.2	0	0	0	110.3	I31 L68 I71 N72 L78 A399 L402	I31-L83 HydrophobicContact CB-CD2 3.95Å; I31-L83 HydrophobicContact CG2-CD2 4.23Å; I31-L83 WeakPolarHBondContact O-CA 3.48Å; L68-L83 HydrophobicContact CD2-CB 3.66Å; L68-L83 HydrophobicContact CD2-CD1 4.37Å; I71-L83 HydrophobicContact CG2-CD1 3.9Å; N72-L83 PolarHBondContact ND2-O 3.01Å; N72-L83 PolarHBondContact OD1-N 3.22Å; L78-L83 HydrophobicContact CD1-CD1 3.78Å; L78-L83 HydrophobicContact CD1-CD2 3.88Å; L78-L83 HydrophobicContact CD1-CG 3.89Å; L83-A399 HydrophobicContact CD1-CB 3.95Å; L83-L402 HydrophobicContact CD2-CD1 3.9Å
84	G	95.9	Very high	91.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95	175.1	171	0	0	0	0	0	112	I27 I31 L33	I27-G84 CarbonylContact O-C 3.46Å; I27-G84 VanDerWaalsContact O-CA 3.31Å; I27-G84 WeakPolarHBondContact O-CA 3.46Å; I31-G84 PolarHBondContact O-N 2.81Å; L33-G84 PolarHBondContact N-O 3.23Å
85	A	95.5	Very high	91.8	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	144	179.1	0	0	0	0	0	113.9	K26 I27 L33 M64 L68 I87	K26-A85 CarbonylContact C-O 3.46Å; K26-A85 WeakPolarHBondContact CA-O 3.4Å; I27-A85 HydrophobicContact CB-CB 4.31Å; I27-A85 HydrophobicContact CG1-CB 4.46Å; I27-A85 PolarHBondContact N-O 3.33Å; I27-A85 PolarHBondContact O-N 2.95Å; L33-A85 CarbonylContact O-C 3.34Å; L33-A85 WeakPolarHBondContact O-CA 3.09Å; M64-A85 HydrophobicContact CE-CB 3.89Å; L68-A85 HydrophobicContact CD1-CB 3.55Å; A85-I87 HydrophobicContact CB-CG1 4.36Å
86	R	94.1	Very high	91.7	Very high	43 Å²	43	33.7 Å²	33.7	16%	0.162	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	105.6	168.9	-172.1	172.3	-179.9	-162.4	-3.6	109.5	L25 T32 L33 G34 G35 T103 F104 V132	L25-R86 CarbonylContact O-C 3.56Å; L25-R86 WeakPolarHBondContact O-CA 3.43Å; T32-R86 HydrophobicContact CG2-CB 4.05Å; L33-R86 PolarHBondContact O-N 3.2Å; G34-R86 CarbonylContact C-O 3.59Å; G34-R86 WeakPolarHBondContact CA-O 3.34Å; G35-R86 PolarHBondContact N-O 3Å; R86-T103 PolarHBondContact NH1-O 3.11Å; R86-F104 HydrophobicContact CB-CE1 4.36Å; R86-F104 HydrophobicContact CG-CE1 4.24Å; R86-F104 WeakPolarHBondContact O-CE1 3.35Å; R86-V132 HydrophobicContact CB-CG2 4.48Å
87	I	95.1	Very high	91.7	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104	129.1	-173.4	-58.2	178.3	0	0	0	110.2	S24 L25 G35 F37 L61 M64 L65 A85 W343	S24-I87 WeakPolarHBondContact CA-O 3.34Å; L25-I87 HydrophobicContact CB-CB 4.2Å; L25-I87 HydrophobicContact CD2-CB 4.48Å; L25-I87 HydrophobicContact CD2-CD1 4.15Å; L25-I87 HydrophobicContact CD2-CG1 4.41Å; L25-I87 PolarHBondContact N-O 3.42Å; L25-I87 PolarHBondContact O-N 3.41Å; G35-I87 CarbonylContact O-C 3.59Å; G35-I87 WeakPolarHBondContact O-CA 3.4Å; F37-I87 HydrophobicContact CD2-CG2 3.57Å; F37-I87 HydrophobicContact CE2-CD1 4.31Å; F37-I87 HydrophobicContact CE2-CG1 4.47Å; F37-I87 HydrophobicContact CE2-CG2 4.09Å; L61-I87 HydrophobicContact CD1-CG2 3.88Å; L61-I87 HydrophobicContact CD2-CD1 4.45Å; L61-I87 HydrophobicContact CG-CD1 4.12Å; L61-I87 HydrophobicContact CG-CG2 4.17Å; M64-I87 HydrophobicContact SD-CD1 4.02Å; M64-I87 HydrophobicContact SD-CG1 4.14Å; L65-I87 HydrophobicContact CD2-CD1 3.89Å; L65-I87 HydrophobicContact CG-CD1 4.35Å; A85-I87 HydrophobicContact CB-CG1 4.36Å; I87-W343 HydrophobicContact CG2-CZ3 4.34Å
88	L	94.1	Very high	91.7	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.005	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	147.8	177.7	-50.8	175.5	0	0	0	110.5	G35 L36 F37 Q100 T103 F104	G35-L88 PolarHBondContact O-N 2.99Å; L36-L88 HydrophobicContact CD2-CB 3.99Å; L36-L88 HydrophobicContact CD2-CD1 4.33Å; F37-L88 PolarHBondContact N-O 3.17Å; L88-Q100 HydrophobicContact CB-CB 4.41Å; L88-Q100 HydrophobicContact CD1-CB 4.04Å; L88-Q100 VanDerWaalsContact CD1-O 3.27Å; L88-Q100 WeakPolarHBondContact CD1-O 3.46Å; L88-T103 WeakPolarHBondContact CD1-OG1 3.43Å; L88-F104 HydrophobicContact CD1-CD1 4.06Å; L88-F104 HydrophobicContact CD1-CD2 4.35Å; L88-F104 HydrophobicContact CD1-CE1 3.52Å; L88-F104 HydrophobicContact CD1-CE2 3.84Å; L88-F104 HydrophobicContact CD1-CG 4.46Å; L88-F104 HydrophobicContact CD1-CZ 3.4Å; L88-F104 VanDerWaalsContact CD1-CZ 3.4Å; L88-F104 HydrophobicContact CG-CE1 3.82Å; L88-F104 HydrophobicContact CG-CZ 3.72Å
89	D	94	Very high	91.5	Very high	6 Å²	6	35 Å²	35	3%	0.032	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	135	170.1	-170.4	7.6	0	0	0	110.8	F37 V39 H40 C91 Y96 W343	F37-D89 WeakPolarHBondContact O-CA 3.27Å; V39-D89 HydrophobicContact CB-CB 4.22Å; V39-D89 HydrophobicContact CG2-CB 4.22Å; V39-D89 PolarHBondContact N-OD1 2.78Å; H40-D89 IonicContact CE1-OD2 3.29Å; H40-D89 IonicContact CG-OD2 3.97Å; H40-D89 PolarHBondContact N-OD1 3.02Å; H40-D89 PolarHBondContact N-OD2 3.15Å; H40-D89 IonicContact ND1-OD2 2.71Å; H40-D89 PolarHBondContact ND1-OD2 2.71Å; D89-C91 PolarHBondContact OD1-N 2.66Å; D89-C91 PolarHBondContact OD2-SG 2.55Å; D89-Y96 WeakPolarHBondContact O-CE1 3.49Å; D89-W343 HydrophobicContact CB-CH2 4.47Å; D89-W343 HydrophobicContact CB-CZ2 4.04Å
90	T	92.3	Very high	91.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.012	17%	0.172	C	C	.	.			trans	-93.9	-15.4	176	59.7	0	0	0	0	112.8	L36 F37 P38 S92 R93 A97 A138 V143	L36-T90 HydrophobicContact CB-CG2 3.82Å; L36-T90 HydrophobicContact CD2-CG2 4.11Å; L36-T90 HydrophobicContact CG-CG2 4.49Å; F37-T90 PolarHBondContact O-N 3.5Å; F37-T90 PolarHBondContact O-OG1 3.16Å; P38-T90 WeakPolarHBondContact CA-OG1 3.32Å; T90-S92 PolarHBondContact O-N 2.97Å; T90-R93 PolarHBondContact O-N 3.46Å; T90-A97 HydrophobicContact CG2-CB 3.96Å; T90-A138 HydrophobicContact CG2-CB 4.4Å; T90-V143 HydrophobicContact CG2-CG1 4.29Å
91	C	89.7	Confident	91.3	Very high	0 Å²	0	28 Å²	28	0%	0	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.1	25.8	-174.5	-60.3	0	0	0	0	114.1	H40 S41 R42 C49 D89 R93 Y96	H40-C91 CarbonylContact O-C 3.57Å; H40-C91 WeakPolarHBondContact O-CA 3.29Å; S41-C91 CarbonylContact C-O 3.57Å; R42-C91 WeakPolarHBondContact CA-O 3.24Å; R42-C91 PolarHBondContact N-O 2.81Å; C49-C91 HydrophobicContact CB-CB 3.76Å; C49-C91 WeakPolarHBondContact CB-SG 3.35Å; C49-C91 WeakPolarHBondContact SG-CB 3.28Å; C49-C91 CovalentContact SG-SG 2.02Å; C49-C91 PolarHBondContact SG-SG 3.27Å; D89-C91 PolarHBondContact OD1-N 2.66Å; D89-C91 PolarHBondContact OD2-SG 2.55Å; C91-R93 PolarHBondContact O-N 3.41Å; C91-Y96 HydrophobicContact CB-CD1 3.81Å; C91-Y96 HydrophobicContact CB-CE1 4.08Å; C91-Y96 WeakPolarHBondContact SG-CE1 3.04Å
92	S	85.1	Confident	91.1	Very high	39 Å²	39	31.7 Å²	31.7	27%	0.273	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	51.7	27	-174	-47.2	0	0	0	0	113.8	H40 K53 T90	H40-S92 PolarHBondContact O-OG 2.77Å; H40-S92 VanDerWaalsContact O-OG 3.09Å; K53-S92 PolarHBondContact NZ-OG 2.81Å; T90-S92 PolarHBondContact O-N 2.97Å
93	R	86	Confident	90.6	Very high	71 Å²	71	29.9 Å²	29.9	27%	0.268	15%	0.15	S	C	.	.			trans	-128.6	120.6	-175.3	-175	173.8	-177.5	157.6	1.2	110.1	T90 C91 T95 Y96 A97	T90-R93 PolarHBondContact O-N 3.46Å; C91-R93 PolarHBondContact O-N 3.41Å; R93-T95 PolarHBondContact NE-OG1 3.47Å; R93-T95 PolarHBondContact O-N 3.02Å; R93-Y96 PolarHBondContact O-N 2.64Å; R93-A97 WeakPolarHBondContact O-CB 3.06Å; R93-A97 PolarHBondContact O-N 3.4Å
94	D	87.1	Confident	90.3	Very high	42 Å²	42	29.9 Å²	29.9	23%	0.225	15%	0.15	C	C	.	.	H	α-helix	trans	-58.6	-46.5	-176.8	52.5	1.9	0	0	0	113.2	Y96 L98 V143 M146	D94-Y96 PolarHBondContact O-N 2.03Å; D94-L98 VanDerWaalsContact O-CB 3.3Å; D94-L98 WeakPolarHBondContact O-CB 3.2Å; D94-L98 PolarHBondContact O-N 3.4Å; D94-V143 HydrophobicContact CB-CG2 4.35Å; D94-M146 HydrophobicContact CB-CG 3.97Å
95	T	88.1	Confident	89.7	Confident	80 Å²	80	29.9 Å²	29.9	49%	0.491	15%	0.15	S	C	.	.	H	α-helix	trans	-64	-39.1	178.5	62.4	0	0	0	0	113.1	R93 E99	R93-T95 PolarHBondContact NE-OG1 3.47Å; R93-T95 PolarHBondContact O-N 3.02Å; T95-E99 PolarHBondContact O-N 2.94Å
96	Y	89.4	Confident	89	Confident	40 Å²	40	35.1 Å²	35.1	16%	0.157	18%	0.175	C	C	.	.	H	α-helix	trans	-73	-45.9	-179.4	179.8	-99.8	0	0	0	110.9	P48 D89 C91 R93 D94 L98 E99 Q100	P48-Y96 HydrophobicContact CB-CD2 3.62Å; P48-Y96 HydrophobicContact CB-CE2 3.86Å; P48-Y96 HydrophobicContact CB-CG 4.22Å; P48-Y96 HydrophobicContact CG-CD2 4.48Å; P48-Y96 HydrophobicContact CG-CE2 4.28Å; D89-Y96 WeakPolarHBondContact O-CE1 3.49Å; C91-Y96 HydrophobicContact CB-CD1 3.81Å; C91-Y96 HydrophobicContact CB-CE1 4.08Å; C91-Y96 WeakPolarHBondContact SG-CE1 3.04Å; R93-Y96 PolarHBondContact O-N 2.64Å; D94-Y96 PolarHBondContact O-N 2.03Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 2.76Å; Y96-E99 WeakPolarHBondContact O-CB 3.26Å; Y96-E99 PolarHBondContact O-N 3.47Å; Y96-E99 VanDerWaalsContact O-N 3.16Å; Y96-Q100 HydrophobicContact CD1-CG 4.07Å; Y96-Q100 HydrophobicContact CE1-CG 3.66Å; Y96-Q100 HydrophobicContact CE2-CG 4.32Å; Y96-Q100 WeakPolarHBondContact O-CG 3.37Å; Y96-Q100 PolarHBondContact O-N 3.08Å
97	A	91	Very high	87.7	Confident	0 Å²	0	33.5 Å²	33.5	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-60.8	-36.9	176.1	0	0	0	0	0	112.5	T90 R93 Q100 S101 V143	T90-A97 HydrophobicContact CG2-CB 3.96Å; R93-A97 WeakPolarHBondContact O-CB 3.06Å; R93-A97 PolarHBondContact O-N 3.4Å; A97-Q100 PolarHBondContact O-N 3.18Å; A97-S101 VanDerWaalsContact O-CB 3.28Å; A97-S101 WeakPolarHBondContact O-CB 3.01Å; A97-S101 PolarHBondContact O-N 3.35Å; A97-S101 PolarHBondContact O-OG 2.86Å; A97-V143 HydrophobicContact CB-CG1 3.38Å
98	L	90.1	Very high	86.6	Confident	53 Å²	53	36.7 Å²	36.7	28%	0.277	19%	0.187	S	C	.	.	H	α-helix	trans	-60.2	-49.4	172.9	179.4	65.9	0	0	0	111.4	D94 Y96 Q100 S101 L102 M146 V150	D94-L98 VanDerWaalsContact O-CB 3.3Å; D94-L98 WeakPolarHBondContact O-CB 3.2Å; D94-L98 PolarHBondContact O-N 3.4Å; Y96-L98 VanDerWaalsContact C-N 3.27Å; Y96-L98 PolarHBondContact O-N 2.76Å; L98-Q100 PolarHBondContact O-N 3.33Å; L98-S101 PolarHBondContact O-N 2.81Å; L98-L102 PolarHBondContact O-N 3.45Å; L98-M146 HydrophobicContact CB-CB 4.48Å; L98-M146 HydrophobicContact CD1-CB 4.46Å; L98-V150 HydrophobicContact CD1-CB 4.43Å; L98-V150 HydrophobicContact CD1-CG2 3.33Å
99	E	88.8	Confident	85.6	Confident	121 Å²	121	41.3 Å²	41.3	57%	0.565	21%	0.211	S	C	*	.	H	α-helix	trans	-58.5	-46.8	176.9	-175.9	-176.2	-176.9	0	0	111.5	T95 Y96 S101 L102	T95-E99 PolarHBondContact O-N 2.94Å; Y96-E99 WeakPolarHBondContact O-CB 3.26Å; Y96-E99 PolarHBondContact O-N 3.47Å; Y96-E99 VanDerWaalsContact O-N 3.16Å; E99-S101 VanDerWaalsContact C-N 3.34Å; E99-S101 PolarHBondContact O-N 3.44Å; E99-L102 WeakPolarHBondContact O-CB 3.37Å; E99-L102 PolarHBondContact O-N 2.93Å
100	Q	87.8	Confident	83.8	Confident	22 Å²	22	49.7 Å²	49.7	10%	0.103	25%	0.25	C	S	.	.	H	α-helix	trans	-63.5	-39.5	177.2	-64.5	-47.3	-58.9	0	0	111.8	L88 Y96 A97 L98 L102 T103	L88-Q100 HydrophobicContact CB-CB 4.41Å; L88-Q100 HydrophobicContact CD1-CB 4.04Å; L88-Q100 VanDerWaalsContact CD1-O 3.27Å; L88-Q100 WeakPolarHBondContact CD1-O 3.46Å; Y96-Q100 HydrophobicContact CD1-CG 4.07Å; Y96-Q100 HydrophobicContact CE1-CG 3.66Å; Y96-Q100 HydrophobicContact CE2-CG 4.32Å; Y96-Q100 WeakPolarHBondContact O-CG 3.37Å; Y96-Q100 PolarHBondContact O-N 3.08Å; A97-Q100 PolarHBondContact O-N 3.18Å; L98-Q100 PolarHBondContact O-N 3.33Å; Q100-L102 PolarHBondContact O-N 2.02Å; Q100-T103 WeakPolarHBondContact O-CB 3.28Å; Q100-T103 WeakPolarHBondContact O-CG2 3.04Å; Q100-T103 PolarHBondContact O-N 2.87Å; Q100-T103 PolarHBondContact O-OG1 3.23Å
101	S	89.1	Confident	82.1	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-65.6	-22	-179.4	-60.6	0	0	0	0	113.3	A97 L98 E99 T103 F104 V147	A97-S101 VanDerWaalsContact O-CB 3.28Å; A97-S101 WeakPolarHBondContact O-CB 3.01Å; A97-S101 PolarHBondContact O-N 3.35Å; A97-S101 PolarHBondContact O-OG 2.86Å; L98-S101 PolarHBondContact O-N 2.81Å; E99-S101 VanDerWaalsContact C-N 3.34Å; E99-S101 PolarHBondContact O-N 3.44Å; S101-T103 PolarHBondContact O-N 3.35Å; S101-T103 VanDerWaalsContact O-N 3.17Å; S101-F104 WeakPolarHBondContact O-CB 3.49Å; S101-F104 PolarHBondContact O-N 3.43Å; S101-F104 VanDerWaalsContact O-N 3.08Å; S101-V147 WeakPolarHBondContact OG-CG2 3.11Å
102	L	87.6	Confident	80.4	Confident	84 Å²	84	64.3 Å²	64.3	44%	0.44	32%	0.32	S	S	.	.	H	α-helix	trans	-59.2	-25.6	171	-67.2	172.9	0	0	0	112	L98 E99 Q100 F104 V105 Q106 V150	L98-L102 PolarHBondContact O-N 3.45Å; E99-L102 WeakPolarHBondContact O-CB 3.37Å; E99-L102 PolarHBondContact O-N 2.93Å; Q100-L102 PolarHBondContact O-N 2.02Å; L102-F104 VanDerWaalsContact C-N 3.28Å; L102-F104 PolarHBondContact O-N 3.33Å; L102-V105 WeakPolarHBondContact O-CG2 3.29Å; L102-V105 PolarHBondContact O-N 2.8Å; L102-Q106 WeakPolarHBondContact O-CG 3.43Å; L102-Q106 PolarHBondContact O-N 3.04Å; L102-V150 HydrophobicContact CD2-CG1 4.19Å
103	T	86.4	Confident	79.3	Confident	23 Å²	23	65.5 Å²	65.5	14%	0.141	32%	0.323	C	S	.	.	H	α-helix	trans	-71.2	-19.5	177.7	71.4	0	0	0	0	113.9	R86 L88 Q100 S101	R86-T103 PolarHBondContact NH1-O 3.11Å; L88-T103 WeakPolarHBondContact CD1-OG1 3.43Å; Q100-T103 WeakPolarHBondContact O-CB 3.28Å; Q100-T103 WeakPolarHBondContact O-CG2 3.04Å; Q100-T103 PolarHBondContact O-N 2.87Å; Q100-T103 PolarHBondContact O-OG1 3.23Å; S101-T103 PolarHBondContact O-N 3.35Å; S101-T103 VanDerWaalsContact O-N 3.17Å
104	F	88.3	Confident	78.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-71.5	-33.7	172	-65.9	-36.2	0	0	0	112.1	L36 R86 L88 S101 L102 V132 V135	L36-F104 HydrophobicContact CD1-CE2 4.27Å; L36-F104 HydrophobicContact CD2-CE2 3.73Å; L36-F104 HydrophobicContact CD2-CZ 4.05Å; L36-F104 HydrophobicContact CG-CE2 3.9Å; L36-F104 HydrophobicContact CG-CZ 4.35Å; R86-F104 HydrophobicContact CB-CE1 4.36Å; R86-F104 HydrophobicContact CG-CE1 4.24Å; R86-F104 WeakPolarHBondContact O-CE1 3.35Å; L88-F104 HydrophobicContact CD1-CD1 4.06Å; L88-F104 HydrophobicContact CD1-CD2 4.35Å; L88-F104 HydrophobicContact CD1-CE1 3.52Å; L88-F104 HydrophobicContact CD1-CE2 3.84Å; L88-F104 HydrophobicContact CD1-CG 4.46Å; L88-F104 HydrophobicContact CD1-CZ 3.4Å; L88-F104 VanDerWaalsContact CD1-CZ 3.4Å; L88-F104 HydrophobicContact CG-CE1 3.82Å; L88-F104 HydrophobicContact CG-CZ 3.72Å; S101-F104 WeakPolarHBondContact O-CB 3.49Å; S101-F104 PolarHBondContact O-N 3.43Å; S101-F104 VanDerWaalsContact O-N 3.08Å; L102-F104 VanDerWaalsContact C-N 3.28Å; L102-F104 PolarHBondContact O-N 3.33Å; F104-V132 HydrophobicContact CB-CB 4.43Å; F104-V132 HydrophobicContact CB-CG2 4.46Å; F104-V132 HydrophobicContact CD1-CB 4.4Å; F104-V132 HydrophobicContact CD1-CG2 3.67Å; F104-V132 HydrophobicContact CE1-CG2 4.21Å; F104-V132 HydrophobicContact CG-CG2 4.31Å; F104-V135 HydrophobicContact CD2-CG2 3.99Å; F104-V135 HydrophobicContact CE2-CG1 4.16Å; F104-V135 HydrophobicContact CE2-CG2 4.09Å
105	V	85.3	Confident	76.8	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.006	37%	0.366	C	S	.	.	H	α-helix	trans	-93.8	-11.1	-176.4	-58.1	0	0	0	0	113	L102 A107 L108 I109 F154 I156	L102-V105 WeakPolarHBondContact O-CG2 3.29Å; L102-V105 PolarHBondContact O-N 2.8Å; V105-A107 PolarHBondContact O-N 3.47Å; V105-L108 WeakPolarHBondContact O-CB 3.32Å; V105-L108 PolarHBondContact O-N 3.37Å; V105-I109 HydrophobicContact CG2-CD1 4.33Å; V105-I109 PolarHBondContact O-N 3.4Å; V105-F154 HydrophobicContact CB-CD1 4.24Å; V105-F154 HydrophobicContact CB-CD2 3.78Å; V105-F154 HydrophobicContact CB-CE1 4.25Å; V105-F154 HydrophobicContact CB-CE2 3.79Å; V105-F154 HydrophobicContact CB-CG 4Å; V105-F154 HydrophobicContact CB-CZ 4.02Å; V105-F154 HydrophobicContact CG1-CB 4.11Å; V105-F154 HydrophobicContact CG1-CD1 4.44Å; V105-F154 HydrophobicContact CG1-CD2 3.4Å; V105-F154 HydrophobicContact CG1-CE2 3.86Å; V105-F154 HydrophobicContact CG1-CG 3.73Å; V105-F154 HydrophobicContact CG2-CD2 4.25Å; V105-F154 HydrophobicContact CG2-CE2 3.81Å; V105-F154 HydrophobicContact CG2-CZ 4.08Å; V105-I156 HydrophobicContact CG1-CD1 3.91Å
106	Q	78.9	Confident	75.8	Confident	109 Å²	109	68 Å²	68	51%	0.509	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-32.2	175.2	-83.4	174.2	-3.7	0	0	112.9	L102 L108	L102-Q106 WeakPolarHBondContact O-CG 3.43Å; L102-Q106 PolarHBondContact O-N 3.04Å; Q106-L108 VanDerWaalsContact C-N 3.3Å; Q106-L108 PolarHBondContact O-N 2.94Å
107	A	68.4	Low	75	Confident	9 Å²	9	75.9 Å²	75.9	7%	0.074	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-19.6	178.3	0	0	0	0	0	115	V105 P129 E130 R131	V105-A107 PolarHBondContact O-N 3.47Å; A107-P129 VanDerWaalsContact CA-CG 3.49Å; A107-P129 HydrophobicContact CB-CB 3.64Å; A107-P129 HydrophobicContact CB-CG 3.81Å; A107-P129 WeakPolarHBondContact CB-O 3.48Å; A107-E130 VanDerWaalsContact CB-O 3.31Å; A107-E130 WeakPolarHBondContact CB-O 3.48Å; A107-R131 HydrophobicContact CB-CB 4.48Å; A107-R131 HydrophobicContact CB-CG 3.69Å
108	L	71.6	Confident	74	Confident	68 Å²	68	78.3 Å²	78.3	36%	0.356	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-23.3	-179.8	-61.5	174.2	0	0	0	111.9	V105 Q106 Q110 F154 I156	V105-L108 WeakPolarHBondContact O-CB 3.32Å; V105-L108 PolarHBondContact O-N 3.37Å; Q106-L108 VanDerWaalsContact C-N 3.3Å; Q106-L108 PolarHBondContact O-N 2.94Å; L108-Q110 PolarHBondContact O-N 3.45Å; L108-F154 HydrophobicContact CB-CD1 4.06Å; L108-F154 HydrophobicContact CD1-CB 3.83Å; L108-F154 HydrophobicContact CD1-CD1 4.11Å; L108-F154 HydrophobicContact CD1-CG 4.28Å; L108-I156 HydrophobicContact CD1-CD1 3.88Å; L108-I156 HydrophobicContact CD1-CG1 4.31Å
109	I	72.1	Confident	73.3	Confident	98 Å²	98	82.6 Å²	82.6	50%	0.503	45%	0.446	S	S	.	.	S	Bend	trans	-77.6	92.6	173.6	-58	169.6	0	0	0	107.6	V105 K111 F154	V105-I109 HydrophobicContact CG2-CD1 4.33Å; V105-I109 PolarHBondContact O-N 3.4Å; I109-K111 PolarHBondContact O-N 3.46Å; I109-K111 VanDerWaalsContact O-N 3.14Å; I109-F154 HydrophobicContact CD1-CZ 4.23Å; I109-F154 HydrophobicContact CG1-CE1 3.98Å; I109-F154 HydrophobicContact CG1-CZ 4.11Å
110	Q	57	Low	72.7	Confident	182 Å²	182	81.8 Å²	81.8	85%	0.85	45%	0.445	S	S	*	.			trans	-54	119.2	177.4	-72	-176.9	-3.6	0	0	110.3	L108	L108-Q110 PolarHBondContact O-N 3.45Å
111	K	56.3	Low	71.9	Confident	170 Å²	170	83.4 Å²	83.4	74%	0.739	47%	0.468	S	S	*	.			trans	-86.7	117.6	157.5	-79.5	-175.1	173.7	178.7	0	107.6	I109 N113	I109-K111 PolarHBondContact O-N 3.46Å; I109-K111 VanDerWaalsContact O-N 3.14Å; K111-N113 VanDerWaalsContact C-N 3.31Å; K111-N113 VanDerWaalsContact CB-OD1 3.28Å; K111-N113 WeakPolarHBondContact CB-OD1 3.34Å; K111-N113 VanDerWaalsContact O-CG 3.32Å; K111-N113 PolarHBondContact O-N 2.89Å; K111-N113 PolarHBondContact O-ND2 2.83Å; K111-N113 PolarHBondContact O-OD1 2.83Å
112	D	54	Low	71.1	Confident	138 Å²	138	89.3 Å²	89.3	74%	0.738	50%	0.496	S	S	*	.			trans	-64.6	95.7	166.8	-168.1	-5.4	0	0	0	108.2	S114	D112-S114 VanDerWaalsContact C-N 3.28Å; D112-S114 WeakPolarHBondContact OD1-CB 3.47Å; D112-S114 PolarHBondContact OD1-N 3.31Å; D112-S114 PolarHBondContact OD1-OG 2.95Å
113	N	61.7	Low	70	Confident	65 Å²	65	91.3 Å²	91.3	35%	0.348	51%	0.511	S	S	.	.			trans	-91.2	7.1	-173.8	-69.7	-30.8	0	0	0	112.3	K111 G115 V116 I126	K111-N113 VanDerWaalsContact C-N 3.31Å; K111-N113 VanDerWaalsContact CB-OD1 3.28Å; K111-N113 WeakPolarHBondContact CB-OD1 3.34Å; K111-N113 VanDerWaalsContact O-CG 3.32Å; K111-N113 PolarHBondContact O-N 2.89Å; K111-N113 PolarHBondContact O-ND2 2.83Å; K111-N113 PolarHBondContact O-OD1 2.83Å; N113-G115 PolarHBondContact O-N 3.38Å; N113-G115 VanDerWaalsContact O-N 3.1Å; N113-V116 PolarHBondContact O-N 3.49Å; N113-I126 HydrophobicContact CB-CD1 3.62Å; N113-I126 VanDerWaalsContact ND2-CD1 3.27Å; N113-I126 WeakPolarHBondContact ND2-CD1 3.4Å
114	S	61.1	Low	69.1	Low	100 Å²	100	91.7 Å²	91.7	70%	0.699	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-20.2	-178.7	57.5	0	0	0	0	113.8	D112	D112-S114 VanDerWaalsContact C-N 3.28Å; D112-S114 WeakPolarHBondContact OD1-CB 3.47Å; D112-S114 PolarHBondContact OD1-N 3.31Å; D112-S114 PolarHBondContact OD1-OG 2.95Å
115	G	59.7	Low	68	Low	67 Å²	67	99.8 Å²	99.8	69%	0.691	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.6	-6.6	179.4	0	0	0	0	0	116.7	N113	N113-G115 PolarHBondContact O-N 3.38Å; N113-G115 VanDerWaalsContact O-N 3.1Å
116	V	67.3	Low	66.9	Low	79 Å²	79	103.3 Å²	103.3	48%	0.479	57%	0.574	S	S	.	*			trans	-91.4	115.9	-175.5	-169.8	0	0	0	0	109.7	N113 P124	N113-V116 PolarHBondContact O-N 3.49Å; V116-P124 HydrophobicContact CB-CG 4.01Å; V116-P124 HydrophobicContact CG1-CB 4.48Å; V116-P124 HydrophobicContact CG1-CG 3.84Å; V116-P124 WeakPolarHBondContact O-CD 3.48Å; V116-P124 WeakPolarHBondContact O-CG 3.34Å
117	R	71.5	Confident	66	Low	204 Å²	204	103.1 Å²	103.1	77%	0.77	58%	0.582	S	S	*	*			trans	-119.7	139.5	173.1	-64.5	-170.5	178.6	-176.5	-1.2	109.7
118	C	71.6	Confident	65.7	Low	52 Å²	52	112.3 Å²	112.3	35%	0.351	62%	0.62	S	S	.	*			trans	-68.8	158.5	171.5	-70.7	0	0	0	0	110.2	N120 G121 E122 P124	C118-N120 WeakPolarHBondContact CB-OD1 3.49Å; C118-N120 PolarHBondContact O-N 3.2Å; C118-G121 PolarHBondContact O-N 3.21Å; C118-E122 PolarHBondContact N-O 3.16Å; C118-P124 VanDerWaalsContact SG-CA 3.53Å
119	S	74.8	Confident	65.4	Low	143 Å²	143	112.5 Å²	112.5	100%	1	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.7	-17.2	-178	-48.6	0	0	0	0	114
120	N	75.4	Confident	65.5	Low	103 Å²	103	109.6 Å²	109.6	55%	0.551	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.9	4	175.7	59.1	-10.4	0	0	0	113.8	C118 E122	C118-N120 WeakPolarHBondContact CB-OD1 3.49Å; C118-N120 PolarHBondContact O-N 3.2Å; N120-E122 VanDerWaalsContact C-N 3.25Å; N120-E122 PolarHBondContact ND2-OE2 2.96Å; N120-E122 PolarHBondContact O-N 3.47Å; N120-E122 PolarHBondContact OD1-N 2.86Å
121	G	70.9	Confident	66.7	Low	56 Å²	56	106.7 Å²	106.7	58%	0.577	59%	0.591	S	S	*	*	S	Bend	trans	80.3	-1.7	-179.7	0	0	0	0	0	115	C118	C118-G121 PolarHBondContact O-N 3.21Å
122	E	72.3	Confident	68.4	Low	125 Å²	125	99 Å²	99	58%	0.584	56%	0.558	S	S	*	*	P	Polyproline II helix	trans	-75.9	154	175.7	-66.9	176.4	170.4	0	0	111.5	C118 N120	C118-E122 PolarHBondContact N-O 3.16Å; N120-E122 VanDerWaalsContact C-N 3.25Å; N120-E122 PolarHBondContact ND2-OE2 2.96Å; N120-E122 PolarHBondContact O-N 3.47Å; N120-E122 PolarHBondContact OD1-N 2.86Å
123	T	65.4	Low	70.3	Confident	126 Å²	126	93.4 Å²	93.4	77%	0.773	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-67.3	128	169.6	49.1	0	0	0	0	109.1	I125	T123-I125 PolarHBondContact O-N 3.14Å
124	P	68.1	Low	71.9	Confident	31 Å²	31	90.3 Å²	90.3	20%	0.201	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-59.7	135.6	176.2	25.1	-34.3	0	0	0	110.4	V116 C118 I126	V116-P124 HydrophobicContact CB-CG 4.01Å; V116-P124 HydrophobicContact CG1-CB 4.48Å; V116-P124 HydrophobicContact CG1-CG 3.84Å; V116-P124 WeakPolarHBondContact O-CD 3.48Å; V116-P124 WeakPolarHBondContact O-CG 3.34Å; C118-P124 VanDerWaalsContact SG-CA 3.53Å; P124-I126 VanDerWaalsContact C-N 3.26Å; P124-I126 HydrophobicContact CB-CD1 4.47Å; P124-I126 HydrophobicContact CB-CG1 3.98Å; P124-I126 HydrophobicContact CG-CD1 3.92Å; P124-I126 HydrophobicContact CG-CG1 3.95Å; P124-I126 PolarHBondContact O-N 3.06Å
125	I	64.8	Low	73.7	Confident	170 Å²	170	85.5 Å²	85.5	87%	0.872	48%	0.479	S	S	*	.			trans	-71.6	90.5	166.7	-55.9	171.7	0	0	0	106.3	T123 P127	T123-I125 PolarHBondContact O-N 3.14Å; I125-P127 VanDerWaalsContact O-CD 3.29Å; I125-P127 WeakPolarHBondContact O-CD 3.31Å
126	I	61.5	Low	75.5	Confident	75 Å²	75	82.3 Å²	82.3	39%	0.385	45%	0.446	S	S	.	.			trans	-88.6	108.6	173.7	-57.4	176.1	0	0	0	106	N113 P124 K128	N113-I126 HydrophobicContact CB-CD1 3.62Å; N113-I126 VanDerWaalsContact ND2-CD1 3.27Å; N113-I126 WeakPolarHBondContact ND2-CD1 3.4Å; P124-I126 VanDerWaalsContact C-N 3.26Å; P124-I126 HydrophobicContact CB-CD1 4.47Å; P124-I126 HydrophobicContact CB-CG1 3.98Å; P124-I126 HydrophobicContact CG-CD1 3.92Å; P124-I126 HydrophobicContact CG-CG1 3.95Å; P124-I126 PolarHBondContact O-N 3.06Å; I126-K128 PolarHBondContact O-N 3.28Å
127	P	60.8	Low	76.8	Confident	105 Å²	105	78.6 Å²	78.6	68%	0.682	42%	0.423	S	S	*	.	P	Polyproline II helix	trans	-57.1	127.3	175.4	22.5	-30.5	0	0	0	108.1	I125 P129	I125-P127 VanDerWaalsContact O-CD 3.29Å; I125-P127 WeakPolarHBondContact O-CD 3.31Å; P127-P129 WeakPolarHBondContact O-CD 3.34Å; P127-P129 VanDerWaalsContact O-N 3.11Å
128	K	61.4	Low	77.8	Confident	201 Å²	201	68.9 Å²	68.9	87%	0.874	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-57.7	120.6	174	-81.4	-175.8	179.2	178.2	0	106.9	I126 E130	I126-K128 PolarHBondContact O-N 3.28Å; K128-E130 PolarHBondContact O-N 3.27Å
129	P	66.1	Low	78.7	Confident	73 Å²	73	67.4 Å²	67.4	47%	0.474	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-62.8	132.1	177.8	26.9	-34.6	0	0	0	108.6	A107 P127 R131	A107-P129 VanDerWaalsContact CA-CG 3.49Å; A107-P129 HydrophobicContact CB-CB 3.64Å; A107-P129 HydrophobicContact CB-CG 3.81Å; A107-P129 WeakPolarHBondContact CB-O 3.48Å; P127-P129 WeakPolarHBondContact O-CD 3.34Å; P127-P129 VanDerWaalsContact O-N 3.11Å; P129-R131 PolarHBondContact O-N 2.9Å
130	E	72.9	Confident	79.3	Confident	37 Å²	37	62 Å²	62	17%	0.173	35%	0.345	C	S	.	.	P	Polyproline II helix	trans	-64.7	128	-177.7	-174.6	176.7	-156.2	0	0	110.5	K26 T32 A107 K128	K26-E130 WeakPolarHBondContact CD-OE2 3.49Å; K26-E130 VanDerWaalsContact CE-CD 3.42Å; K26-E130 WeakPolarHBondContact CE-OE1 3.38Å; K26-E130 WeakPolarHBondContact CE-OE2 3.4Å; K26-E130 IonicContact NZ-OE2 2.68Å; T32-E130 WeakPolarHBondContact CB-OE1 3.44Å; T32-E130 HydrophobicContact CG2-CG 4Å; T32-E130 WeakPolarHBondContact CG2-OE1 3.28Å; T32-E130 WeakPolarHBondContact OG1-CG 3.41Å; T32-E130 PolarHBondContact OG1-OE1 3.11Å; A107-E130 VanDerWaalsContact CB-O 3.31Å; A107-E130 WeakPolarHBondContact CB-O 3.48Å; K128-E130 PolarHBondContact O-N 3.27Å
131	R	83.5	Confident	80	Confident	121 Å²	121	57.6 Å²	57.6	46%	0.457	32%	0.321	S	S	.	.	P	Polyproline II helix	trans	-93.6	126.1	-177	-70	180	177.1	174.8	-1.2	109.9	A107 P129	A107-R131 HydrophobicContact CB-CB 4.48Å; A107-R131 HydrophobicContact CB-CG 3.69Å; P129-R131 PolarHBondContact O-N 2.9Å
132	V	91.6	Very high	80.9	Confident	7 Å²	7	56.7 Å²	56.7	4%	0.042	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	122.6	172.8	170.2	0	0	0	0	109.2	T32 R86 F104 G134 V135	T32-V132 HydrophobicContact CG2-CG2 4.4Å; T32-V132 WeakPolarHBondContact O-CA 3.39Å; R86-V132 HydrophobicContact CB-CG2 4.48Å; F104-V132 HydrophobicContact CB-CB 4.43Å; F104-V132 HydrophobicContact CB-CG2 4.46Å; F104-V132 HydrophobicContact CD1-CB 4.4Å; F104-V132 HydrophobicContact CD1-CG2 3.67Å; F104-V132 HydrophobicContact CE1-CG2 4.21Å; F104-V132 HydrophobicContact CG-CG2 4.31Å; V132-G134 WeakPolarHBondContact CG1-O 3.49Å; V132-V135 HydrophobicContact CG1-CG2 3.91Å
133	V	94	Very high	81.8	Confident	21 Å²	21	51 Å²	51	13%	0.127	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-24.2	-178.3	-57.3	0	0	0	0	113.3	I31 T32 L33 P157 V423	I31-V133 HydrophobicContact CG2-CB 4.28Å; I31-V133 HydrophobicContact CG2-CG1 3.93Å; I31-V133 HydrophobicContact CG2-CG2 3.36Å; T32-V133 PolarHBondContact O-N 3.09Å; T32-V133 VanDerWaalsContact O-N 3.1Å; L33-V133 HydrophobicContact CD2-CG2 3.69Å; V133-P157 WeakPolarHBondContact O-CD 3.44Å; V133-V423 HydrophobicContact CB-CB 4.19Å; V133-V423 HydrophobicContact CB-CG1 4.38Å; V133-V423 HydrophobicContact CG1-CB 3.81Å; V133-V423 HydrophobicContact CG1-CG2 3.98Å
134	G	96	Very high	83.2	Confident	0 Å²	0	45 Å²	45	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-164.9	156.1	179.9	0	0	0	0	0	110.7	G34 V132 P157	G34-G134 PolarHBondContact N-O 3.11Å; V132-G134 WeakPolarHBondContact CG1-O 3.49Å; G134-P157 CarbonylContact C-O 3.52Å; G134-P157 VanDerWaalsContact CA-O 3.3Å; G134-P157 WeakPolarHBondContact CA-O 3.44Å
135	V	97.4	Very high	84.4	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	129.8	-174.8	178.1	0	0	0	0	111.1	G34 L36 F104 V132 L151 I156 P157 Q158 I159	G34-V135 CarbonylContact O-C 3.59Å; G34-V135 WeakPolarHBondContact O-CA 3.21Å; L36-V135 HydrophobicContact CD1-CG1 3.85Å; L36-V135 HydrophobicContact CG-CG1 4.01Å; F104-V135 HydrophobicContact CD2-CG2 3.99Å; F104-V135 HydrophobicContact CE2-CG1 4.16Å; F104-V135 HydrophobicContact CE2-CG2 4.09Å; V132-V135 HydrophobicContact CG1-CG2 3.91Å; V135-L151 HydrophobicContact CB-CD1 3.84Å; V135-L151 HydrophobicContact CG1-CD1 4.26Å; V135-L151 HydrophobicContact CG2-CD1 3.7Å; V135-L151 HydrophobicContact CG2-CD2 4.14Å; V135-I156 HydrophobicContact CG2-CG2 4.04Å; V135-P157 PolarHBondContact N-O 3.23Å; V135-Q158 HydrophobicContact CB-CG 4.42Å; V135-Q158 CarbonylContact O-C 3.54Å; V135-Q158 VanDerWaalsContact O-CA 3.29Å; V135-Q158 WeakPolarHBondContact O-CA 3.27Å; V135-I159 PolarHBondContact O-N 3.27Å
136	I	98	Very high	85.7	Confident	0 Å²	0	39 Å²	39	0%	0	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124.3	170.5	-54	-57.8	0	0	0	109.2	G34 L36 M64 I159 Y161 A394 V395 M398	G34-I136 PolarHBondContact O-N 2.94Å; L36-I136 PolarHBondContact N-O 2.82Å; M64-I136 HydrophobicContact CE-CG1 4.31Å; M64-I136 HydrophobicContact SD-CB 4.44Å; I136-I159 WeakPolarHBondContact CA-O 3.44Å; I136-I159 HydrophobicContact CD1-CB 4.16Å; I136-Y161 HydrophobicContact CG2-CD1 4.02Å; I136-A394 HydrophobicContact CD1-CB 4.28Å; I136-A394 HydrophobicContact CG2-CB 4.09Å; I136-V395 HydrophobicContact CG1-CG2 4.2Å; I136-V395 HydrophobicContact CG2-CG2 4.37Å; I136-M398 HydrophobicContact CD1-CB 4.35Å; I136-M398 HydrophobicContact CD1-CE 4.22Å
137	G	94.6	Very high	87.2	Confident	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.191	C	C	.	.			trans	113.1	-165.9	-174.6	0	0	0	0	0	112.6	Q158 I159 Y161	G137-Q158 WeakPolarHBondContact O-CG 3.4Å; G137-Q158 PolarHBondContact O-NE2 2.71Å; G137-I159 PolarHBondContact N-O 3.2Å; G137-Y161 VanDerWaalsContact CA-CE1 3.47Å
138	A	93.3	Very high	88.8	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.162	C	C	.	.			cis	-81.3	176.1	-7.5	0	0	0	0	0	111.7	L36 T90 V143 S144 S160 S163	L36-A138 HydrophobicContact CB-CB 4.01Å; L36-A138 HydrophobicContact CD1-CB 4.3Å; T90-A138 HydrophobicContact CG2-CB 4.4Å; A138-V143 HydrophobicContact CB-CB 4.05Å; A138-V143 HydrophobicContact CB-CG1 3.52Å; A138-S144 PolarHBondContact N-OG 2.83Å; A138-S144 PolarHBondContact O-OG 3.21Å; A138-S160 PolarHBondContact O-OG 3.18Å; A138-S163 PolarHBondContact O-OG 3.47Å
139	S	89.9	Confident	90.3	Very high	22 Å²	22	23.3 Å²	23.3	15%	0.154	13%	0.131	C	C	.	.	S	Bend	trans	-77.7	-37.5	179.4	-178.1	0	0	0	0	114.6	R60 A162	R60-S139 PolarHBondContact NH1-OG 2.81Å; S139-A162 CarbonylContact O-C 3.58Å; S139-A162 WeakPolarHBondContact O-CB 3.37Å
140	G	87.1	Confident	91.5	Very high	30 Å²	30	20.8 Å²	20.8	31%	0.309	12%	0.115	S	C	.	.	S	Bend	trans	-96.2	135.2	-174.5	0	0	0	0	0	111.2	S142 V143 S144 S163	G140-S142 VanDerWaalsContact C-N 3.34Å; G140-S142 PolarHBondContact O-N 3.15Å; G140-V143 WeakPolarHBondContact O-CA 3.39Å; G140-V143 WeakPolarHBondContact O-CB 3.17Å; G140-V143 PolarHBondContact O-N 3.37Å; G140-S144 PolarHBondContact O-N 3.1Å; G140-S163 PolarHBondContact O-OG 3.42Å
141	S	91.3	Very high	92.5	Very high	9 Å²	9	19.1 Å²	19.1	6%	0.063	11%	0.107	C	C	.	.	H	α-helix	trans	-57.7	-43.2	-177.1	-57.3	0	0	0	0	113	V143 S144 I145 T164 A165	S141-V143 VanDerWaalsContact C-N 3.31Å; S141-V143 PolarHBondContact O-N 3.29Å; S141-S144 PolarHBondContact O-N 3.08Å; S141-I145 WeakPolarHBondContact O-CB 3.05Å; S141-I145 VanDerWaalsContact O-CG1 3.23Å; S141-I145 WeakPolarHBondContact O-CG1 3.39Å; S141-I145 PolarHBondContact O-N 2.71Å; S141-T164 PolarHBondContact OG-N 3.19Å; S141-A165 PolarHBondContact OG-N 2.75Å
142	S	88.8	Confident	92.9	Very high	38 Å²	38	18.2 Å²	18.2	27%	0.266	10%	0.104	S	C	.	.	H	α-helix	trans	-62.3	-37	175.7	54.1	0	0	0	0	112.9	G140 M146	G140-S142 VanDerWaalsContact C-N 3.34Å; G140-S142 PolarHBondContact O-N 3.15Å; S142-M146 PolarHBondContact O-N 3.4Å
143	V	90.8	Very high	92.9	Very high	4 Å²	4	23.9 Å²	23.9	2%	0.024	13%	0.133	C	C	.	.	H	α-helix	trans	-67.5	-49.2	176.6	-179.4	0	0	0	0	110.2	T90 D94 A97 A138 G140 S141 I145 M146 V147	T90-V143 HydrophobicContact CG2-CG1 4.29Å; D94-V143 HydrophobicContact CB-CG2 4.35Å; A97-V143 HydrophobicContact CB-CG1 3.38Å; A138-V143 HydrophobicContact CB-CB 4.05Å; A138-V143 HydrophobicContact CB-CG1 3.52Å; G140-V143 WeakPolarHBondContact O-CA 3.39Å; G140-V143 WeakPolarHBondContact O-CB 3.17Å; G140-V143 PolarHBondContact O-N 3.37Å; S141-V143 VanDerWaalsContact C-N 3.31Å; S141-V143 PolarHBondContact O-N 3.29Å; V143-I145 VanDerWaalsContact C-N 3.29Å; V143-I145 PolarHBondContact O-N 2.95Å; V143-M146 PolarHBondContact O-N 2.92Å; V143-M146 VanDerWaalsContact O-N 3.15Å; V143-V147 HydrophobicContact CG1-CG2 4.24Å; V143-V147 WeakPolarHBondContact O-CG2 3.22Å; V143-V147 PolarHBondContact O-N 3.26Å
144	S	94.6	Very high	92.8	Very high	0 Å²	0	26.3 Å²	26.3	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-60.6	-38.4	178.2	-69.3	0	0	0	0	112.1	A138 G140 S141 M146 V147 A148 S163	A138-S144 PolarHBondContact N-OG 2.83Å; A138-S144 PolarHBondContact O-OG 3.21Å; G140-S144 PolarHBondContact O-N 3.1Å; S141-S144 PolarHBondContact O-N 3.08Å; S144-M146 PolarHBondContact O-N 2.94Å; S144-V147 PolarHBondContact O-N 2.76Å; S144-A148 WeakPolarHBondContact O-CB 3.43Å; S144-A148 PolarHBondContact O-N 2.88Å; S144-S163 WeakPolarHBondContact CB-OG 3.18Å; S144-S163 PolarHBondContact OG-OG 3.48Å
145	I	93.4	Very high	92.7	Very high	7 Å²	7	27.5 Å²	27.5	4%	0.036	15%	0.152	C	C	.	.	H	α-helix	trans	-60.6	-44.7	174.9	-73.2	167.1	0	0	0	111.3	S141 V143 N149 L168 Y174 N211	S141-I145 WeakPolarHBondContact O-CB 3.05Å; S141-I145 VanDerWaalsContact O-CG1 3.23Å; S141-I145 WeakPolarHBondContact O-CG1 3.39Å; S141-I145 PolarHBondContact O-N 2.71Å; V143-I145 VanDerWaalsContact C-N 3.29Å; V143-I145 PolarHBondContact O-N 2.95Å; I145-N149 PolarHBondContact O-N 2.89Å; I145-N149 PolarHBondContact O-ND2 3.37Å; I145-L168 HydrophobicContact CD1-CG 4.46Å; I145-L168 HydrophobicContact CG1-CD1 4.22Å; I145-L168 HydrophobicContact CG1-CD2 3.6Å; I145-L168 HydrophobicContact CG1-CG 3.83Å; I145-Y174 HydrophobicContact CG2-CE1 4.31Å; I145-Y174 WeakPolarHBondContact CG2-OH 3.43Å; I145-N211 HydrophobicContact CD1-CB 3.75Å; I145-N211 WeakPolarHBondContact CD1-ND2 3.41Å
146	M	92.5	Very high	92.6	Very high	68 Å²	68	27.8 Å²	27.8	34%	0.335	15%	0.153	S	C	.	.	H	α-helix	trans	-66.7	-44.7	177.7	-72.2	-62.2	98.8	0	0	112.2	D94 L98 S142 V143 S144 N149	D94-M146 HydrophobicContact CB-CG 3.97Å; L98-M146 HydrophobicContact CB-CB 4.48Å; L98-M146 HydrophobicContact CD1-CB 4.46Å; S142-M146 PolarHBondContact O-N 3.4Å; V143-M146 PolarHBondContact O-N 2.92Å; V143-M146 VanDerWaalsContact O-N 3.15Å; S144-M146 PolarHBondContact O-N 2.94Å; M146-N149 PolarHBondContact O-N 3.26Å
147	V	93.7	Very high	92.6	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-68.1	-44.6	-178.6	173	0	0	0	0	111.6	L36 S101 V143 S144 N149 V150 L151	L36-V147 HydrophobicContact CD1-CB 4.31Å; L36-V147 HydrophobicContact CD1-CG1 3.64Å; L36-V147 HydrophobicContact CD1-CG2 3.98Å; S101-V147 WeakPolarHBondContact OG-CG2 3.11Å; V143-V147 HydrophobicContact CG1-CG2 4.24Å; V143-V147 WeakPolarHBondContact O-CG2 3.22Å; V143-V147 PolarHBondContact O-N 3.26Å; S144-V147 PolarHBondContact O-N 2.76Å; V147-N149 PolarHBondContact O-N 3.38Å; V147-V150 PolarHBondContact O-N 3.15Å; V147-L151 HydrophobicContact CG1-CD1 3.58Å; V147-L151 HydrophobicContact CG1-CG 3.86Å; V147-L151 PolarHBondContact O-N 3.32Å
148	A	94.5	Very high	92.7	Very high	7 Å²	7	27.9 Å²	27.9	6%	0.058	15%	0.153	C	C	.	.	H	α-helix	trans	-58.9	-35.5	179.6	0	0	0	0	0	112.1	S144 V150 L151 R152 Y174 F177	S144-A148 WeakPolarHBondContact O-CB 3.43Å; S144-A148 PolarHBondContact O-N 2.88Å; A148-V150 PolarHBondContact O-N 3.34Å; A148-L151 PolarHBondContact O-N 3.21Å; A148-R152 WeakPolarHBondContact O-CB 3.29Å; A148-R152 WeakPolarHBondContact O-CG 3.31Å; A148-R152 PolarHBondContact O-N 3.49Å; A148-Y174 HydrophobicContact CB-CD1 3.99Å; A148-F177 HydrophobicContact CB-CD2 4.4Å
149	N	92	Very high	92.9	Very high	45 Å²	45	27.9 Å²	27.9	24%	0.241	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-27.8	175.9	-80.6	-37.7	0	0	0	113.7	I145 M146 V147 R152	I145-N149 PolarHBondContact O-N 2.89Å; I145-N149 PolarHBondContact O-ND2 3.37Å; M146-N149 PolarHBondContact O-N 3.26Å; V147-N149 PolarHBondContact O-N 3.38Å; N149-R152 WeakPolarHBondContact O-CG 3.46Å; N149-R152 PolarHBondContact O-NE 2.74Å
150	V	91.4	Very high	93.2	Very high	21 Å²	21	26.9 Å²	26.9	13%	0.127	15%	0.146	C	C	.	.	H	α-helix	trans	-86.1	-49.3	174.2	174.4	0	0	0	0	110.7	L98 L102 V147 A148 R152 L153 F154	L98-V150 HydrophobicContact CD1-CB 4.43Å; L98-V150 HydrophobicContact CD1-CG2 3.33Å; L102-V150 HydrophobicContact CD2-CG1 4.19Å; V147-V150 PolarHBondContact O-N 3.15Å; A148-V150 PolarHBondContact O-N 3.34Å; V150-R152 VanDerWaalsContact C-N 3.27Å; V150-R152 PolarHBondContact O-N 3Å; V150-L153 WeakPolarHBondContact O-CB 3.27Å; V150-L153 PolarHBondContact O-N 3.39Å; V150-F154 HydrophobicContact CG1-CE2 4.46Å; V150-F154 WeakPolarHBondContact O-CD2 3.38Å
151	L	93.3	Very high	93.6	Very high	2 Å²	2	25.4 Å²	25.4	1%	0.01	13%	0.132	C	C	.	.	H	α-helix	trans	-60	-36.6	-176.1	-66.4	-177.3	0	0	0	112.5	V135 V147 A148 L153 F154 A155 I156 Q158	V135-L151 HydrophobicContact CB-CD1 3.84Å; V135-L151 HydrophobicContact CG1-CD1 4.26Å; V135-L151 HydrophobicContact CG2-CD1 3.7Å; V135-L151 HydrophobicContact CG2-CD2 4.14Å; V147-L151 HydrophobicContact CG1-CD1 3.58Å; V147-L151 HydrophobicContact CG1-CG 3.86Å; V147-L151 PolarHBondContact O-N 3.32Å; A148-L151 PolarHBondContact O-N 3.21Å; L151-L153 PolarHBondContact O-N 3.3Å; L151-F154 CarbonylContact O-C 3.59Å; L151-F154 PolarHBondContact O-N 3.25Å; L151-F154 VanDerWaalsContact O-N 3.1Å; L151-A155 PolarHBondContact O-N 3.38Å; L151-A155 VanDerWaalsContact O-N 3.13Å; L151-I156 HydrophobicContact CB-CB 4.22Å; L151-I156 HydrophobicContact CD2-CB 4.15Å; L151-I156 HydrophobicContact CD2-CD1 4.1Å; L151-I156 HydrophobicContact CD2-CG2 4.22Å; L151-I156 PolarHBondContact O-N 3.44Å; L151-Q158 HydrophobicContact CD1-CB 3.99Å; L151-Q158 HydrophobicContact CD1-CG 4.25Å
152	R	93.2	Very high	93.6	Very high	101 Å²	101	25.2 Å²	25.2	38%	0.381	13%	0.13	S	C	.	.	G	3₁₀ helix	trans	-59.4	-31.8	176.2	74	-177.7	-172.4	150.5	8.2	113.5	A148 N149 V150 F154 A155 R173 F176	A148-R152 WeakPolarHBondContact O-CB 3.29Å; A148-R152 WeakPolarHBondContact O-CG 3.31Å; A148-R152 PolarHBondContact O-N 3.49Å; N149-R152 WeakPolarHBondContact O-CG 3.46Å; N149-R152 PolarHBondContact O-NE 2.74Å; V150-R152 VanDerWaalsContact C-N 3.27Å; V150-R152 PolarHBondContact O-N 3Å; R152-F154 PolarHBondContact O-N 3.48Å; R152-A155 PolarHBondContact O-N 2.93Å; R152-R173 WeakPolarHBondContact CD-O 3.47Å; R152-R173 PolarHBondContact NH1-O 3.26Å; R152-F176 HydrophobicContact CB-CD2 4.05Å
153	L	91.6	Very high	93.8	Very high	127 Å²	127	23.4 Å²	23.4	67%	0.665	12%	0.118	S	C	*	.	G	3₁₀ helix	trans	-67.9	-25.5	-179.8	-62.4	175.2	0	0	0	111.9	V150 L151	V150-L153 WeakPolarHBondContact O-CB 3.27Å; V150-L153 PolarHBondContact O-N 3.39Å; L151-L153 PolarHBondContact O-N 3.3Å
154	F	91.5	Very high	93.9	Very high	72 Å²	72	23.4 Å²	23.4	32%	0.316	12%	0.118	S	C	.	.	G	3₁₀ helix	trans	-107.3	10.7	179	-62.8	-85.1	0	0	0	112.4	V105 L108 I109 V150 L151 R152 I156	V105-F154 HydrophobicContact CB-CD1 4.24Å; V105-F154 HydrophobicContact CB-CD2 3.78Å; V105-F154 HydrophobicContact CB-CE1 4.25Å; V105-F154 HydrophobicContact CB-CE2 3.79Å; V105-F154 HydrophobicContact CB-CG 4Å; V105-F154 HydrophobicContact CB-CZ 4.02Å; V105-F154 HydrophobicContact CG1-CB 4.11Å; V105-F154 HydrophobicContact CG1-CD1 4.44Å; V105-F154 HydrophobicContact CG1-CD2 3.4Å; V105-F154 HydrophobicContact CG1-CE2 3.86Å; V105-F154 HydrophobicContact CG1-CG 3.73Å; V105-F154 HydrophobicContact CG2-CD2 4.25Å; V105-F154 HydrophobicContact CG2-CE2 3.81Å; V105-F154 HydrophobicContact CG2-CZ 4.08Å; L108-F154 HydrophobicContact CB-CD1 4.06Å; L108-F154 HydrophobicContact CD1-CB 3.83Å; L108-F154 HydrophobicContact CD1-CD1 4.11Å; L108-F154 HydrophobicContact CD1-CG 4.28Å; I109-F154 HydrophobicContact CD1-CZ 4.23Å; I109-F154 HydrophobicContact CG1-CE1 3.98Å; I109-F154 HydrophobicContact CG1-CZ 4.11Å; V150-F154 HydrophobicContact CG1-CE2 4.46Å; V150-F154 WeakPolarHBondContact O-CD2 3.38Å; L151-F154 CarbonylContact O-C 3.59Å; L151-F154 PolarHBondContact O-N 3.25Å; L151-F154 VanDerWaalsContact O-N 3.1Å; R152-F154 PolarHBondContact O-N 3.48Å; F154-I156 HydrophobicContact CB-CD1 4.18Å; F154-I156 HydrophobicContact CB-CG1 4.13Å; F154-I156 PolarHBondContact O-N 3.13Å
155	A	93.9	Very high	93.8	Very high	24 Å²	24	23.4 Å²	23.4	20%	0.198	12%	0.118	C	C	.	.	T	Hydrogen-bonded Turn	trans	54.4	34.1	-178.3	0	0	0	0	0	114.3	L151 R152 P157 F176 G425 R426	L151-A155 PolarHBondContact O-N 3.38Å; L151-A155 VanDerWaalsContact O-N 3.13Å; R152-A155 PolarHBondContact O-N 2.93Å; A155-P157 WeakPolarHBondContact O-CD 3.33Å; A155-F176 HydrophobicContact CB-CE1 3.65Å; A155-F176 HydrophobicContact CB-CE2 4.32Å; A155-F176 HydrophobicContact CB-CZ 3.52Å; A155-F176 WeakPolarHBondContact O-CE1 3.18Å; A155-G425 CarbonylContact O-C 3.57Å; A155-G425 VanDerWaalsContact O-CA 3.23Å; A155-G425 WeakPolarHBondContact O-CA 3.48Å; A155-R426 HydrophobicContact CB-CG 4.26Å
156	I	95.6	Very high	93.7	Very high	6 Å²	6	24.5 Å²	24.5	3%	0.031	13%	0.126	C	C	.	.			trans	-90.5	115.9	178.2	-59	176.3	0	0	0	109	V105 L108 V135 L151 F154	V105-I156 HydrophobicContact CG1-CD1 3.91Å; L108-I156 HydrophobicContact CD1-CD1 3.88Å; L108-I156 HydrophobicContact CD1-CG1 4.31Å; V135-I156 HydrophobicContact CG2-CG2 4.04Å; L151-I156 HydrophobicContact CB-CB 4.22Å; L151-I156 HydrophobicContact CD2-CB 4.15Å; L151-I156 HydrophobicContact CD2-CD1 4.1Å; L151-I156 HydrophobicContact CD2-CG2 4.22Å; L151-I156 PolarHBondContact O-N 3.44Å; F154-I156 HydrophobicContact CB-CD1 4.18Å; F154-I156 HydrophobicContact CB-CG1 4.13Å; F154-I156 PolarHBondContact O-N 3.13Å
157	P	96.9	Very high	93.6	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.124	C	C	.	.			trans	-67.6	142.7	176.3	27.2	-33.6	0	0	0	111.9	V133 G134 V135 A155 F176 L428 L429 I432	V133-P157 WeakPolarHBondContact O-CD 3.44Å; G134-P157 CarbonylContact C-O 3.52Å; G134-P157 VanDerWaalsContact CA-O 3.3Å; G134-P157 WeakPolarHBondContact CA-O 3.44Å; V135-P157 PolarHBondContact N-O 3.23Å; A155-P157 WeakPolarHBondContact O-CD 3.33Å; P157-F176 WeakPolarHBondContact CA-O 3.48Å; P157-L428 HydrophobicContact CG-CB 4.43Å; P157-L428 HydrophobicContact CG-CD2 3.8Å; P157-L428 HydrophobicContact CG-CG 4.09Å; P157-L429 HydrophobicContact CB-CD1 4.29Å; P157-I432 HydrophobicContact CB-CD1 3.67Å; P157-I432 HydrophobicContact CG-CD1 3.86Å
158	Q	97.3	Very high	93.6	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.009	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	125.3	-180	-178.8	-172.3	-24.5	0	0	110.1	V135 G137 L151 F176 F177 S178	V135-Q158 HydrophobicContact CB-CG 4.42Å; V135-Q158 CarbonylContact O-C 3.54Å; V135-Q158 VanDerWaalsContact O-CA 3.29Å; V135-Q158 WeakPolarHBondContact O-CA 3.27Å; G137-Q158 WeakPolarHBondContact O-CG 3.4Å; G137-Q158 PolarHBondContact O-NE2 2.71Å; L151-Q158 HydrophobicContact CD1-CB 3.99Å; L151-Q158 HydrophobicContact CD1-CG 4.25Å; Q158-F176 PolarHBondContact N-O 2.97Å; Q158-F177 HydrophobicContact CB-CD2 4.47Å; Q158-F177 HydrophobicContact CG-CD2 4.29Å; Q158-S178 PolarHBondContact O-N 3.32Å
159	I	97.8	Very high	93.6	Very high	1 Å²	1	25 Å²	25	1%	0.005	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	109.9	172.5	-52.4	-179.5	0	0	0	109.3	V135 I136 G137 S178 V180 A394 A397 M398 I432 F453	V135-I159 PolarHBondContact O-N 3.27Å; I136-I159 WeakPolarHBondContact CA-O 3.44Å; I136-I159 HydrophobicContact CD1-CB 4.16Å; G137-I159 PolarHBondContact N-O 3.2Å; I159-S178 CarbonylContact C-O 3.45Å; I159-S178 VanDerWaalsContact CA-O 3.28Å; I159-S178 WeakPolarHBondContact CA-O 3.33Å; I159-V180 HydrophobicContact CG2-CG1 4.03Å; I159-A394 HydrophobicContact CB-CB 4.45Å; I159-A394 HydrophobicContact CG2-CB 3.75Å; I159-A397 HydrophobicContact CD1-CB 4.22Å; I159-M398 HydrophobicContact CD1-CB 4.44Å; I159-M398 HydrophobicContact CD1-CE 3.8Å; I159-M398 HydrophobicContact CG1-CE 3.99Å; I159-I432 HydrophobicContact CD1-CD1 4.21Å; I159-I432 HydrophobicContact CD1-CG1 4.29Å; I159-I432 HydrophobicContact CD1-CG2 3.73Å; I159-I432 HydrophobicContact CG1-CG2 4.19Å; I159-F453 HydrophobicContact CG2-CZ 4.38Å
160	S	97.1	Very high	93.6	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	139.6	176	-174.9	0	0	0	0	112.1	A138 A162 S163 S178 R179 V180	A138-S160 PolarHBondContact O-OG 3.18Å; S160-A162 PolarHBondContact OG-N 3.3Å; S160-S163 VanDerWaalsContact OG-CB 3.25Å; S160-S163 WeakPolarHBondContact OG-CB 3.28Å; S160-S163 PolarHBondContact OG-N 3.27Å; S160-S163 PolarHBondContact OG-OG 2.81Å; S160-S163 VanDerWaalsContact OG-OG 3.11Å; S160-S178 PolarHBondContact N-O 3.07Å; S160-R179 VanDerWaalsContact O-CA 3.22Å; S160-R179 WeakPolarHBondContact O-CA 3.33Å; S160-R179 VanDerWaalsContact O-CB 3.31Å; S160-R179 WeakPolarHBondContact O-CB 3.16Å; S160-V180 PolarHBondContact O-N 3.35Å; S160-V180 VanDerWaalsContact O-N 3.16Å
161	Y	94.3	Very high	93.6	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	S	Bend	trans	-97.6	-3.3	176.1	58.3	-99.3	0	0	0	113.6	L36 F37 I136 G137 V181 F390 V391	L36-Y161 PolarHBondContact O-OH 3.43Å; F37-Y161 AromaticContact CD1-CE1 3.99Å; F37-Y161 HydrophobicContact CD1-CE1 3.99Å; F37-Y161 AromaticContact CD1-CZ 3.76Å; F37-Y161 WeakPolarHBondContact CD1-OH 3.43Å; F37-Y161 HydrophobicContact CE1-CD1 4.43Å; F37-Y161 AromaticContact CE1-CE1 3.6Å; F37-Y161 HydrophobicContact CE1-CE1 3.6Å; F37-Y161 AromaticContact CE1-CZ 3.78Å; F37-Y161 HydrophobicContact CZ-CE1 4.3Å; I136-Y161 HydrophobicContact CG2-CD1 4.02Å; G137-Y161 VanDerWaalsContact CA-CE1 3.47Å; Y161-V181 VanDerWaalsContact O-CG1 3.24Å; Y161-V181 WeakPolarHBondContact O-CG1 3.36Å; Y161-F390 WeakPolarHBondContact O-CB 3.5Å; Y161-V391 HydrophobicContact CD1-CG2 3.96Å; Y161-V391 HydrophobicContact CD2-CG2 3.61Å; Y161-V391 HydrophobicContact CE1-CG2 4.34Å; Y161-V391 HydrophobicContact CE2-CG2 4.05Å; Y161-V391 HydrophobicContact CG-CG2 3.58Å
162	A	92.3	Very high	93.5	Very high	4 Å²	4	31.7 Å²	31.7	3%	0.033	17%	0.171	C	C	.	.	S	Bend	trans	-154.5	-5.4	-173.5	0	0	0	0	0	116.7	S139 S160 T164 K387	S139-A162 CarbonylContact O-C 3.58Å; S139-A162 WeakPolarHBondContact O-CB 3.37Å; S160-A162 PolarHBondContact OG-N 3.3Å; A162-T164 PolarHBondContact O-N 3.09Å; A162-K387 HydrophobicContact CB-CD 3.55Å
163	S	92.6	Very high	93.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	17%	0.173	C	C	.	.			trans	-85.3	111.1	-179.8	-61.2	0	0	0	0	111.4	A138 G140 S144 S160 R179	A138-S163 PolarHBondContact O-OG 3.47Å; G140-S163 PolarHBondContact O-OG 3.42Å; S144-S163 WeakPolarHBondContact CB-OG 3.18Å; S144-S163 PolarHBondContact OG-OG 3.48Å; S160-S163 VanDerWaalsContact OG-CB 3.25Å; S160-S163 WeakPolarHBondContact OG-CB 3.28Å; S160-S163 PolarHBondContact OG-N 3.27Å; S160-S163 PolarHBondContact OG-OG 2.81Å; S160-S163 VanDerWaalsContact OG-OG 3.11Å; S163-R179 WeakPolarHBondContact O-CD 3.47Å; S163-R179 PolarHBondContact O-NH1 3.29Å
164	T	92.9	Very high	93.6	Very high	4 Å²	4	26.5 Å²	26.5	3%	0.025	14%	0.142	C	C	.	.			trans	-109.6	0.4	-169	57	0	0	0	0	114.3	S141 A162 R179 V181 P183 D184 Y212	S141-T164 PolarHBondContact OG-N 3.19Å; A162-T164 PolarHBondContact O-N 3.09Å; T164-R179 VanDerWaalsContact CA-NH1 3.26Å; T164-R179 PolarHBondContact O-NH1 2.99Å; T164-R179 VanDerWaalsContact O-NH1 3.13Å; T164-V181 HydrophobicContact CG2-CB 4.31Å; T164-V181 HydrophobicContact CG2-CG2 3.81Å; T164-P183 CarbonylContact O-C 3.57Å; T164-P183 WeakPolarHBondContact O-CA 3.26Å; T164-D184 VanDerWaalsContact C-OD2 3.23Å; T164-D184 WeakPolarHBondContact CB-OD1 3.2Å; T164-D184 PolarHBondContact O-N 2.95Å; T164-D184 VanDerWaalsContact OG1-CG 3.27Å; T164-D184 PolarHBondContact OG1-OD1 2.83Å; T164-D184 PolarHBondContact OG1-OD2 3.41Å; T164-Y212 WeakPolarHBondContact OG1-CE2 3.12Å
165	A	91.5	Very high	93.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	15%	0.148	C	C	.	.			trans	-55.1	135.5	-179.7	0	0	0	0	0	112.4	S141 E167 L168 R179 D184 N211	S141-A165 PolarHBondContact OG-N 2.75Å; A165-E167 VanDerWaalsContact C-N 3.29Å; A165-E167 PolarHBondContact O-N 3.29Å; A165-L168 HydrophobicContact CB-CD1 4.33Å; A165-L168 PolarHBondContact O-N 3.16Å; A165-R179 PolarHBondContact O-NH1 3.36Å; A165-D184 PolarHBondContact N-OD2 3.13Å; A165-N211 VanDerWaalsContact CB-O 3.27Å; A165-N211 WeakPolarHBondContact CB-O 3.35Å
166	P	91.8	Very high	93.8	Very high	31 Å²	31	26.9 Å²	26.9	20%	0.201	14%	0.141	C	C	.	.	G	3₁₀ helix	trans	-64	-30.5	-178.4	-24.3	34.8	0	0	0	114	L168 S169 D184	P166-L168 PolarHBondContact O-N 3.1Å; P166-L168 VanDerWaalsContact O-N 3.17Å; P166-S169 WeakPolarHBondContact O-CB 3.25Å; P166-S169 PolarHBondContact O-N 2.85Å; P166-S169 VanDerWaalsContact O-N 3.09Å; P166-D184 HydrophobicContact CG-CB 4.08Å
167	E	90.8	Very high	93.8	Very high	66 Å²	66	26.7 Å²	26.7	31%	0.308	14%	0.14	S	C	.	.	G	3₁₀ helix	trans	-60.4	-26.6	-179.1	-67.4	165.2	-148.7	0	0	113.4	A165 S169 D170 Y174 N211 S215	A165-E167 VanDerWaalsContact C-N 3.29Å; A165-E167 PolarHBondContact O-N 3.29Å; E167-S169 PolarHBondContact O-N 3.41Å; E167-D170 WeakPolarHBondContact O-CB 3.41Å; E167-D170 PolarHBondContact O-N 3.18Å; E167-Y174 VanDerWaalsContact O-CD2 3.25Å; E167-Y174 WeakPolarHBondContact O-CD2 3.19Å; E167-Y174 VanDerWaalsContact O-CE2 3.31Å; E167-Y174 WeakPolarHBondContact O-CE2 3.28Å; E167-N211 PolarHBondContact OE2-ND2 2.75Å; E167-S215 PolarHBondContact OE1-OG 3.49Å
168	L	93.4	Very high	93.8	Very high	1 Å²	1	26.8 Å²	26.8	1%	0.005	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-71.4	-13.8	179.3	-75.1	165.4	0	0	0	113.4	I145 A165 P166 D170 Y174 F177	I145-L168 HydrophobicContact CD1-CG 4.46Å; I145-L168 HydrophobicContact CG1-CD1 4.22Å; I145-L168 HydrophobicContact CG1-CD2 3.6Å; I145-L168 HydrophobicContact CG1-CG 3.83Å; A165-L168 HydrophobicContact CB-CD1 4.33Å; A165-L168 PolarHBondContact O-N 3.16Å; P166-L168 PolarHBondContact O-N 3.1Å; P166-L168 VanDerWaalsContact O-N 3.17Å; L168-D170 VanDerWaalsContact C-N 3.27Å; L168-Y174 HydrophobicContact CD2-CD1 4.23Å; L168-Y174 HydrophobicContact CD2-CD2 4.36Å; L168-Y174 HydrophobicContact CD2-CE1 4.43Å; L168-Y174 HydrophobicContact CD2-CG 4.2Å; L168-F177 HydrophobicContact CB-CD1 3.88Å; L168-F177 HydrophobicContact CB-CE1 3.64Å; L168-F177 HydrophobicContact CB-CZ 4.24Å; L168-F177 HydrophobicContact CD1-CE1 4.02Å; L168-F177 HydrophobicContact CD1-CE2 4.31Å; L168-F177 HydrophobicContact CD1-CZ 3.74Å; L168-F177 HydrophobicContact CD2-CD1 4.23Å; L168-F177 HydrophobicContact CD2-CD2 4.19Å; L168-F177 HydrophobicContact CD2-CE1 4.24Å; L168-F177 HydrophobicContact CD2-CE2 4.18Å; L168-F177 HydrophobicContact CD2-CG 4.22Å; L168-F177 HydrophobicContact CD2-CZ 4.21Å; L168-F177 HydrophobicContact CG-CE1 4.18Å; L168-F177 HydrophobicContact CG-CZ 4.29Å
169	S	93.6	Very high	93.8	Very high	18 Å²	18	26.7 Å²	26.7	13%	0.126	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-78.9	-8.6	173.6	-60.4	0	0	0	0	113.1	P166 E167 N171 R179 D458	P166-S169 WeakPolarHBondContact O-CB 3.25Å; P166-S169 PolarHBondContact O-N 2.85Å; P166-S169 VanDerWaalsContact O-N 3.09Å; E167-S169 PolarHBondContact O-N 3.41Å; S169-N171 PolarHBondContact O-N 3.38Å; S169-R179 PolarHBondContact OG-NH2 2.86Å; S169-D458 WeakPolarHBondContact CB-OD2 3.36Å; S169-D458 VanDerWaalsContact OG-CG 3.3Å; S169-D458 PolarHBondContact OG-OD1 2.88Å; S169-D458 PolarHBondContact OG-OD2 2.86Å
170	D	93.8	Very high	93.6	Very high	62 Å²	62	27.1 Å²	27.1	33%	0.332	14%	0.143	S	C	.	.			trans	-75.4	93.1	178.4	-178.8	2.4	0	0	0	110.9	E167 L168 S172 R173 Y174	E167-D170 WeakPolarHBondContact O-CB 3.41Å; E167-D170 PolarHBondContact O-N 3.18Å; L168-D170 VanDerWaalsContact C-N 3.27Å; D170-S172 VanDerWaalsContact CG-OG 3.27Å; D170-S172 PolarHBondContact O-N 2.96Å; D170-S172 VanDerWaalsContact O-N 3.11Å; D170-S172 VanDerWaalsContact OD1-CB 3.3Å; D170-S172 WeakPolarHBondContact OD1-CB 3.17Å; D170-S172 PolarHBondContact OD1-N 3.33Å; D170-S172 PolarHBondContact OD1-OG 3.19Å; D170-S172 PolarHBondContact OD2-OG 3.47Å; D170-R173 PolarHBondContact O-N 3.29Å; D170-R173 WeakPolarHBondContact OD2-CD 3.41Å; D170-R173 WeakPolarHBondContact OD2-CG 3.2Å; D170-Y174 PolarHBondContact O-N 2.86Å
171	N	89.8	Confident	93.3	Very high	46 Å²	46	27.2 Å²	27.2	25%	0.246	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-24.6	177.4	-85.6	-26.4	0	0	0	114.2	S169 R173 E175 R433 E455 N456	S169-N171 PolarHBondContact O-N 3.38Å; N171-R173 PolarHBondContact O-N 3.27Å; N171-E175 WeakPolarHBondContact O-CA 3.4Å; N171-E175 PolarHBondContact O-N 3.13Å; N171-R433 PolarHBondContact OD1-NH2 3.23Å; N171-E455 PolarHBondContact ND2-O 3.04Å; N171-N456 PolarHBondContact ND2-OD1 2.99Å
172	S	91.4	Very high	93.2	Very high	101 Å²	101	27.6 Å²	27.6	71%	0.706	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.9	-24.7	177.8	76.6	0	0	0	0	112.5	D170	D170-S172 VanDerWaalsContact CG-OG 3.27Å; D170-S172 PolarHBondContact O-N 2.96Å; D170-S172 VanDerWaalsContact O-N 3.11Å; D170-S172 VanDerWaalsContact OD1-CB 3.3Å; D170-S172 WeakPolarHBondContact OD1-CB 3.17Å; D170-S172 PolarHBondContact OD1-N 3.33Å; D170-S172 PolarHBondContact OD1-OG 3.19Å; D170-S172 PolarHBondContact OD2-OG 3.47Å
173	R	92.1	Very high	93.3	Very high	114 Å²	114	27.5 Å²	27.5	43%	0.43	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-106.6	-39.1	-179	-66.1	178.3	64.8	-162.6	-4.5	112.4	R152 D170 N171	R152-R173 WeakPolarHBondContact CD-O 3.47Å; R152-R173 PolarHBondContact NH1-O 3.26Å; D170-R173 PolarHBondContact O-N 3.29Å; D170-R173 WeakPolarHBondContact OD2-CD 3.41Å; D170-R173 WeakPolarHBondContact OD2-CG 3.2Å; N171-R173 PolarHBondContact O-N 3.27Å
174	Y	94.3	Very high	93.3	Very high	5 Å²	5	27.5 Å²	27.5	2%	0.02	15%	0.145	C	C	.	.			trans	-121.6	45.1	-171.2	-54.4	-70.4	0	0	0	112.5	I145 A148 E167 L168 D170 F176 F177	I145-Y174 HydrophobicContact CG2-CE1 4.31Å; I145-Y174 WeakPolarHBondContact CG2-OH 3.43Å; A148-Y174 HydrophobicContact CB-CD1 3.99Å; E167-Y174 VanDerWaalsContact O-CD2 3.25Å; E167-Y174 WeakPolarHBondContact O-CD2 3.19Å; E167-Y174 VanDerWaalsContact O-CE2 3.31Å; E167-Y174 WeakPolarHBondContact O-CE2 3.28Å; L168-Y174 HydrophobicContact CD2-CD1 4.23Å; L168-Y174 HydrophobicContact CD2-CD2 4.36Å; L168-Y174 HydrophobicContact CD2-CE1 4.43Å; L168-Y174 HydrophobicContact CD2-CG 4.2Å; D170-Y174 PolarHBondContact O-N 2.86Å; Y174-F176 PolarHBondContact O-N 3.36Å; Y174-F176 VanDerWaalsContact O-N 3.1Å; Y174-F177 WeakPolarHBondContact O-CB 3.23Å; Y174-F177 PolarHBondContact O-N 3.22Å
175	E	94.1	Very high	93.3	Very high	93 Å²	93	29.3 Å²	29.3	44%	0.435	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-47.8	-40.6	-177.9	-174.5	-175.5	-178	0	0	114.5	N171 F177 L429 R433	N171-E175 WeakPolarHBondContact O-CA 3.4Å; N171-E175 PolarHBondContact O-N 3.13Å; E175-F177 VanDerWaalsContact C-N 3.31Å; E175-F177 PolarHBondContact O-N 3.36Å; E175-L429 HydrophobicContact CG-CD2 4.45Å; E175-L429 WeakPolarHBondContact O-CD2 3.42Å; E175-R433 PolarHBondContact O-NH2 3.42Å
176	F	95.9	Very high	93.4	Very high	11 Å²	11	33 Å²	33	5%	0.048	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.5	8.7	-177.2	-71.5	-90.6	0	0	0	114.2	R152 A155 P157 Q158 Y174 R426 L429	R152-F176 HydrophobicContact CB-CD2 4.05Å; A155-F176 HydrophobicContact CB-CE1 3.65Å; A155-F176 HydrophobicContact CB-CE2 4.32Å; A155-F176 HydrophobicContact CB-CZ 3.52Å; A155-F176 WeakPolarHBondContact O-CE1 3.18Å; P157-F176 WeakPolarHBondContact CA-O 3.48Å; Q158-F176 PolarHBondContact N-O 2.97Å; Y174-F176 PolarHBondContact O-N 3.36Å; Y174-F176 VanDerWaalsContact O-N 3.1Å; F176-R426 HydrophobicContact CE1-CG 3.82Å; F176-R426 HydrophobicContact CZ-CG 3.52Å; F176-L429 HydrophobicContact CD1-CD2 3.97Å; F176-L429 HydrophobicContact CE1-CD2 4.23Å; F176-L429 HydrophobicContact CG-CD2 4.38Å
177	F	97.3	Very high	93.5	Very high	2 Å²	2	31.6 Å²	31.6	1%	0.009	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	140.3	179.2	-173.9	-94.4	0	0	0	111	A148 Q158 L168 Y174 E175 R179	A148-F177 HydrophobicContact CB-CD2 4.4Å; Q158-F177 HydrophobicContact CB-CD2 4.47Å; Q158-F177 HydrophobicContact CG-CD2 4.29Å; L168-F177 HydrophobicContact CB-CD1 3.88Å; L168-F177 HydrophobicContact CB-CE1 3.64Å; L168-F177 HydrophobicContact CB-CZ 4.24Å; L168-F177 HydrophobicContact CD1-CE1 4.02Å; L168-F177 HydrophobicContact CD1-CE2 4.31Å; L168-F177 HydrophobicContact CD1-CZ 3.74Å; L168-F177 HydrophobicContact CD2-CD1 4.23Å; L168-F177 HydrophobicContact CD2-CD2 4.19Å; L168-F177 HydrophobicContact CD2-CE1 4.24Å; L168-F177 HydrophobicContact CD2-CE2 4.18Å; L168-F177 HydrophobicContact CD2-CG 4.22Å; L168-F177 HydrophobicContact CD2-CZ 4.21Å; L168-F177 HydrophobicContact CG-CE1 4.18Å; L168-F177 HydrophobicContact CG-CZ 4.29Å; Y174-F177 WeakPolarHBondContact O-CB 3.23Å; Y174-F177 PolarHBondContact O-N 3.22Å; E175-F177 VanDerWaalsContact C-N 3.31Å; E175-F177 PolarHBondContact O-N 3.36Å; F177-R179 HydrophobicContact CE1-CB 4.09Å; F177-R179 HydrophobicContact CE1-CG 4.09Å; F177-R179 HydrophobicContact CZ-CB 4.27Å
178	S	96.8	Very high	93.7	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.007	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	162	169.9	-62	0	0	0	0	109.3	Q158 I159 S160 G457	Q158-S178 PolarHBondContact O-N 3.32Å; I159-S178 CarbonylContact C-O 3.45Å; I159-S178 VanDerWaalsContact CA-O 3.28Å; I159-S178 WeakPolarHBondContact CA-O 3.33Å; S160-S178 PolarHBondContact N-O 3.07Å; S178-G457 CarbonylContact C-O 3.47Å; S178-G457 WeakPolarHBondContact CA-O 3.2Å; S178-G457 WeakPolarHBondContact CB-O 3.1Å
179	R	95.6	Very high	93.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	143	179.7	57.5	175.2	174.6	-152.9	-12.9	113	S160 S163 T164 A165 S169 F177 V181 F453 G457 D458 A459	S160-R179 VanDerWaalsContact O-CA 3.22Å; S160-R179 WeakPolarHBondContact O-CA 3.33Å; S160-R179 VanDerWaalsContact O-CB 3.31Å; S160-R179 WeakPolarHBondContact O-CB 3.16Å; S163-R179 WeakPolarHBondContact O-CD 3.47Å; S163-R179 PolarHBondContact O-NH1 3.29Å; T164-R179 VanDerWaalsContact CA-NH1 3.26Å; T164-R179 PolarHBondContact O-NH1 2.99Å; T164-R179 VanDerWaalsContact O-NH1 3.13Å; A165-R179 PolarHBondContact O-NH1 3.36Å; S169-R179 PolarHBondContact OG-NH2 2.86Å; F177-R179 HydrophobicContact CE1-CB 4.09Å; F177-R179 HydrophobicContact CE1-CG 4.09Å; F177-R179 HydrophobicContact CZ-CB 4.27Å; R179-V181 VanDerWaalsContact C-N 3.26Å; R179-V181 HydrophobicContact CB-CG2 4.29Å; R179-V181 WeakPolarHBondContact CD-O 3.46Å; R179-V181 VanDerWaalsContact CG-O 3.3Å; R179-V181 WeakPolarHBondContact CG-O 3.44Å; R179-V181 PolarHBondContact NE-O 3.22Å; R179-V181 PolarHBondContact O-N 2.91Å; R179-F453 WeakPolarHBondContact O-CE1 3.43Å; R179-G457 PolarHBondContact N-O 2.87Å; R179-D458 IonicContact CZ-OD1 2.67Å; R179-D458 IonicContact NE-OD1 2.69Å; R179-D458 PolarHBondContact NE-OD1 2.94Å; R179-D458 IonicContact NH2-OD1 3.3Å; R179-D458 PolarHBondContact NH2-OD1 2.96Å; R179-D458 IonicContact NH2-OD2 3.83Å; R179-A459 PolarHBondContact O-N 3.28Å; R179-A459 VanDerWaalsContact O-N 3.14Å
180	V	93.4	Very high	93.9	Very high	11 Å²	11	30.3 Å²	30.3	7%	0.067	16%	0.155	C	C	.	.	S	Bend	trans	-87.9	3.9	178.1	-62	0	0	0	0	113	I159 S160 F390 A394 V451 F453 A459	I159-V180 HydrophobicContact CG2-CG1 4.03Å; S160-V180 PolarHBondContact O-N 3.35Å; S160-V180 VanDerWaalsContact O-N 3.16Å; V180-F390 HydrophobicContact CG2-CB 3.93Å; V180-F390 HydrophobicContact CG2-CD1 4.4Å; V180-F390 VanDerWaalsContact CG2-O 3.26Å; V180-F390 WeakPolarHBondContact CG2-O 3.27Å; V180-A394 HydrophobicContact CG1-CB 4.25Å; V180-A394 HydrophobicContact CG2-CB 4.12Å; V180-V451 HydrophobicContact CG1-CG1 4.17Å; V180-F453 HydrophobicContact CG1-CE1 4.01Å; V180-F453 HydrophobicContact CG1-CZ 3.9Å; V180-A459 WeakPolarHBondContact O-CB 3.33Å
181	V	92.1	Very high	94	Very high	2 Å²	2	27.4 Å²	27.4	1%	0.012	14%	0.139	C	C	.	.	S	Bend	trans	-113.3	145.7	174.6	-66.9	0	0	0	0	110.2	Y161 T164 R179 F390	Y161-V181 VanDerWaalsContact O-CG1 3.24Å; Y161-V181 WeakPolarHBondContact O-CG1 3.36Å; T164-V181 HydrophobicContact CG2-CB 4.31Å; T164-V181 HydrophobicContact CG2-CG2 3.81Å; R179-V181 VanDerWaalsContact C-N 3.26Å; R179-V181 HydrophobicContact CB-CG2 4.29Å; R179-V181 WeakPolarHBondContact CD-O 3.46Å; R179-V181 VanDerWaalsContact CG-O 3.3Å; R179-V181 WeakPolarHBondContact CG-O 3.44Å; R179-V181 PolarHBondContact NE-O 3.22Å; R179-V181 PolarHBondContact O-N 2.91Å; V181-F390 HydrophobicContact CG1-CB 4.1Å; V181-F390 HydrophobicContact CG1-CD1 3.86Å; V181-F390 HydrophobicContact CG1-CD2 3.77Å; V181-F390 HydrophobicContact CG1-CE1 4.24Å; V181-F390 HydrophobicContact CG1-CE2 4.17Å; V181-F390 HydrophobicContact CG1-CG 3.62Å; V181-F390 HydrophobicContact CG1-CZ 4.4Å
182	P	92.6	Very high	94.3	Very high	7 Å²	7	25.2 Å²	25.2	5%	0.045	13%	0.128	C	C	.	.			trans	-71.9	150.5	180	28.5	-35.2	0	0	0	112.8	Y186 Y463	P182-Y186 HydrophobicContact CB-CD2 4.27Å; P182-Y463 HydrophobicContact CG-CE1 4.05Å; P182-Y463 HydrophobicContact CG-CE2 4.4Å; P182-Y463 VanDerWaalsContact CG-OH 3.29Å; P182-Y463 WeakPolarHBondContact CG-OH 3.44Å
183	P	93.4	Very high	94.5	Very high	2 Å²	2	22.2 Å²	22.2	1%	0.013	10%	0.103	C	C	.	.			trans	-60.8	155	171.8	3.3	-11.9	0	0	0	114.5	T164 S185 Y186 Q187 D458 Y463	T164-P183 CarbonylContact O-C 3.57Å; T164-P183 WeakPolarHBondContact O-CA 3.26Å; P183-S185 WeakPolarHBondContact CB-OG 3.34Å; P183-S185 PolarHBondContact O-N 3.1Å; P183-S185 VanDerWaalsContact O-N 3.11Å; P183-Y186 HydrophobicContact CG-CD2 3.67Å; P183-Y186 HydrophobicContact CG-CE2 3.83Å; P183-Y186 PolarHBondContact O-N 2.91Å; P183-Y186 VanDerWaalsContact O-N 3.15Å; P183-Q187 PolarHBondContact O-N 2.82Å; P183-D458 HydrophobicContact CG-CB 4.3Å; P183-Y463 PolarHBondContact O-OH 3.34Å
184	D	92.1	Very high	94.6	Very high	1 Å²	1	16.8 Å²	16.8	1%	0.005	8%	0.083	C	C	.	.	H	α-helix	trans	-63.4	-14.2	171.6	-57.9	-32.1	0	0	0	112.7	T164 A165 P166 Q187 A188 Y212 F266	T164-D184 VanDerWaalsContact C-OD2 3.23Å; T164-D184 WeakPolarHBondContact CB-OD1 3.2Å; T164-D184 PolarHBondContact O-N 2.95Å; T164-D184 VanDerWaalsContact OG1-CG 3.27Å; T164-D184 PolarHBondContact OG1-OD1 2.83Å; T164-D184 PolarHBondContact OG1-OD2 3.41Å; A165-D184 PolarHBondContact N-OD2 3.13Å; P166-D184 HydrophobicContact CG-CB 4.08Å; D184-Q187 WeakPolarHBondContact O-CB 3.49Å; D184-Q187 PolarHBondContact O-N 2.89Å; D184-Q187 PolarHBondContact OD1-OE1 3.43Å; D184-A188 WeakPolarHBondContact O-CB 3.03Å; D184-A188 PolarHBondContact O-N 2.86Å; D184-Y212 WeakPolarHBondContact OD1-CE2 3.42Å; D184-Y212 WeakPolarHBondContact OD2-CD2 3.18Å; D184-F266 HydrophobicContact CB-CE1 4.42Å
185	S	92.6	Very high	94.7	Very high	42 Å²	42	16.5 Å²	16.5	29%	0.294	8%	0.082	S	C	.	.	H	α-helix	trans	-65.5	-41.1	172.7	58.4	0	0	0	0	112.1	P183 Q187 A188 Q189	P183-S185 WeakPolarHBondContact CB-OG 3.34Å; P183-S185 PolarHBondContact O-N 3.1Å; P183-S185 VanDerWaalsContact O-N 3.11Å; S185-Q187 VanDerWaalsContact C-N 3.3Å; S185-A188 PolarHBondContact O-N 3.34Å; S185-Q189 PolarHBondContact O-N 3.18Å
186	Y	93.8	Very high	94.7	Very high	77 Å²	77	15.9 Å²	15.9	30%	0.302	8%	0.078	S	C	.	.	H	α-helix	trans	-68.6	-34.3	172.1	-68.8	-60.1	0	0	0	111.4	P182 P183 Q189 A190 W484	P182-Y186 HydrophobicContact CB-CD2 4.27Å; P183-Y186 HydrophobicContact CG-CD2 3.67Å; P183-Y186 HydrophobicContact CG-CE2 3.83Å; P183-Y186 PolarHBondContact O-N 2.91Å; P183-Y186 VanDerWaalsContact O-N 3.15Å; Y186-Q189 PolarHBondContact O-N 3.41Å; Y186-A190 WeakPolarHBondContact O-CB 3.19Å; Y186-A190 PolarHBondContact O-N 3.08Å; Y186-W484 AromaticContact CD1-CH2 3.96Å; Y186-W484 HydrophobicContact CD1-CH2 3.96Å; Y186-W484 HydrophobicContact CD1-CZ3 4.42Å
187	Q	94.1	Very high	94.6	Very high	1 Å²	1	17.5 Å²	17.5	1%	0.005	9%	0.093	C	C	.	.	H	α-helix	trans	-63.3	-47.3	175.4	-165.9	179.3	35	0	0	111.4	P183 D184 S185 Q189 A190 M191 F266 D294 I316 Y463	P183-Q187 PolarHBondContact O-N 2.82Å; D184-Q187 WeakPolarHBondContact O-CB 3.49Å; D184-Q187 PolarHBondContact O-N 2.89Å; D184-Q187 PolarHBondContact OD1-OE1 3.43Å; S185-Q187 VanDerWaalsContact C-N 3.3Å; Q187-Q189 VanDerWaalsContact C-N 3.32Å; Q187-Q189 PolarHBondContact O-N 2.82Å; Q187-A190 PolarHBondContact O-N 3.13Å; Q187-M191 HydrophobicContact CG-SD 4.44Å; Q187-M191 VanDerWaalsContact O-CG 3.29Å; Q187-M191 WeakPolarHBondContact O-CG 3.35Å; Q187-M191 PolarHBondContact O-N 2.79Å; Q187-F266 HydrophobicContact CG-CE1 4.31Å; Q187-D294 PolarHBondContact NE2-OD1 2.87Å; Q187-I316 HydrophobicContact CB-CD1 4.39Å; Q187-I316 HydrophobicContact CG-CD1 3.23Å; Q187-I316 HydrophobicContact CG-CG1 4.08Å; Q187-Y463 HydrophobicContact CB-CE1 4.39Å; Q187-Y463 HydrophobicContact CG-CE1 4.38Å; Q187-Y463 PolarHBondContact N-OH 3.04Å
188	A	95.3	Very high	94.4	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-60.3	-41.1	175.5	0	0	0	0	0	111.9	D184 S185 M191 L192 A219 F220 I223 F266	D184-A188 WeakPolarHBondContact O-CB 3.03Å; D184-A188 PolarHBondContact O-N 2.86Å; S185-A188 PolarHBondContact O-N 3.34Å; A188-M191 PolarHBondContact O-N 3.38Å; A188-L192 WeakPolarHBondContact O-CB 3.43Å; A188-L192 PolarHBondContact O-N 2.81Å; A188-A219 HydrophobicContact CB-CB 4.05Å; A188-F220 HydrophobicContact CB-CB 3.98Å; A188-I223 HydrophobicContact CB-CD1 4.11Å; A188-F266 HydrophobicContact CB-CZ 4.27Å
189	Q	95.1	Very high	94.1	Very high	59 Å²	59	20.6 Å²	20.6	28%	0.276	12%	0.123	S	C	.	.	H	α-helix	trans	-60.9	-48.1	172.8	-175.8	64.4	56.7	0	0	111.7	S185 Y186 Q187 M191 L192 D193 I223 W484	S185-Q189 PolarHBondContact O-N 3.18Å; Y186-Q189 PolarHBondContact O-N 3.41Å; Q187-Q189 VanDerWaalsContact C-N 3.32Å; Q187-Q189 PolarHBondContact O-N 2.82Å; Q189-M191 VanDerWaalsContact C-N 3.33Å; Q189-M191 PolarHBondContact O-N 2.91Å; Q189-L192 WeakPolarHBondContact O-CB 3.38Å; Q189-L192 PolarHBondContact O-N 3.35Å; Q189-D193 PolarHBondContact NE2-OD1 2.95Å; Q189-D193 VanDerWaalsContact O-CG 3.28Å; Q189-D193 PolarHBondContact O-N 2.86Å; Q189-I223 HydrophobicContact CB-CD1 4.44Å; Q189-W484 HydrophobicContact CB-CZ2 4.25Å; Q189-W484 HydrophobicContact CG-CZ2 3.82Å
190	A	95.8	Very high	94.1	Very high	0 Å²	0	21 Å²	21	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-60.3	-43	178.3	0	0	0	0	0	111.8	Y186 Q187 L192 D193 I194 Y463 W484	Y186-A190 WeakPolarHBondContact O-CB 3.19Å; Y186-A190 PolarHBondContact O-N 3.08Å; Q187-A190 PolarHBondContact O-N 3.13Å; A190-L192 PolarHBondContact O-N 2.85Å; A190-D193 PolarHBondContact O-N 2.97Å; A190-I194 WeakPolarHBondContact O-CD1 3.48Å; A190-I194 WeakPolarHBondContact O-CG1 3.43Å; A190-I194 PolarHBondContact O-N 3.31Å; A190-Y463 HydrophobicContact CB-CD2 4.35Å; A190-W484 HydrophobicContact CB-CB 4.23Å; A190-W484 HydrophobicContact CB-CD2 3.77Å; A190-W484 HydrophobicContact CB-CE3 4.38Å; A190-W484 HydrophobicContact CB-CG 3.69Å
191	M	96.2	Very high	94	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-63.5	-39.8	176	-66.9	175.4	88	0	0	112	Q187 A188 Q189 I194 V195 F220 I264 F266 V291 I316	Q187-M191 HydrophobicContact CG-SD 4.44Å; Q187-M191 VanDerWaalsContact O-CG 3.29Å; Q187-M191 WeakPolarHBondContact O-CG 3.35Å; Q187-M191 PolarHBondContact O-N 2.79Å; A188-M191 PolarHBondContact O-N 3.38Å; Q189-M191 VanDerWaalsContact C-N 3.33Å; Q189-M191 PolarHBondContact O-N 2.91Å; M191-I194 PolarHBondContact O-N 2.97Å; M191-V195 WeakPolarHBondContact O-CG2 3.39Å; M191-V195 PolarHBondContact O-N 3.34Å; M191-F220 HydrophobicContact CB-CD2 4.23Å; M191-F220 HydrophobicContact CB-CE2 4.11Å; M191-I264 HydrophobicContact CE-CG2 3.52Å; M191-I264 HydrophobicContact SD-CG2 4.34Å; M191-F266 HydrophobicContact CE-CE2 4.09Å; M191-F266 HydrophobicContact CE-CZ 4.47Å; M191-F266 HydrophobicContact SD-CD2 4.39Å; M191-F266 HydrophobicContact SD-CE1 4.17Å; M191-F266 HydrophobicContact SD-CE2 3.45Å; M191-F266 WeakPolarHBondContact SD-CE2 3.42Å; M191-F266 HydrophobicContact SD-CZ 3.32Å; M191-F266 WeakPolarHBondContact SD-CZ 3.4Å; M191-V291 HydrophobicContact CB-CG1 4.46Å; M191-V291 HydrophobicContact CE-CB 4.21Å; M191-V291 HydrophobicContact CE-CG1 3.72Å; M191-V291 WeakPolarHBondContact CE-O 3.29Å; M191-V291 HydrophobicContact CG-CG1 4.29Å; M191-I316 HydrophobicContact CG-CD1 3.41Å; M191-I316 VanDerWaalsContact CG-CD1 3.41Å; M191-I316 HydrophobicContact SD-CD1 3.96Å
192	L	95.8	Very high	94.1	Very high	1 Å²	1	23.4 Å²	23.4	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-62.9	-45.7	175.7	176.9	63	0	0	0	111.4	A188 Q189 A190 I194 V195 K196 F220 I223 A227 L230	A188-L192 WeakPolarHBondContact O-CB 3.43Å; A188-L192 PolarHBondContact O-N 2.81Å; Q189-L192 WeakPolarHBondContact O-CB 3.38Å; Q189-L192 PolarHBondContact O-N 3.35Å; A190-L192 PolarHBondContact O-N 2.85Å; L192-I194 VanDerWaalsContact C-N 3.28Å; L192-I194 PolarHBondContact O-N 2.92Å; L192-V195 PolarHBondContact O-N 2.87Å; L192-K196 HydrophobicContact CD1-CD 4.39Å; L192-K196 HydrophobicContact CD1-CG 4.31Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CB 3.31Å; L192-K196 WeakPolarHBondContact O-CG 3.23Å; L192-K196 PolarHBondContact O-N 3.41Å; L192-F220 HydrophobicContact CB-CD2 4.47Å; L192-F220 HydrophobicContact CB-CE2 4.05Å; L192-I223 HydrophobicContact CD2-CB 4.31Å; L192-I223 HydrophobicContact CD2-CG2 3.47Å; L192-I223 VanDerWaalsContact CD2-CG2 3.47Å; L192-A227 HydrophobicContact CD2-CB 3.9Å; L192-L230 HydrophobicContact CD1-CB 4.36Å; L192-L230 HydrophobicContact CD1-CD2 3.47Å; L192-L230 VanDerWaalsContact CD1-CD2 3.47Å
193	D	95.7	Very high	94.3	Very high	37 Å²	37	23.1 Å²	23.1	20%	0.198	13%	0.133	C	C	.	.	H	α-helix	trans	-61.1	-40.7	178.3	-64.4	-17.3	0	0	0	110.7	Q189 A190 K196 A197 W484 L488	Q189-D193 PolarHBondContact NE2-OD1 2.95Å; Q189-D193 VanDerWaalsContact O-CG 3.28Å; Q189-D193 PolarHBondContact O-N 2.86Å; A190-D193 PolarHBondContact O-N 2.97Å; D193-K196 PolarHBondContact O-N 3.11Å; D193-A197 WeakPolarHBondContact O-CB 2.92Å; D193-A197 PolarHBondContact O-N 2.87Å; D193-W484 PolarHBondContact OD2-NE1 2.01Å; D193-L488 VanDerWaalsContact C-CD2 3.47Å; D193-L488 HydrophobicContact CB-CB 3.97Å; D193-L488 HydrophobicContact CB-CD2 4Å; D193-L488 WeakPolarHBondContact O-CD2 3.23Å
194	I	95.7	Very high	94.5	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-61.7	-49.1	176.3	-69.7	162.8	0	0	0	110.6	A190 M191 L192 K196 A197 M198 V314 I316 I465 L488	A190-I194 WeakPolarHBondContact O-CD1 3.48Å; A190-I194 WeakPolarHBondContact O-CG1 3.43Å; A190-I194 PolarHBondContact O-N 3.31Å; M191-I194 PolarHBondContact O-N 2.97Å; L192-I194 VanDerWaalsContact C-N 3.28Å; L192-I194 PolarHBondContact O-N 2.92Å; I194-K196 VanDerWaalsContact C-N 3.33Å; I194-K196 PolarHBondContact O-N 2.8Å; I194-A197 PolarHBondContact O-N 3.35Å; I194-M198 HydrophobicContact CG2-CE 3.89Å; I194-M198 HydrophobicContact CG2-SD 4.36Å; I194-M198 WeakPolarHBondContact O-CG 3.25Å; I194-M198 PolarHBondContact O-N 2.87Å; I194-V314 HydrophobicContact CG2-CG1 4.02Å; I194-I316 HydrophobicContact CD1-CG2 3.6Å; I194-I465 HydrophobicContact CD1-CD1 3.79Å; I194-I465 HydrophobicContact CD1-CG1 4.06Å; I194-I465 HydrophobicContact CD1-CG2 3.97Å; I194-I465 HydrophobicContact CG1-CD1 3.96Å; I194-L488 HydrophobicContact CG1-CD1 3.85Å; I194-L488 HydrophobicContact CG1-CD2 4.14Å
195	V	95.6	Very high	94.7	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-60.9	-42.2	179.4	171.4	0	0	0	0	111.4	M191 L192 M198 G199 W200 V203 L230 I264 V291	M191-V195 WeakPolarHBondContact O-CG2 3.39Å; M191-V195 PolarHBondContact O-N 3.34Å; L192-V195 PolarHBondContact O-N 2.87Å; V195-M198 HydrophobicContact CG2-CE 4.31Å; V195-M198 PolarHBondContact O-N 2.82Å; V195-G199 PolarHBondContact O-N 2.87Å; V195-W200 HydrophobicContact CG1-CB 3.78Å; V195-W200 HydrophobicContact CG1-CE3 4.26Å; V195-W200 HydrophobicContact CG2-CE3 4.43Å; V195-W200 PolarHBondContact O-N 3.21Å; V195-V203 HydrophobicContact CG1-CG1 3.94Å; V195-L230 HydrophobicContact CG1-CD1 3.69Å; V195-L230 HydrophobicContact CG1-CD2 3.91Å; V195-L230 HydrophobicContact CG1-CG 4.48Å; V195-I264 HydrophobicContact CG2-CD1 3.55Å; V195-V291 HydrophobicContact CG2-CG2 4.31Å
196	K	93.6	Very high	94.9	Very high	79 Å²	79	21 Å²	21	34%	0.343	12%	0.119	S	C	.	.	H	α-helix	trans	-65.6	-41.5	175.5	-75.9	-173	170.4	-168.7	0	112.2	L192 D193 I194 M198 G199 A227 G228	L192-K196 HydrophobicContact CD1-CD 4.39Å; L192-K196 HydrophobicContact CD1-CG 4.31Å; L192-K196 HydrophobicContact CG-CD 4.4Å; L192-K196 WeakPolarHBondContact O-CB 3.31Å; L192-K196 WeakPolarHBondContact O-CG 3.23Å; L192-K196 PolarHBondContact O-N 3.41Å; D193-K196 PolarHBondContact O-N 3.11Å; I194-K196 VanDerWaalsContact C-N 3.33Å; I194-K196 PolarHBondContact O-N 2.8Å; K196-M198 VanDerWaalsContact C-N 3.25Å; K196-M198 PolarHBondContact O-N 3.49Å; K196-G199 PolarHBondContact O-N 2.76Å; K196-A227 VanDerWaalsContact NZ-CB 3.27Å; K196-A227 PolarHBondContact NZ-O 3.49Å; K196-A227 VanDerWaalsContact NZ-O 3.1Å; K196-G228 WeakPolarHBondContact CE-O 3.17Å; K196-G228 PolarHBondContact NZ-O 3.43Å
197	A	93.9	Very high	95	Very high	46 Å²	46	17.3 Å²	17.3	38%	0.38	11%	0.105	S	C	.	.	H	α-helix	trans	-64.2	-30.2	176.6	0	0	0	0	0	112.7	D193 I194 G199 L488 L490	D193-A197 WeakPolarHBondContact O-CB 2.92Å; D193-A197 PolarHBondContact O-N 2.87Å; I194-A197 PolarHBondContact O-N 3.35Å; A197-G199 PolarHBondContact O-N 3.37Å; A197-L488 HydrophobicContact CB-CD2 3.66Å; A197-L490 HydrophobicContact CB-CD2 4.24Å
198	M	92.9	Very high	94.9	Very high	11 Å²	11	17.4 Å²	17.4	5%	0.054	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.9	173	-69	-173	-57.2	0	0	113.9	I194 V195 K196 W200 V291 V314 M495 W497 I504	I194-M198 HydrophobicContact CG2-CE 3.89Å; I194-M198 HydrophobicContact CG2-SD 4.36Å; I194-M198 WeakPolarHBondContact O-CG 3.25Å; I194-M198 PolarHBondContact O-N 2.87Å; V195-M198 HydrophobicContact CG2-CE 4.31Å; V195-M198 PolarHBondContact O-N 2.82Å; K196-M198 VanDerWaalsContact C-N 3.25Å; K196-M198 PolarHBondContact O-N 3.49Å; M198-W200 VanDerWaalsContact C-N 3.29Å; M198-W200 HydrophobicContact CB-CD2 4.46Å; M198-W200 HydrophobicContact CB-CG 4.36Å; M198-W200 HydrophobicContact CE-CD2 4.01Å; M198-W200 HydrophobicContact CE-CE3 3.76Å; M198-W200 HydrophobicContact CE-CH2 3.73Å; M198-W200 HydrophobicContact CE-CZ2 3.99Å; M198-W200 HydrophobicContact CE-CZ3 3.62Å; M198-W200 PolarHBondContact O-N 3.06Å; M198-W200 HydrophobicContact SD-CH2 4.35Å; M198-W200 HydrophobicContact SD-CZ2 4.2Å; M198-V291 HydrophobicContact CE-CG2 4Å; M198-V314 HydrophobicContact SD-CG2 4.42Å; M198-M495 HydrophobicContact SD-CE 4.03Å; M198-W497 HydrophobicContact SD-CH2 3.82Å; M198-W497 HydrophobicContact SD-CZ2 4.24Å; M198-I504 HydrophobicContact CB-CD1 4.44Å; M198-I504 HydrophobicContact CB-CG2 4.03Å; M198-I504 HydrophobicContact CG-CD1 4.41Å; M198-I504 HydrophobicContact CG-CG2 4.43Å
199	G	92	Very high	94.6	Very high	57 Å²	57	21.7 Å²	21.7	59%	0.588	13%	0.125	S	C	*	.	T	Hydrogen-bonded Turn	trans	74.4	15.7	-179.5	0	0	0	0	0	114.4	V195 K196 A197	V195-G199 PolarHBondContact O-N 2.87Å; K196-G199 PolarHBondContact O-N 2.76Å; A197-G199 PolarHBondContact O-N 3.37Å
200	W	94.1	Very high	94.1	Very high	7 Å²	7	19.4 Å²	19.4	3%	0.027	12%	0.118	C	C	.	.			trans	-79.5	137.6	177.5	-68.3	0.5	0	0	0	111.2	V195 M198 V203 L289 V291 W497 P505	V195-W200 HydrophobicContact CG1-CB 3.78Å; V195-W200 HydrophobicContact CG1-CE3 4.26Å; V195-W200 HydrophobicContact CG2-CE3 4.43Å; V195-W200 PolarHBondContact O-N 3.21Å; M198-W200 VanDerWaalsContact C-N 3.29Å; M198-W200 HydrophobicContact CB-CD2 4.46Å; M198-W200 HydrophobicContact CB-CG 4.36Å; M198-W200 HydrophobicContact CE-CD2 4.01Å; M198-W200 HydrophobicContact CE-CE3 3.76Å; M198-W200 HydrophobicContact CE-CH2 3.73Å; M198-W200 HydrophobicContact CE-CZ2 3.99Å; M198-W200 HydrophobicContact CE-CZ3 3.62Å; M198-W200 PolarHBondContact O-N 3.06Å; M198-W200 HydrophobicContact SD-CH2 4.35Å; M198-W200 HydrophobicContact SD-CZ2 4.2Å; W200-V203 HydrophobicContact CB-CG1 4.38Å; W200-V203 HydrophobicContact CE3-CG1 3.89Å; W200-L289 HydrophobicContact CH2-CB 3.44Å; W200-L289 VanDerWaalsContact CH2-CB 3.44Å; W200-L289 HydrophobicContact CH2-CD1 4.1Å; W200-L289 HydrophobicContact CH2-CG 4.42Å; W200-L289 HydrophobicContact CZ2-CB 3.77Å; W200-L289 HydrophobicContact CZ2-CD1 3.5Å; W200-L289 HydrophobicContact CZ2-CG 4.28Å; W200-V291 HydrophobicContact CH2-CG2 4.31Å; W200-V291 HydrophobicContact CZ3-CG2 3.83Å; W200-W497 HydrophobicContact CZ2-CH2 4.44Å; W200-P505 PolarHBondContact NE1-O 3.34Å
201	N	92.4	Very high	93.6	Very high	41 Å²	41	21.6 Å²	21.6	22%	0.219	13%	0.129	C	C	.	.			trans	-124.4	-3.2	178.6	72.8	24.1	0	0	0	113.7	C231 S507 V508	N201-C231 PolarHBondContact O-N 3.27Å; N201-S507 PolarHBondContact N-O 3.08Å; N201-S507 VanDerWaalsContact N-O 3.15Å; N201-V508 WeakPolarHBondContact OD1-CA 3.34Å
202	Y	94.6	Very high	93.1	Very high	24 Å²	24	23 Å²	23	9%	0.094	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	114	-179.8	-166.5	-121.9	0	0	0	110.6	C231 A233 A260 S507 C509	Y202-C231 WeakPolarHBondContact CA-O 3.21Å; Y202-C231 HydrophobicContact CD2-CB 3.71Å; Y202-C231 HydrophobicContact CE2-CB 4.28Å; Y202-A233 HydrophobicContact CD1-CB 4.2Å; Y202-A233 HydrophobicContact CD2-CB 4.26Å; Y202-A233 HydrophobicContact CE1-CB 3.55Å; Y202-A233 HydrophobicContact CE2-CB 3.64Å; Y202-A233 WeakPolarHBondContact OH-CA 3.4Å; Y202-A233 WeakPolarHBondContact OH-CB 3.21Å; Y202-A260 HydrophobicContact CD1-CB 3.6Å; Y202-A260 HydrophobicContact CE1-CB 3.71Å; Y202-A260 HydrophobicContact CG-CB 4.46Å; Y202-S507 PolarHBondContact N-O 2.9Å; Y202-S507 VanDerWaalsContact N-O 3.12Å; Y202-S507 PolarHBondContact O-OG 3.45Å; Y202-C509 VanDerWaalsContact CB-N 3.29Å; Y202-C509 HydrophobicContact CD1-CB 3.84Å; Y202-C509 HydrophobicContact CD2-CB 3.67Å; Y202-C509 HydrophobicContact CE1-CB 4.15Å; Y202-C509 HydrophobicContact CE2-CB 4.01Å; Y202-C509 HydrophobicContact CG-CB 3.59Å
203	V	96.4	Very high	92.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	156.1	-174.9	-62.8	0	0	0	0	111.9	V195 W200 F220 L230 C231 I232 A233 G262 I264	V195-V203 HydrophobicContact CG1-CG1 3.94Å; W200-V203 HydrophobicContact CB-CG1 4.38Å; W200-V203 HydrophobicContact CE3-CG1 3.89Å; V203-F220 HydrophobicContact CG2-CE1 4.29Å; V203-L230 HydrophobicContact CG1-CD1 4.04Å; V203-L230 HydrophobicContact CG2-CD1 3.95Å; V203-L230 HydrophobicContact CG2-CD2 4.07Å; V203-L230 HydrophobicContact CG2-CG 4.18Å; V203-C231 PolarHBondContact N-O 3.3Å; V203-I232 CarbonylContact O-C 3.56Å; V203-I232 VanDerWaalsContact O-CA 3.31Å; V203-I232 WeakPolarHBondContact O-CA 3.3Å; V203-A233 PolarHBondContact O-N 3.24Å; V203-G262 CarbonylContact C-O 3.5Å; V203-G262 WeakPolarHBondContact CA-O 3.45Å; V203-G262 WeakPolarHBondContact CB-O 2.91Å; V203-I264 HydrophobicContact CB-CG1 4.28Å; V203-I264 HydrophobicContact CG2-CG1 4.07Å
204	S	97.1	Very high	92.5	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	151.3	168.7	-65.5	0	0	0	0	110.5	G262 V263 I264	S204-G262 PolarHBondContact N-O 3.41Å; S204-V263 CarbonylContact O-C 3.56Å; S204-V263 WeakPolarHBondContact O-CA 3.21Å; S204-I264 PolarHBondContact O-N 3.04Å
205	T	97.1	Very high	92.3	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	142.8	174.9	63.1	0	0	0	0	111	V217 F220 I232 Q234 S235 I236 I264	T205-V217 HydrophobicContact CG2-CG1 4.37Å; T205-F220 HydrophobicContact CG2-CD1 4.02Å; T205-F220 HydrophobicContact CG2-CE1 4.14Å; T205-I232 HydrophobicContact CG2-CG1 4.4Å; T205-I232 HydrophobicContact CG2-CG2 4.17Å; T205-Q234 PolarHBondContact N-O 3.34Å; T205-S235 VanDerWaalsContact OG1-CA 3.25Å; T205-S235 WeakPolarHBondContact OG1-CA 3.48Å; T205-S235 WeakPolarHBondContact OG1-CB 3.23Å; T205-S235 PolarHBondContact OG1-OG 2.92Å; T205-I236 PolarHBondContact O-N 2.83Å; T205-I264 CarbonylContact C-O 3.51Å; T205-I264 WeakPolarHBondContact CA-O 3.3Å; T205-I264 HydrophobicContact CG2-CB 4.13Å; T205-I264 HydrophobicContact CG2-CG1 4.4Å
206	L	96.8	Very high	92.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	14%	0.141	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	124.2	178.4	-172.5	67.7	0	0	0	110	I236 I238 I250 V263 I264 I265 F266 V275	L206-I236 WeakPolarHBondContact CA-O 3.31Å; L206-I236 HydrophobicContact CD1-CB 3.77Å; L206-I236 HydrophobicContact CD1-CG2 3.81Å; L206-I238 HydrophobicContact CD1-CD1 4.12Å; L206-I238 HydrophobicContact CD1-CG1 3.74Å; L206-I238 HydrophobicContact CD2-CD1 3.96Å; L206-I238 HydrophobicContact CD2-CG1 4.49Å; L206-I238 HydrophobicContact CG-CD1 3.89Å; L206-I238 HydrophobicContact CG-CG1 4.03Å; L206-I250 HydrophobicContact CD1-CG2 3.78Å; L206-V263 HydrophobicContact CB-CG1 4.31Å; L206-I264 PolarHBondContact N-O 3.33Å; L206-I265 HydrophobicContact CB-CG1 4.27Å; L206-I265 HydrophobicContact CD2-CD1 4.26Å; L206-I265 HydrophobicContact CD2-CG1 4.47Å; L206-I265 WeakPolarHBondContact O-CA 3.31Å; L206-F266 PolarHBondContact O-N 2.85Å; L206-V275 HydrophobicContact CD2-CB 4.44Å; L206-V275 HydrophobicContact CD2-CG1 3.91Å; L206-V275 HydrophobicContact CD2-CG2 3.75Å
207	A	95.9	Very high	92.2	Very high	1 Å²	1	20.5 Å²	20.5	1%	0.008	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	135.8	-177.2	0	0	0	0	0	112.1	G213 V217 I236 K237 I238 F266	A207-G213 WeakPolarHBondContact CB-O 3.41Å; A207-V217 HydrophobicContact CB-CB 4.2Å; A207-V217 HydrophobicContact CB-CG2 3.76Å; A207-I236 PolarHBondContact N-O 2.77Å; A207-K237 CarbonylContact O-C 3.51Å; A207-K237 WeakPolarHBondContact O-CA 3.22Å; A207-I238 PolarHBondContact O-N 3.07Å; A207-F266 CarbonylContact C-O 3.55Å; A207-F266 VanDerWaalsContact CA-O 3.29Å; A207-F266 WeakPolarHBondContact CA-O 3.33Å
208	S	91.6	Very high	92.2	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.021	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	135.8	162.5	-67	0	0	0	0	110.4	G210 G213 F266 A267 N268 D271	S208-G210 PolarHBondContact O-N 2.78Å; S208-G213 WeakPolarHBondContact O-CA 3.28Å; S208-F266 PolarHBondContact N-O 2.97Å; S208-A267 WeakPolarHBondContact OG-CA 3.4Å; S208-A267 VanDerWaalsContact OG-CB 3.3Å; S208-A267 WeakPolarHBondContact OG-CB 3.35Å; S208-N268 PolarHBondContact OG-N 3.43Å; S208-D271 WeakPolarHBondContact CB-OD2 3.2Å; S208-D271 PolarHBondContact OG-OD2 2.87Å
209	E	88.9	Confident	92.3	Very high	89 Å²	89	23 Å²	23	42%	0.416	14%	0.135	S	C	.	.	S	Bend	trans	-61.5	122.7	-179.6	177.3	-177.4	-160.7	0	0	112	E214 I238 P239 R240	E209-E214 WeakPolarHBondContact CA-OE1 3.48Å; E209-E214 WeakPolarHBondContact CG-OE1 3.37Å; E209-I238 WeakPolarHBondContact CB-O 3.25Å; E209-I238 PolarHBondContact N-O 2.77Å; E209-P239 VanDerWaalsContact OE2-CA 3.31Å; E209-P239 WeakPolarHBondContact OE2-CA 3.47Å; E209-R240 HydrophobicContact CB-CG 3.88Å; E209-R240 HydrophobicContact CG-CG 3.9Å; E209-R240 WeakPolarHBondContact O-CG 3.28Å; E209-R240 PolarHBondContact O-NE 2.99Å; E209-R240 VanDerWaalsContact O-NE 3.11Å; E209-R240 PolarHBondContact OE2-N 3.2Å
210	G	84.3	Confident	92.5	Very high	12 Å²	12	20.2 Å²	20.2	12%	0.124	11%	0.107	C	C	.	.	S	Bend	trans	134.3	174.1	-178.3	0	0	0	0	0	113.7	S208 Y212 G213 E214	S208-G210 PolarHBondContact O-N 2.78Å; G210-Y212 PolarHBondContact O-N 2.71Å; G210-G213 PolarHBondContact O-N 3.17Å; G210-E214 PolarHBondContact N-OE1 3Å; G210-E214 WeakPolarHBondContact O-CB 3.49Å; G210-E214 PolarHBondContact O-N 3.46Å
211	N	84.5	Confident	92.5	Very high	45 Å²	45	20.8 Å²	20.8	24%	0.241	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67	-8	-168.6	-55.4	59.2	0	0	0	115.2	I145 A165 E167 S215	I145-N211 HydrophobicContact CD1-CB 3.75Å; I145-N211 WeakPolarHBondContact CD1-ND2 3.41Å; A165-N211 VanDerWaalsContact CB-O 3.27Å; A165-N211 WeakPolarHBondContact CB-O 3.35Å; E167-N211 PolarHBondContact OE2-ND2 2.75Å; N211-S215 VanDerWaalsContact O-CB 3.32Å; N211-S215 WeakPolarHBondContact O-CB 3.48Å; N211-S215 PolarHBondContact O-OG 3.01Å; N211-S215 VanDerWaalsContact O-OG 3.04Å
212	Y	85.6	Confident	92.6	Very high	31 Å²	31	23.2 Å²	23.2	12%	0.122	12%	0.121	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90	-62.3	172	171.9	-110.3	0	0	0	110.2	T164 D184 G210 G216 S293 D294 S295	T164-Y212 WeakPolarHBondContact OG1-CE2 3.12Å; D184-Y212 WeakPolarHBondContact OD1-CE2 3.42Å; D184-Y212 WeakPolarHBondContact OD2-CD2 3.18Å; G210-Y212 PolarHBondContact O-N 2.71Å; Y212-G216 PolarHBondContact O-N 3.11Å; Y212-S293 PolarHBondContact OH-OG 3.29Å; Y212-D294 PolarHBondContact OH-OD1 3.2Å; Y212-S295 PolarHBondContact OH-N 3.07Å
213	G	89.1	Confident	92.5	Very high	2 Å²	2	23.4 Å²	23.4	2%	0.021	12%	0.123	C	C	.	.	H	α-helix	trans	-64.9	-46.1	-174.7	0	0	0	0	0	113.7	A207 S208 G210 V217 F266	A207-G213 WeakPolarHBondContact CB-O 3.41Å; S208-G213 WeakPolarHBondContact O-CA 3.28Å; G210-G213 PolarHBondContact O-N 3.17Å; G213-V217 PolarHBondContact O-N 2.96Å; G213-V217 VanDerWaalsContact O-N 3.1Å; G213-F266 WeakPolarHBondContact CA-O 3.4Å
214	E	91.5	Very high	92.4	Very high	46 Å²	46	23.4 Å²	23.4	22%	0.215	12%	0.124	C	C	.	.	H	α-helix	trans	-68.9	-51.4	-178.1	-64.2	-171	-152.4	0	0	111.5	E209 G210 G216 V217 D218 K237	E209-E214 WeakPolarHBondContact CA-OE1 3.48Å; E209-E214 WeakPolarHBondContact CG-OE1 3.37Å; G210-E214 PolarHBondContact N-OE1 3Å; G210-E214 WeakPolarHBondContact O-CB 3.49Å; G210-E214 PolarHBondContact O-N 3.46Å; E214-G216 VanDerWaalsContact C-N 3.26Å; E214-G216 PolarHBondContact O-N 2.94Å; E214-V217 PolarHBondContact O-N 3.32Å; E214-D218 WeakPolarHBondContact O-CB 3.46Å; E214-D218 VanDerWaalsContact O-CG 3.3Å; E214-D218 PolarHBondContact O-N 3.43Å; E214-K237 HydrophobicContact CG-CD 4.34Å; E214-K237 IonicContact OE1-NZ 3.55Å; E214-K237 IonicContact OE2-NZ 2.87Å; E214-K237 PolarHBondContact OE2-NZ 3.11Å
215	S	90.6	Very high	92.1	Very high	13 Å²	13	32 Å²	32	9%	0.091	16%	0.156	C	C	.	.	H	α-helix	trans	-65.2	-31.4	-178.1	-42.9	0	0	0	0	111.8	E167 N211 A219	E167-S215 PolarHBondContact OE1-OG 3.49Å; N211-S215 VanDerWaalsContact O-CB 3.32Å; N211-S215 WeakPolarHBondContact O-CB 3.48Å; N211-S215 PolarHBondContact O-OG 3.01Å; N211-S215 VanDerWaalsContact O-OG 3.04Å; S215-A219 WeakPolarHBondContact O-CB 3.46Å; S215-A219 PolarHBondContact O-N 3.14Å
216	G	92.6	Very high	91.9	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-67.1	-46.4	172.3	0	0	0	0	0	113.2	Y212 E214 A219 F220	Y212-G216 PolarHBondContact O-N 3.11Å; E214-G216 VanDerWaalsContact C-N 3.26Å; E214-G216 PolarHBondContact O-N 2.94Å; G216-A219 PolarHBondContact O-N 2.9Å; G216-F220 PolarHBondContact O-N 2.96Å
217	V	95	Very high	91.5	Very high	2 Å²	2	40.9 Å²	40.9	1%	0.012	21%	0.206	C	C	.	.	H	α-helix	trans	-65.8	-41.5	174.4	164	0	0	0	0	111.7	T205 A207 G213 E214 A219 F220 V221 F266	T205-V217 HydrophobicContact CG2-CG1 4.37Å; A207-V217 HydrophobicContact CB-CB 4.2Å; A207-V217 HydrophobicContact CB-CG2 3.76Å; G213-V217 PolarHBondContact O-N 2.96Å; G213-V217 VanDerWaalsContact O-N 3.1Å; E214-V217 PolarHBondContact O-N 3.32Å; V217-A219 VanDerWaalsContact C-N 3.32Å; V217-A219 PolarHBondContact O-N 3.39Å; V217-F220 CarbonylContact O-C 3.59Å; V217-F220 WeakPolarHBondContact O-CB 3.23Å; V217-F220 PolarHBondContact O-N 2.85Å; V217-F220 VanDerWaalsContact O-N 3.13Å; V217-V221 HydrophobicContact CG1-CG2 3.93Å; V217-V221 WeakPolarHBondContact O-CG2 3.43Å; V217-V221 PolarHBondContact O-N 2.84Å; V217-F266 HydrophobicContact CG2-CB 4.1Å; V217-F266 HydrophobicContact CG2-CD2 3.77Å; V217-F266 HydrophobicContact CG2-CG 4.28Å
218	D	94.2	Very high	91.1	Very high	91 Å²	91	42.4 Å²	42.4	49%	0.487	22%	0.222	S	C	.	.	H	α-helix	trans	-62.3	-40.8	178.3	-73.4	-17.4	0	0	0	111.1	E214 V221 Q222	E214-D218 WeakPolarHBondContact O-CB 3.46Å; E214-D218 VanDerWaalsContact O-CG 3.3Å; E214-D218 PolarHBondContact O-N 3.43Å; D218-V221 PolarHBondContact O-N 2.87Å; D218-Q222 WeakPolarHBondContact O-CB 3.49Å; D218-Q222 PolarHBondContact O-N 3.12Å
219	A	94.3	Very high	90.7	Very high	18 Å²	18	45.5 Å²	45.5	15%	0.149	25%	0.254	C	S	.	.	H	α-helix	trans	-60.4	-45.6	171.4	0	0	0	0	0	111.6	A188 S215 G216 V217 V221 Q222 I223	A188-A219 HydrophobicContact CB-CB 4.05Å; S215-A219 WeakPolarHBondContact O-CB 3.46Å; S215-A219 PolarHBondContact O-N 3.14Å; G216-A219 PolarHBondContact O-N 2.9Å; V217-A219 VanDerWaalsContact C-N 3.32Å; V217-A219 PolarHBondContact O-N 3.39Å; A219-V221 PolarHBondContact O-N 2.93Å; A219-Q222 PolarHBondContact O-N 2.77Å; A219-I223 WeakPolarHBondContact O-CB 3.41Å; A219-I223 WeakPolarHBondContact O-CD1 3.47Å; A219-I223 WeakPolarHBondContact O-CG1 3.21Å; A219-I223 PolarHBondContact O-N 3.48Å
220	F	95.8	Very high	90.9	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-61.5	-42.9	176.3	-179.3	-91	0	0	0	112.6	A188 M191 L192 V203 T205 G216 V217 Q222 S224 L230 I264 F266	A188-F220 HydrophobicContact CB-CB 3.98Å; M191-F220 HydrophobicContact CB-CD2 4.23Å; M191-F220 HydrophobicContact CB-CE2 4.11Å; L192-F220 HydrophobicContact CB-CD2 4.47Å; L192-F220 HydrophobicContact CB-CE2 4.05Å; V203-F220 HydrophobicContact CG2-CE1 4.29Å; T205-F220 HydrophobicContact CG2-CD1 4.02Å; T205-F220 HydrophobicContact CG2-CE1 4.14Å; G216-F220 PolarHBondContact O-N 2.96Å; V217-F220 CarbonylContact O-C 3.59Å; V217-F220 WeakPolarHBondContact O-CB 3.23Å; V217-F220 PolarHBondContact O-N 2.85Å; V217-F220 VanDerWaalsContact O-N 3.13Å; F220-Q222 VanDerWaalsContact C-N 3.35Å; F220-S224 VanDerWaalsContact O-CB 3.23Å; F220-S224 WeakPolarHBondContact O-CB 3.44Å; F220-S224 PolarHBondContact O-N 3.16Å; F220-S224 PolarHBondContact O-OG 2.86Å; F220-L230 HydrophobicContact CE1-CD2 4.09Å; F220-L230 HydrophobicContact CZ-CD2 3.68Å; F220-I264 HydrophobicContact CD1-CG2 4.4Å; F220-I264 HydrophobicContact CD2-CG2 4.25Å; F220-I264 HydrophobicContact CE1-CG1 3.88Å; F220-I264 HydrophobicContact CE1-CG2 4.37Å; F220-I264 HydrophobicContact CE2-CG1 4.37Å; F220-I264 HydrophobicContact CE2-CG2 4.2Å; F220-I264 HydrophobicContact CG-CG2 4.34Å; F220-I264 HydrophobicContact CZ-CD1 4.15Å; F220-I264 HydrophobicContact CZ-CG1 3.72Å; F220-I264 HydrophobicContact CZ-CG2 4.27Å; F220-F266 HydrophobicContact CB-CE2 4.36Å
221	V	94.7	Very high	91.3	Very high	18 Å²	18	42 Å²	42	11%	0.109	24%	0.236	C	C	.	.	H	α-helix	trans	-62.9	-42.3	177	175.8	0	0	0	0	111.1	V217 D218 A219 S224 R225 I232	V217-V221 HydrophobicContact CG1-CG2 3.93Å; V217-V221 WeakPolarHBondContact O-CG2 3.43Å; V217-V221 PolarHBondContact O-N 2.84Å; D218-V221 PolarHBondContact O-N 2.87Å; A219-V221 PolarHBondContact O-N 2.93Å; V221-S224 WeakPolarHBondContact CA-OG 3.3Å; V221-S224 PolarHBondContact O-OG 2.92Å; V221-R225 VanDerWaalsContact O-CG 3.27Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 2.86Å; V221-I232 HydrophobicContact CB-CD1 3.75Å; V221-I232 HydrophobicContact CG1-CD1 3.7Å; V221-I232 HydrophobicContact CG2-CD1 3.4Å; V221-I232 VanDerWaalsContact CG2-CD1 3.4Å
222	Q	93.6	Very high	91.7	Very high	93 Å²	93	42 Å²	42	44%	0.435	24%	0.236	S	C	.	.	H	α-helix	trans	-66.8	-50.6	-179.7	-174.5	60.2	22.3	0	0	111.3	D218 A219 F220 S224 R225 E226	D218-Q222 WeakPolarHBondContact O-CB 3.49Å; D218-Q222 PolarHBondContact O-N 3.12Å; A219-Q222 PolarHBondContact O-N 2.77Å; F220-Q222 VanDerWaalsContact C-N 3.35Å; Q222-S224 VanDerWaalsContact C-N 3.34Å; Q222-S224 PolarHBondContact O-N 2.84Å; Q222-R225 PolarHBondContact O-N 3.31Å; Q222-E226 PolarHBondContact NE2-OE1 3.39Å; Q222-E226 WeakPolarHBondContact O-CG 3.5Å; Q222-E226 PolarHBondContact O-N 2.79Å
223	I	93.7	Very high	92.1	Very high	27 Å²	27	41.7 Å²	41.7	14%	0.138	24%	0.239	C	C	.	.	H	α-helix	trans	-65	-38.8	-178.9	-60.8	167.1	0	0	0	110.8	A188 Q189 L192 A219 R225 E226 A227	A188-I223 HydrophobicContact CB-CD1 4.11Å; Q189-I223 HydrophobicContact CB-CD1 4.44Å; L192-I223 HydrophobicContact CD2-CB 4.31Å; L192-I223 HydrophobicContact CD2-CG2 3.47Å; L192-I223 VanDerWaalsContact CD2-CG2 3.47Å; A219-I223 WeakPolarHBondContact O-CB 3.41Å; A219-I223 WeakPolarHBondContact O-CD1 3.47Å; A219-I223 WeakPolarHBondContact O-CG1 3.21Å; A219-I223 PolarHBondContact O-N 3.48Å; I223-R225 VanDerWaalsContact C-N 3.34Å; I223-R225 PolarHBondContact O-N 3.5Å; I223-E226 PolarHBondContact O-N 3.01Å; I223-A227 VanDerWaalsContact O-CB 3.29Å; I223-A227 WeakPolarHBondContact O-CB 3.48Å; I223-A227 PolarHBondContact O-N 3.45Å
224	S	93.3	Very high	92.3	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.007	25%	0.246	C	C	.	.	H	α-helix	trans	-64.1	-36.8	177	57.1	0	0	0	0	112.9	F220 V221 Q222 G228	F220-S224 VanDerWaalsContact O-CB 3.23Å; F220-S224 WeakPolarHBondContact O-CB 3.44Å; F220-S224 PolarHBondContact O-N 3.16Å; F220-S224 PolarHBondContact O-OG 2.86Å; V221-S224 WeakPolarHBondContact CA-OG 3.3Å; V221-S224 PolarHBondContact O-OG 2.92Å; Q222-S224 VanDerWaalsContact C-N 3.34Å; Q222-S224 PolarHBondContact O-N 2.84Å; S224-G228 PolarHBondContact O-N 2.84Å; S224-G228 VanDerWaalsContact O-N 3.14Å
225	R	91.1	Very high	92.4	Very high	180 Å²	180	43.9 Å²	43.9	68%	0.679	26%	0.256	S	S	*	.	H	α-helix	trans	-66.2	-44.1	173.6	-74.5	172.3	179.3	175.3	2	112.2	V221 Q222 I223	V221-R225 VanDerWaalsContact O-CG 3.27Å; V221-R225 WeakPolarHBondContact O-CG 3.42Å; V221-R225 PolarHBondContact O-N 2.86Å; Q222-R225 PolarHBondContact O-N 3.31Å; I223-R225 VanDerWaalsContact C-N 3.34Å; I223-R225 PolarHBondContact O-N 3.5Å
226	E	91.9	Very high	92.7	Very high	137 Å²	137	43.5 Å²	43.5	64%	0.64	25%	0.253	S	S	*	.	H	α-helix	trans	-66.2	-42.5	179.6	-71.7	172.4	-170.5	0	0	112	Q222 I223 G228	Q222-E226 PolarHBondContact NE2-OE1 3.39Å; Q222-E226 WeakPolarHBondContact O-CG 3.5Å; Q222-E226 PolarHBondContact O-N 2.79Å; I223-E226 PolarHBondContact O-N 3.01Å; E226-G228 VanDerWaalsContact C-N 3.32Å; E226-G228 PolarHBondContact O-N 2.98Å
227	A	89.9	Confident	92.8	Very high	50 Å²	50	48.5 Å²	48.5	41%	0.413	27%	0.274	S	S	.	.	H	α-helix	trans	-77.5	-17.2	-178.1	0	0	0	0	0	113.6	L192 K196 I223	L192-A227 HydrophobicContact CD2-CB 3.9Å; K196-A227 VanDerWaalsContact NZ-CB 3.27Å; K196-A227 PolarHBondContact NZ-O 3.49Å; K196-A227 VanDerWaalsContact NZ-O 3.1Å; I223-A227 VanDerWaalsContact O-CB 3.29Å; I223-A227 WeakPolarHBondContact O-CB 3.48Å; I223-A227 PolarHBondContact O-N 3.45Å
228	G	86.6	Confident	92.7	Very high	33 Å²	33	48.4 Å²	48.4	34%	0.34	27%	0.274	S	S	.	.			trans	63.1	170.9	-176.7	0	0	0	0	0	114.6	K196 S224 E226 L230	K196-G228 WeakPolarHBondContact CE-O 3.17Å; K196-G228 PolarHBondContact NZ-O 3.43Å; S224-G228 PolarHBondContact O-N 2.84Å; S224-G228 VanDerWaalsContact O-N 3.14Å; E226-G228 VanDerWaalsContact C-N 3.32Å; E226-G228 PolarHBondContact O-N 2.98Å; G228-L230 VanDerWaalsContact C-N 3.3Å; G228-L230 PolarHBondContact O-N 3.38Å
229	G	84.4	Confident	92.5	Very high	68 Å²	68	46 Å²	46	70%	0.701	26%	0.263	S	S	*	.	S	Bend	trans	80.4	-2.1	173.8	0	0	0	0	0	116.3
230	L	91.9	Very high	91.8	Very high	15 Å²	15	50.6 Å²	50.6	8%	0.079	28%	0.277	C	S	.	.			trans	-128.4	132.2	174	-176.6	67.5	0	0	0	110.3	L192 V195 V203 F220 G228	L192-L230 HydrophobicContact CD1-CB 4.36Å; L192-L230 HydrophobicContact CD1-CD2 3.47Å; L192-L230 VanDerWaalsContact CD1-CD2 3.47Å; V195-L230 HydrophobicContact CG1-CD1 3.69Å; V195-L230 HydrophobicContact CG1-CD2 3.91Å; V195-L230 HydrophobicContact CG1-CG 4.48Å; V203-L230 HydrophobicContact CG1-CD1 4.04Å; V203-L230 HydrophobicContact CG2-CD1 3.95Å; V203-L230 HydrophobicContact CG2-CD2 4.07Å; V203-L230 HydrophobicContact CG2-CG 4.18Å; F220-L230 HydrophobicContact CE1-CD2 4.09Å; F220-L230 HydrophobicContact CZ-CD2 3.68Å; G228-L230 VanDerWaalsContact C-N 3.3Å; G228-L230 PolarHBondContact O-N 3.38Å
231	C	92.6	Very high	91.1	Very high	12 Å²	12	57.2 Å²	57.2	8%	0.081	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	148.7	172.5	-81.5	0	0	0	0	112	N201 Y202 V203 C527	N201-C231 PolarHBondContact O-N 3.27Å; Y202-C231 WeakPolarHBondContact CA-O 3.21Å; Y202-C231 HydrophobicContact CD2-CB 3.71Å; Y202-C231 HydrophobicContact CE2-CB 4.28Å; V203-C231 PolarHBondContact N-O 3.3Å; C231-C527 HydrophobicContact CB-CB 3.83Å; C231-C527 WeakPolarHBondContact CB-SG 3.42Å; C231-C527 WeakPolarHBondContact SG-CB 2.88Å; C231-C527 PolarHBondContact SG-N 2.74Å; C231-C527 VanDerWaalsContact SG-N 3.36Å; C231-C527 CovalentContact SG-SG 2.01Å; C231-C527 PolarHBondContact SG-SG 3.19Å
232	I	94.1	Very high	90.6	Very high	45 Å²	45	57.9 Å²	57.9	23%	0.231	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	116.5	172.5	-64	155.8	0	0	0	108.3	V203 T205 V221	V203-I232 CarbonylContact O-C 3.56Å; V203-I232 VanDerWaalsContact O-CA 3.31Å; V203-I232 WeakPolarHBondContact O-CA 3.3Å; T205-I232 HydrophobicContact CG2-CG1 4.4Å; T205-I232 HydrophobicContact CG2-CG2 4.17Å; V221-I232 HydrophobicContact CB-CD1 3.75Å; V221-I232 HydrophobicContact CG1-CD1 3.7Å; V221-I232 HydrophobicContact CG2-CD1 3.4Å; V221-I232 VanDerWaalsContact CG2-CD1 3.4Å
233	A	92.9	Very high	90.4	Very high	24 Å²	24	63.5 Å²	63.5	20%	0.198	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	-48.4	178.2	0	0	0	0	0	111.1	Y202 V203 T257 A260	Y202-A233 HydrophobicContact CD1-CB 4.2Å; Y202-A233 HydrophobicContact CD2-CB 4.26Å; Y202-A233 HydrophobicContact CE1-CB 3.55Å; Y202-A233 HydrophobicContact CE2-CB 3.64Å; Y202-A233 WeakPolarHBondContact OH-CA 3.4Å; Y202-A233 WeakPolarHBondContact OH-CB 3.21Å; V203-A233 PolarHBondContact O-N 3.24Å; A233-T257 HydrophobicContact CB-CG2 4.23Å; A233-A260 HydrophobicContact CB-CB 3.59Å
234	Q	93.2	Very high	90	Very high	35 Å²	35	74.4 Å²	74.4	16%	0.164	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-161	154.2	177.3	57	-174.9	-34.1	0	0	110.1	T205 I236 R253 T257	T205-Q234 PolarHBondContact N-O 3.34Å; Q234-I236 HydrophobicContact CG-CD1 4.33Å; Q234-I236 HydrophobicContact CG-CG1 4.25Å; Q234-R253 PolarHBondContact NE2-O 3.03Å; Q234-R253 PolarHBondContact OE1-O 3.36Å; Q234-T257 PolarHBondContact NE2-OG1 2.66Å
235	S	95.1	Very high	89.9	Confident	59 Å²	59	76 Å²	76	41%	0.413	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	115.7	171.5	-176.4	0	0	0	0	109.1	T205	T205-S235 VanDerWaalsContact OG1-CA 3.25Å; T205-S235 WeakPolarHBondContact OG1-CA 3.48Å; T205-S235 WeakPolarHBondContact OG1-CB 3.23Å; T205-S235 PolarHBondContact OG1-OG 2.92Å
236	I	95.7	Very high	90	Very high	6 Å²	6	69 Å²	69	3%	0.031	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	135.7	-176.8	-55.7	175.2	0	0	0	109.1	T205 L206 A207 Q234 I250 R253 L254	T205-I236 PolarHBondContact O-N 2.83Å; L206-I236 WeakPolarHBondContact CA-O 3.31Å; L206-I236 HydrophobicContact CD1-CB 3.77Å; L206-I236 HydrophobicContact CD1-CG2 3.81Å; A207-I236 PolarHBondContact N-O 2.77Å; Q234-I236 HydrophobicContact CG-CD1 4.33Å; Q234-I236 HydrophobicContact CG-CG1 4.25Å; I236-I250 HydrophobicContact CD1-CG2 4.5Å; I236-I250 HydrophobicContact CG2-CG1 4.06Å; I236-I250 HydrophobicContact CG2-CG2 4.11Å; I236-R253 HydrophobicContact CD1-CB 3.81Å; I236-L254 HydrophobicContact CD1-CD2 3.62Å; I236-L254 HydrophobicContact CD1-CG 3.73Å
237	K	94.6	Very high	90.1	Very high	104 Å²	104	63.6 Å²	63.6	45%	0.452	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	134.7	175	-61.4	-173.9	178.1	-168.2	0	110.5	A207 E214	A207-K237 CarbonylContact O-C 3.51Å; A207-K237 WeakPolarHBondContact O-CA 3.22Å; E214-K237 HydrophobicContact CG-CD 4.34Å; E214-K237 IonicContact OE1-NZ 3.55Å; E214-K237 IonicContact OE2-NZ 2.87Å; E214-K237 PolarHBondContact OE2-NZ 3.11Å
238	I	93.3	Very high	90.4	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	117.2	172.6	-48.1	178.1	0	0	0	107.4	L206 A207 E209 F247 I250 A267 D271 V275	L206-I238 HydrophobicContact CD1-CD1 4.12Å; L206-I238 HydrophobicContact CD1-CG1 3.74Å; L206-I238 HydrophobicContact CD2-CD1 3.96Å; L206-I238 HydrophobicContact CD2-CG1 4.49Å; L206-I238 HydrophobicContact CG-CD1 3.89Å; L206-I238 HydrophobicContact CG-CG1 4.03Å; A207-I238 PolarHBondContact O-N 3.07Å; E209-I238 WeakPolarHBondContact CB-O 3.25Å; E209-I238 PolarHBondContact N-O 2.77Å; I238-F247 HydrophobicContact CD1-CE1 4.5Å; I238-F247 HydrophobicContact CG2-CE1 3.82Å; I238-F247 HydrophobicContact CG2-CZ 4.03Å; I238-I250 HydrophobicContact CB-CD1 4.46Å; I238-I250 HydrophobicContact CG1-CD1 4.04Å; I238-I250 HydrophobicContact CG2-CD1 4.32Å; I238-A267 HydrophobicContact CD1-CB 4.13Å; I238-D271 HydrophobicContact CD1-CB 3.86Å; I238-D271 HydrophobicContact CG2-CB 4.5Å; I238-V275 HydrophobicContact CD1-CG2 3.96Å
239	P	89.9	Confident	90.8	Very high	41 Å²	41	67.3 Å²	67.3	27%	0.266	34%	0.335	S	S	.	.			trans	-60.2	146.1	179.1	-22.8	33.2	0	0	0	112.2	E209 E241 P242 E246	E209-P239 VanDerWaalsContact OE2-CA 3.31Å; E209-P239 WeakPolarHBondContact OE2-CA 3.47Å; P239-E241 PolarHBondContact O-N 3.17Å; P239-P242 WeakPolarHBondContact O-CD 3.22Å; P239-E246 HydrophobicContact CG-CG 4.29Å
240	R	79.7	Confident	91.3	Very high	115 Å²	115	64.2 Å²	64.2	43%	0.434	30%	0.302	S	S	.	.	S	Bend	trans	-56.7	-32.9	178.4	-76.8	-175.3	179	-175.2	4.2	113.5	E209	E209-R240 HydrophobicContact CB-CG 3.88Å; E209-R240 HydrophobicContact CG-CG 3.9Å; E209-R240 WeakPolarHBondContact O-CG 3.28Å; E209-R240 PolarHBondContact O-NE 2.99Å; E209-R240 VanDerWaalsContact O-NE 3.11Å; E209-R240 PolarHBondContact OE2-N 3.2Å
241	E	81.4	Confident	91.5	Very high	139 Å²	139	63.7 Å²	63.7	65%	0.65	30%	0.299	S	S	*	.	S	Bend	trans	-124.9	78.6	178.1	-69.2	-179.9	-170.4	0	0	109.1	R42 P239 R243	R42-E241 IonicContact CZ-OE1 3.04Å; R42-E241 IonicContact NH1-OE1 3.13Å; R42-E241 IonicContact NH2-OE1 2.74Å; R42-E241 PolarHBondContact NH2-OE1 3.2Å; P239-E241 PolarHBondContact O-N 3.17Å; E241-R243 PolarHBondContact O-N 2.73Å
242	P	83.8	Confident	91.7	Very high	31 Å²	31	70.2 Å²	70.2	20%	0.201	33%	0.326	C	S	.	.	P	Polyproline II helix	trans	-69.4	130	-172.5	27.1	-31.8	0	0	0	110.4	P239 E246 F247	P239-P242 WeakPolarHBondContact O-CD 3.22Å; P242-E246 HydrophobicContact CB-CB 4.31Å; P242-F247 HydrophobicContact CB-CE2 3.74Å; P242-F247 HydrophobicContact CB-CZ 4.11Å; P242-F247 HydrophobicContact CG-CE2 3.65Å; P242-F247 HydrophobicContact CG-CZ 3.86Å
243	R	88.6	Confident	91.7	Very high	211 Å²	211	73.8 Å²	73.8	80%	0.796	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-71.9	161.3	174.5	-63.4	-178.4	-176	174.3	2.4	110.5	E241 G245 E246	E241-R243 PolarHBondContact O-N 2.73Å; R243-G245 PolarHBondContact O-N 2.92Å; R243-E246 VanDerWaalsContact O-CB 3.3Å; R243-E246 WeakPolarHBondContact O-CB 3.42Å; R243-E246 PolarHBondContact O-N 2.67Å; R243-E246 VanDerWaalsContact O-N 3.11Å
244	R	86.9	Confident	91.9	Very high	256 Å²	256	72.7 Å²	72.7	97%	0.966	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	131.2	173.3	-69.8	-173.4	178.2	-175.2	-0.4	110.3
245	G	90	Very high	92	Very high	35 Å²	35	74.3 Å²	74.3	36%	0.361	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.9	2.7	-179.3	0	0	0	0	0	115.5	R243 D248 K249	R243-G245 PolarHBondContact O-N 2.92Å; G245-D248 PolarHBondContact O-N 2.84Å; G245-K249 PolarHBondContact O-N 3.37Å
246	E	93.6	Very high	91.9	Very high	32 Å²	32	78.7 Å²	78.7	15%	0.15	35%	0.35	C	S	.	.	H	α-helix	trans	-68.4	-40.9	179.5	-161.7	61.5	-160.6	0	0	112.3	P239 P242 R243 D248 K249 I250	P239-E246 HydrophobicContact CG-CG 4.29Å; P242-E246 HydrophobicContact CB-CB 4.31Å; R243-E246 VanDerWaalsContact O-CB 3.3Å; R243-E246 WeakPolarHBondContact O-CB 3.42Å; R243-E246 PolarHBondContact O-N 2.67Å; R243-E246 VanDerWaalsContact O-N 3.11Å; E246-D248 VanDerWaalsContact C-N 3.31Å; E246-D248 PolarHBondContact O-N 3Å; E246-K249 WeakPolarHBondContact O-CB 3.43Å; E246-K249 PolarHBondContact O-N 3.47Å; E246-K249 IonicContact OE2-NZ 3.3Å; E246-K249 PolarHBondContact OE2-NZ 3.23Å; E246-I250 WeakPolarHBondContact O-CG1 3.31Å; E246-I250 PolarHBondContact O-N 3.22Å
247	F	94.1	Very high	91.7	Very high	25 Å²	25	79.8 Å²	79.8	11%	0.11	36%	0.357	C	S	.	.	H	α-helix	trans	-61.6	-36.9	174.7	-65.4	-81.2	0	0	0	112.6	I238 P242 K249 I250 I251 R274 V275 A278	I238-F247 HydrophobicContact CD1-CE1 4.5Å; I238-F247 HydrophobicContact CG2-CE1 3.82Å; I238-F247 HydrophobicContact CG2-CZ 4.03Å; P242-F247 HydrophobicContact CB-CE2 3.74Å; P242-F247 HydrophobicContact CB-CZ 4.11Å; P242-F247 HydrophobicContact CG-CE2 3.65Å; P242-F247 HydrophobicContact CG-CZ 3.86Å; F247-K249 VanDerWaalsContact C-N 3.27Å; F247-K249 PolarHBondContact O-N 2.88Å; F247-I250 HydrophobicContact CD1-CD1 4.3Å; F247-I250 WeakPolarHBondContact O-CB 3.29Å; F247-I250 PolarHBondContact O-N 3.24Å; F247-I251 WeakPolarHBondContact O-CG1 3.39Å; F247-I251 PolarHBondContact O-N 2.83Å; F247-R274 HydrophobicContact CD1-CB 3.89Å; F247-R274 HydrophobicContact CD2-CB 4.01Å; F247-R274 HydrophobicContact CE1-CB 3.68Å; F247-R274 HydrophobicContact CE2-CB 3.83Å; F247-R274 VanDerWaalsContact CE2-CD 3.46Å; F247-R274 HydrophobicContact CE2-CG 4.25Å; F247-R274 HydrophobicContact CG-CB 4.05Å; F247-R274 HydrophobicContact CZ-CB 3.65Å; F247-R274 HydrophobicContact CZ-CG 4.27Å; F247-V275 HydrophobicContact CD1-CG2 3.77Å; F247-V275 HydrophobicContact CE1-CG2 3.97Å; F247-A278 HydrophobicContact CB-CB 3.84Å
248	D	95.1	Very high	91.6	Very high	54 Å²	54	77.3 Å²	77.3	29%	0.289	35%	0.353	S	S	.	.	H	α-helix	trans	-62.5	-35.3	174.4	-65.1	-36.3	0	0	0	111.3	G245 E246 K252 K281	G245-D248 PolarHBondContact O-N 2.84Å; E246-D248 VanDerWaalsContact C-N 3.31Å; E246-D248 PolarHBondContact O-N 3Å; D248-K252 WeakPolarHBondContact O-CG 3.33Å; D248-K252 PolarHBondContact O-N 2.7Å; D248-K252 VanDerWaalsContact O-N 3.12Å; D248-K281 IonicContact OD1-NZ 3.62Å; D248-K281 PolarHBondContact OD1-NZ 2.87Å; D248-K281 IonicContact OD2-NZ 3.64Å; D248-K281 PolarHBondContact OD2-NZ 2.95Å
249	K	95.4	Very high	91.5	Very high	106 Å²	106	80.6 Å²	80.6	46%	0.461	37%	0.37	S	S	.	.	H	α-helix	trans	-71.2	-38	174.6	-63.1	177.1	-163.6	156.4	0	112.2	G245 E246 F247 I251 K252 R253	G245-K249 PolarHBondContact O-N 3.37Å; E246-K249 WeakPolarHBondContact O-CB 3.43Å; E246-K249 PolarHBondContact O-N 3.47Å; E246-K249 IonicContact OE2-NZ 3.3Å; E246-K249 PolarHBondContact OE2-NZ 3.23Å; F247-K249 VanDerWaalsContact C-N 3.27Å; F247-K249 PolarHBondContact O-N 2.88Å; K249-I251 VanDerWaalsContact C-N 3.34Å; K249-K252 PolarHBondContact O-N 3.06Å; K249-R253 WeakPolarHBondContact O-CG 3.43Å; K249-R253 PolarHBondContact O-N 3.1Å
250	I	95.8	Very high	91.7	Very high	3 Å²	3	78.6 Å²	78.6	2%	0.015	36%	0.358	C	S	.	.	H	α-helix	trans	-58.9	-48.4	176.4	-70.3	167.6	0	0	0	109.7	L206 I236 I238 E246 F247 K252 R253 L254	L206-I250 HydrophobicContact CD1-CG2 3.78Å; I236-I250 HydrophobicContact CD1-CG2 4.5Å; I236-I250 HydrophobicContact CG2-CG1 4.06Å; I236-I250 HydrophobicContact CG2-CG2 4.11Å; I238-I250 HydrophobicContact CB-CD1 4.46Å; I238-I250 HydrophobicContact CG1-CD1 4.04Å; I238-I250 HydrophobicContact CG2-CD1 4.32Å; E246-I250 WeakPolarHBondContact O-CG1 3.31Å; E246-I250 PolarHBondContact O-N 3.22Å; F247-I250 HydrophobicContact CD1-CD1 4.3Å; F247-I250 WeakPolarHBondContact O-CB 3.29Å; F247-I250 PolarHBondContact O-N 3.24Å; I250-K252 VanDerWaalsContact C-N 3.35Å; I250-K252 PolarHBondContact O-N 3.27Å; I250-R253 PolarHBondContact O-N 3.49Å; I250-L254 HydrophobicContact CG2-CD1 4.39Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 3.46Å
251	I	96.2	Very high	92.4	Very high	4 Å²	4	76.5 Å²	76.5	2%	0.021	35%	0.35	C	S	.	.	H	α-helix	trans	-61.5	-42.1	176.3	-62.9	-54.9	0	0	0	111.5	F247 K249 R253 L254 M255 V275 A278 A279 A282 L284	F247-I251 WeakPolarHBondContact O-CG1 3.39Å; F247-I251 PolarHBondContact O-N 2.83Å; K249-I251 VanDerWaalsContact C-N 3.34Å; I251-R253 VanDerWaalsContact C-N 3.34Å; I251-R253 PolarHBondContact O-N 2.83Å; I251-L254 HydrophobicContact CD1-CD1 4.19Å; I251-L254 WeakPolarHBondContact O-CB 3.38Å; I251-L254 PolarHBondContact O-N 2.72Å; I251-M255 WeakPolarHBondContact O-CG 3.5Å; I251-M255 PolarHBondContact O-N 2.91Å; I251-V275 HydrophobicContact CD1-CG1 4.25Å; I251-A278 HydrophobicContact CG1-CB 3.71Å; I251-A279 HydrophobicContact CD1-CB 3.99Å; I251-A282 HydrophobicContact CG2-CB 3.92Å; I251-L284 HydrophobicContact CG2-CD1 3.42Å; I251-L284 VanDerWaalsContact CG2-CD1 3.42Å
252	K	95.4	Very high	93.1	Very high	149 Å²	149	69.9 Å²	69.9	65%	0.648	32%	0.319	S	S	*	.	H	α-helix	trans	-60.2	-41.5	175	-75.9	176.2	-179.2	-178.3	0	112.7	D248 K249 I250 M255 E256	D248-K252 WeakPolarHBondContact O-CG 3.33Å; D248-K252 PolarHBondContact O-N 2.7Å; D248-K252 VanDerWaalsContact O-N 3.12Å; K249-K252 PolarHBondContact O-N 3.06Å; I250-K252 VanDerWaalsContact C-N 3.35Å; I250-K252 PolarHBondContact O-N 3.27Å; K252-M255 PolarHBondContact O-N 2.89Å; K252-E256 PolarHBondContact O-N 3.34Å
253	R	95.8	Very high	93.8	Very high	121 Å²	121	68.4 Å²	68.4	46%	0.457	31%	0.309	S	S	.	.	H	α-helix	trans	-64.6	-42.9	174.5	-75	-178	-177.7	171.8	1.9	111.7	Q234 I236 K249 I250 I251 M255 E256	Q234-R253 PolarHBondContact NE2-O 3.03Å; Q234-R253 PolarHBondContact OE1-O 3.36Å; I236-R253 HydrophobicContact CD1-CB 3.81Å; K249-R253 WeakPolarHBondContact O-CG 3.43Å; K249-R253 PolarHBondContact O-N 3.1Å; I250-R253 PolarHBondContact O-N 3.49Å; I251-R253 VanDerWaalsContact C-N 3.34Å; I251-R253 PolarHBondContact O-N 2.83Å; R253-M255 PolarHBondContact O-N 2.88Å; R253-E256 VanDerWaalsContact O-CB 3.31Å; R253-E256 WeakPolarHBondContact O-CB 3.01Å; R253-E256 PolarHBondContact O-N 3.09Å
254	L	95.5	Very high	94.2	Very high	1 Å²	1	58.3 Å²	58.3	1%	0.005	27%	0.271	C	S	.	.	H	α-helix	trans	-54	-41.4	173	-71.8	174.1	0	0	0	111.7	I236 I250 I251 E256 T257 V263 F288	I236-L254 HydrophobicContact CD1-CD2 3.62Å; I236-L254 HydrophobicContact CD1-CG 3.73Å; I250-L254 HydrophobicContact CG2-CD1 4.39Å; I250-L254 WeakPolarHBondContact O-CG 3.33Å; I250-L254 PolarHBondContact O-N 3.46Å; I251-L254 HydrophobicContact CD1-CD1 4.19Å; I251-L254 WeakPolarHBondContact O-CB 3.38Å; I251-L254 PolarHBondContact O-N 2.72Å; L254-E256 VanDerWaalsContact C-N 3.3Å; L254-E256 PolarHBondContact O-N 3.46Å; L254-T257 CarbonylContact O-C 3.49Å; L254-T257 PolarHBondContact O-N 3.03Å; L254-V263 HydrophobicContact CD2-CG2 4.48Å; L254-F288 HydrophobicContact CB-CE1 3.93Å; L254-F288 HydrophobicContact CB-CE2 4.21Å; L254-F288 HydrophobicContact CB-CZ 3.52Å
255	M	95.3	Very high	94.7	Very high	69 Å²	69	46.2 Å²	46.2	34%	0.34	23%	0.225	S	C	.	.	H	α-helix	trans	-70.7	-15.7	177	-69.9	-58.3	-60.2	0	0	115.4	I251 K252 R253 T257 S258 L284 F288	I251-M255 WeakPolarHBondContact O-CG 3.5Å; I251-M255 PolarHBondContact O-N 2.91Å; K252-M255 PolarHBondContact O-N 2.89Å; R253-M255 PolarHBondContact O-N 2.88Å; M255-T257 PolarHBondContact O-N 3.12Å; M255-S258 PolarHBondContact O-N 3.4Å; M255-L284 HydrophobicContact CE-CD2 4.05Å; M255-L284 HydrophobicContact CG-CD1 3.69Å; M255-L284 HydrophobicContact SD-CD1 3.66Å; M255-L284 HydrophobicContact SD-CD2 3.74Å; M255-L284 HydrophobicContact SD-CG 4.36Å; M255-F288 HydrophobicContact CG-CZ 4.12Å; M255-F288 HydrophobicContact SD-CE1 4.37Å; M255-F288 HydrophobicContact SD-CE2 4.12Å; M255-F288 HydrophobicContact SD-CZ 3.56Å; M255-F288 VanDerWaalsContact SD-CZ 3.56Å
256	E	94.1	Very high	94.9	Very high	150 Å²	150	44.5 Å²	44.5	70%	0.701	21%	0.208	S	C	*	.	H	α-helix	trans	-63.5	-24.4	172.2	-65.6	173.9	-171.5	0	0	111.4	K252 R253 L254	K252-E256 PolarHBondContact O-N 3.34Å; R253-E256 VanDerWaalsContact O-CB 3.31Å; R253-E256 WeakPolarHBondContact O-CB 3.01Å; R253-E256 PolarHBondContact O-N 3.09Å; L254-E256 VanDerWaalsContact C-N 3.3Å; L254-E256 PolarHBondContact O-N 3.46Å
257	T	91.8	Very high	94.8	Very high	30 Å²	30	43 Å²	43	18%	0.184	20%	0.201	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	57.8	173.9	52.2	0	0	0	0	110.5	A233 Q234 L254 M255 N259 A260	A233-T257 HydrophobicContact CB-CG2 4.23Å; Q234-T257 PolarHBondContact NE2-OG1 2.66Å; L254-T257 CarbonylContact O-C 3.49Å; L254-T257 PolarHBondContact O-N 3.03Å; M255-T257 PolarHBondContact O-N 3.12Å; T257-N259 PolarHBondContact O-N 3.03Å; T257-A260 WeakPolarHBondContact O-CB 3.29Å; T257-A260 PolarHBondContact O-N 3.4Å
258	S	91.3	Very high	94.5	Very high	51 Å²	51	45.6 Å²	45.6	36%	0.357	22%	0.216	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-22.5	-176	58.5	0	0	0	0	115.9	M255 A260 H287	M255-S258 PolarHBondContact O-N 3.4Å; S258-A260 VanDerWaalsContact C-N 3.3Å; S258-H287 PolarHBondContact O-CE1 2.96Å; S258-H287 PolarHBondContact O-NE2 3.1Å
259	N	91.4	Very high	93.9	Very high	69 Å²	69	44 Å²	44	37%	0.369	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-23.7	173.9	-71.9	-3.2	0	0	0	112.8	T257 R261 V508 C509	T257-N259 PolarHBondContact O-N 3.03Å; N259-R261 VanDerWaalsContact C-N 3.28Å; N259-R261 PolarHBondContact O-N 2.85Å; N259-V508 WeakPolarHBondContact CB-O 3.43Å; N259-C509 PolarHBondContact ND2-O 3.01Å
260	A	94.4	Very high	93.4	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.214	C	C	.	.			trans	-81.1	73.3	173.6	0	0	0	0	0	110.4	Y202 A233 T257 S258 G262	Y202-A260 HydrophobicContact CD1-CB 3.6Å; Y202-A260 HydrophobicContact CE1-CB 3.71Å; Y202-A260 HydrophobicContact CG-CB 4.46Å; A233-A260 HydrophobicContact CB-CB 3.59Å; T257-A260 WeakPolarHBondContact O-CB 3.29Å; T257-A260 PolarHBondContact O-N 3.4Å; S258-A260 VanDerWaalsContact C-N 3.3Å; A260-G262 VanDerWaalsContact C-N 3.35Å
261	R	94.9	Very high	93.1	Very high	70 Å²	70	45 Å²	45	26%	0.264	22%	0.217	S	C	.	.			trans	-68.6	-33.4	-180	-63.7	-173	66.9	-174.7	-1.1	112.7	N259 G286 H287 F288 L289 S507	N259-R261 VanDerWaalsContact C-N 3.28Å; N259-R261 PolarHBondContact O-N 2.85Å; R261-G286 PolarHBondContact NH2-O 3.46Å; R261-H287 PolarHBondContact NE-O 3.16Å; R261-H287 PolarHBondContact NH2-O 2.85Å; R261-F288 CarbonylContact O-C 3.56Å; R261-F288 WeakPolarHBondContact O-CA 3.24Å; R261-L289 HydrophobicContact CB-CD1 4.42Å; R261-L289 PolarHBondContact O-N 3.27Å; R261-S507 PolarHBondContact N-OG 3.12Å
262	G	96.1	Very high	93	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	125	176.9	0	0	0	0	0	112.4	V203 S204 A260 L289 S507	V203-G262 CarbonylContact C-O 3.5Å; V203-G262 WeakPolarHBondContact CA-O 3.45Å; V203-G262 WeakPolarHBondContact CB-O 2.91Å; S204-G262 PolarHBondContact N-O 3.41Å; A260-G262 VanDerWaalsContact C-N 3.35Å; G262-L289 CarbonylContact C-O 3.58Å; G262-L289 WeakPolarHBondContact CA-O 3.25Å; G262-S507 PolarHBondContact N-OG 3.25Å
263	V	97.7	Very high	92.8	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	115	179.4	-174.2	0	0	0	0	110.3	S204 L206 L254 I265 F288 L289 F290 V291	S204-V263 CarbonylContact O-C 3.56Å; S204-V263 WeakPolarHBondContact O-CA 3.21Å; L206-V263 HydrophobicContact CB-CG1 4.31Å; L254-V263 HydrophobicContact CD2-CG2 4.48Å; V263-I265 HydrophobicContact CG1-CD1 4.28Å; V263-I265 HydrophobicContact CG1-CG1 3.91Å; V263-F288 HydrophobicContact CG2-CB 4.18Å; V263-F288 HydrophobicContact CG2-CD1 3.8Å; V263-F288 HydrophobicContact CG2-CG 4.18Å; V263-L289 PolarHBondContact N-O 3.04Å; V263-F290 HydrophobicContact CB-CD1 3.88Å; V263-F290 HydrophobicContact CB-CE1 4.12Å; V263-F290 HydrophobicContact CG1-CD1 4.26Å; V263-F290 HydrophobicContact CG1-CE1 4.35Å; V263-F290 HydrophobicContact CG2-CE1 4.39Å; V263-F290 WeakPolarHBondContact O-CA 3.47Å; V263-V291 PolarHBondContact O-N 3.13Å
264	I	97.8	Very high	92.7	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.1	178.1	-47.7	-53.9	0	0	0	108.8	M191 V195 V203 S204 T205 L206 F220 F266 V291	M191-I264 HydrophobicContact CE-CG2 3.52Å; M191-I264 HydrophobicContact SD-CG2 4.34Å; V195-I264 HydrophobicContact CG2-CD1 3.55Å; V203-I264 HydrophobicContact CB-CG1 4.28Å; V203-I264 HydrophobicContact CG2-CG1 4.07Å; S204-I264 PolarHBondContact O-N 3.04Å; T205-I264 CarbonylContact C-O 3.51Å; T205-I264 WeakPolarHBondContact CA-O 3.3Å; T205-I264 HydrophobicContact CG2-CB 4.13Å; T205-I264 HydrophobicContact CG2-CG1 4.4Å; L206-I264 PolarHBondContact N-O 3.33Å; F220-I264 HydrophobicContact CD1-CG2 4.4Å; F220-I264 HydrophobicContact CD2-CG2 4.25Å; F220-I264 HydrophobicContact CE1-CG1 3.88Å; F220-I264 HydrophobicContact CE1-CG2 4.37Å; F220-I264 HydrophobicContact CE2-CG1 4.37Å; F220-I264 HydrophobicContact CE2-CG2 4.2Å; F220-I264 HydrophobicContact CG-CG2 4.34Å; F220-I264 HydrophobicContact CZ-CD1 4.15Å; F220-I264 HydrophobicContact CZ-CG1 3.72Å; F220-I264 HydrophobicContact CZ-CG2 4.27Å; I264-F266 HydrophobicContact CG2-CD2 4.28Å; I264-F266 HydrophobicContact CG2-CE2 4.01Å; I264-V291 WeakPolarHBondContact CA-O 3.34Å; I264-V291 HydrophobicContact CD1-CB 3.77Å; I264-V291 HydrophobicContact CD1-CG1 4.48Å; I264-V291 HydrophobicContact CD1-CG2 3.96Å
265	I	96.6	Very high	92.7	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.005	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	115.3	-172.4	-58.5	-169.4	0	0	0	112	L206 V263 A267 I272 F290 V291 S293 W296	L206-I265 HydrophobicContact CB-CG1 4.27Å; L206-I265 HydrophobicContact CD2-CD1 4.26Å; L206-I265 HydrophobicContact CD2-CG1 4.47Å; L206-I265 WeakPolarHBondContact O-CA 3.31Å; V263-I265 HydrophobicContact CG1-CD1 4.28Å; V263-I265 HydrophobicContact CG1-CG1 3.91Å; I265-A267 HydrophobicContact CG2-CB 3.53Å; I265-I272 HydrophobicContact CG2-CG1 3.99Å; I265-F290 HydrophobicContact CD1-CB 4.49Å; I265-F290 HydrophobicContact CD1-CD1 3.35Å; I265-F290 HydrophobicContact CD1-CE1 3.87Å; I265-F290 HydrophobicContact CD1-CG 4.22Å; I265-F290 HydrophobicContact CG1-CD1 4.2Å; I265-V291 PolarHBondContact N-O 3.23Å; I265-S293 PolarHBondContact O-N 3.1Å; I265-S293 VanDerWaalsContact O-N 3.07Å; I265-S293 PolarHBondContact O-OG 3.25Å; I265-W296 HydrophobicContact CD1-CZ3 4.44Å
266	F	95.1	Very high	92.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	76.9	163	-72.2	-98.3	0	0	0	109.5	D184 Q187 A188 M191 L206 A207 S208 G213 V217 F220 I264	D184-F266 HydrophobicContact CB-CE1 4.42Å; Q187-F266 HydrophobicContact CG-CE1 4.31Å; A188-F266 HydrophobicContact CB-CZ 4.27Å; M191-F266 HydrophobicContact CE-CE2 4.09Å; M191-F266 HydrophobicContact CE-CZ 4.47Å; M191-F266 HydrophobicContact SD-CD2 4.39Å; M191-F266 HydrophobicContact SD-CE1 4.17Å; M191-F266 HydrophobicContact SD-CE2 3.45Å; M191-F266 WeakPolarHBondContact SD-CE2 3.42Å; M191-F266 HydrophobicContact SD-CZ 3.32Å; M191-F266 WeakPolarHBondContact SD-CZ 3.4Å; L206-F266 PolarHBondContact O-N 2.85Å; A207-F266 CarbonylContact C-O 3.55Å; A207-F266 VanDerWaalsContact CA-O 3.29Å; A207-F266 WeakPolarHBondContact CA-O 3.33Å; S208-F266 PolarHBondContact N-O 2.97Å; G213-F266 WeakPolarHBondContact CA-O 3.4Å; V217-F266 HydrophobicContact CG2-CB 4.1Å; V217-F266 HydrophobicContact CG2-CD2 3.77Å; V217-F266 HydrophobicContact CG2-CG 4.28Å; F220-F266 HydrophobicContact CB-CE2 4.36Å; I264-F266 HydrophobicContact CG2-CD2 4.28Å; I264-F266 HydrophobicContact CG2-CE2 4.01Å
267	A	91.8	Very high	92.7	Very high	0 Å²	0	34.9 Å²	34.9	0%	0	17%	0.171	C	C	.	.			trans	-131.7	160.5	-175.4	0	0	0	0	0	111.4	S208 I238 I265 D271 I272 S295	S208-A267 WeakPolarHBondContact OG-CA 3.4Å; S208-A267 VanDerWaalsContact OG-CB 3.3Å; S208-A267 WeakPolarHBondContact OG-CB 3.35Å; I238-A267 HydrophobicContact CD1-CB 4.13Å; I265-A267 HydrophobicContact CG2-CB 3.53Å; A267-D271 HydrophobicContact CB-CB 4.23Å; A267-I272 HydrophobicContact CB-CG1 3.99Å; A267-I272 WeakPolarHBondContact O-CD1 3.49Å; A267-S295 WeakPolarHBondContact O-CB 3.4Å; A267-S295 PolarHBondContact O-OG 3.48Å
268	N	86.5	Confident	92.9	Very high	80 Å²	80	33.7 Å²	33.7	43%	0.428	17%	0.165	S	C	.	.			trans	-70.4	156.9	172.6	-60.5	-51.1	0	0	0	110.7	S208 D270 D271 I272	S208-N268 PolarHBondContact OG-N 3.43Å; N268-D270 VanDerWaalsContact C-N 3.31Å; N268-D270 PolarHBondContact O-N 3.28Å; N268-D271 WeakPolarHBondContact O-CB 3.06Å; N268-D271 PolarHBondContact O-N 2.95Å; N268-I272 WeakPolarHBondContact O-CG1 3.15Å; N268-I272 PolarHBondContact O-N 2.81Å
269	E	84.1	Confident	93.1	Very high	20 Å²	20	31.3 Å²	31.3	9%	0.093	15%	0.148	C	C	.	.	H	α-helix	trans	-55.1	-42.7	-179.3	-68.2	174.2	-136.3	0	0	113.3	K56 D271 I272 K273 S295 K299 P302	K56-E269 WeakPolarHBondContact CE-OE1 3.17Å; K56-E269 WeakPolarHBondContact CE-OE2 3.5Å; K56-E269 IonicContact NZ-OE1 3.16Å; K56-E269 PolarHBondContact NZ-OE1 3.29Å; K56-E269 IonicContact NZ-OE2 2.81Å; K56-E269 PolarHBondContact NZ-OE2 3.32Å; E269-D271 VanDerWaalsContact C-N 3.31Å; E269-D271 PolarHBondContact O-N 2.62Å; E269-I272 PolarHBondContact O-N 2.78Å; E269-K273 PolarHBondContact O-N 2.81Å; E269-S295 WeakPolarHBondContact CG-O 3.38Å; E269-K299 IonicContact OE1-NZ 2.78Å; E269-K299 PolarHBondContact OE1-NZ 2.95Å; E269-P302 HydrophobicContact CB-CG 4.05Å; E269-P302 HydrophobicContact CG-CG 3.89Å
270	D	83.2	Confident	93.3	Very high	114 Å²	114	31.2 Å²	31.2	61%	0.61	14%	0.144	S	C	*	.	H	α-helix	trans	-63.7	-37.6	177.9	-62.4	-48	0	0	0	112.2	N268 R274	N268-D270 VanDerWaalsContact C-N 3.31Å; N268-D270 PolarHBondContact O-N 3.28Å; D270-R274 VanDerWaalsContact O-CG 3.27Å; D270-R274 WeakPolarHBondContact O-CG 3.38Å; D270-R274 PolarHBondContact O-N 3.3Å
271	D	90.4	Very high	93.3	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.08	17%	0.173	C	C	.	.	H	α-helix	trans	-71.7	-40.2	178.1	-68.5	-34.5	0	0	0	110.5	S208 I238 A267 N268 E269 R274 V275	S208-D271 WeakPolarHBondContact CB-OD2 3.2Å; S208-D271 PolarHBondContact OG-OD2 2.87Å; I238-D271 HydrophobicContact CD1-CB 3.86Å; I238-D271 HydrophobicContact CG2-CB 4.5Å; A267-D271 HydrophobicContact CB-CB 4.23Å; N268-D271 WeakPolarHBondContact O-CB 3.06Å; N268-D271 PolarHBondContact O-N 2.95Å; E269-D271 VanDerWaalsContact C-N 3.31Å; E269-D271 PolarHBondContact O-N 2.62Å; D271-R274 PolarHBondContact O-N 3.07Å; D271-V275 WeakPolarHBondContact O-CG2 3.23Å; D271-V275 PolarHBondContact O-N 3.06Å
272	I	93.8	Very high	93.3	Very high	2 Å²	2	37 Å²	37	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-57.7	-51.8	174.3	-67.1	159.8	0	0	0	110.2	I265 A267 N268 E269 R274 V275 L276 W296 P302	I265-I272 HydrophobicContact CG2-CG1 3.99Å; A267-I272 HydrophobicContact CB-CG1 3.99Å; A267-I272 WeakPolarHBondContact O-CD1 3.49Å; N268-I272 WeakPolarHBondContact O-CG1 3.15Å; N268-I272 PolarHBondContact O-N 2.81Å; E269-I272 PolarHBondContact O-N 2.78Å; I272-R274 VanDerWaalsContact C-N 3.27Å; I272-R274 PolarHBondContact O-N 3.45Å; I272-V275 PolarHBondContact O-N 3.23Å; I272-V275 VanDerWaalsContact O-N 3.11Å; I272-L276 HydrophobicContact CG2-CD1 3.99Å; I272-L276 HydrophobicContact CG2-CG 4.33Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 2.89Å; I272-W296 HydrophobicContact CD1-CB 3.86Å; I272-W296 HydrophobicContact CD1-CE3 4.35Å; I272-W296 HydrophobicContact CD1-CG 4.41Å; I272-W296 HydrophobicContact CG2-CD2 3.9Å; I272-W296 HydrophobicContact CG2-CE3 3.59Å; I272-W296 HydrophobicContact CG2-CH2 4.37Å; I272-W296 HydrophobicContact CG2-CZ3 3.84Å; I272-P302 HydrophobicContact CB-CB 4.3Å; I272-P302 HydrophobicContact CG2-CB 3.89Å
273	K	92.2	Very high	93.2	Very high	56 Å²	56	43.9 Å²	43.9	24%	0.243	22%	0.217	C	C	.	.	H	α-helix	trans	-55.1	-43.7	179.2	-173.7	169.1	-174.5	166.4	0	111.7	E269 L276 Q277 P302 E304	E269-K273 PolarHBondContact O-N 2.81Å; K273-L276 PolarHBondContact O-N 2.95Å; K273-Q277 WeakPolarHBondContact O-CB 3.49Å; K273-Q277 PolarHBondContact O-N 3.4Å; K273-P302 VanDerWaalsContact CA-O 3.27Å; K273-P302 WeakPolarHBondContact CA-O 3.44Å; K273-P302 WeakPolarHBondContact CB-O 3.48Å; K273-E304 WeakPolarHBondContact CE-O 3.46Å; K273-E304 IonicContact NZ-OE2 2.83Å; K273-E304 PolarHBondContact NZ-OE2 2.92Å
274	R	92.6	Very high	93	Very high	114 Å²	114	45.1 Å²	45.1	43%	0.43	22%	0.224	S	C	.	.	H	α-helix	trans	-70.2	-34.9	179.3	-69.1	173.2	-175.4	-174.6	1.9	113.3	F247 D270 D271 I272 A278	F247-R274 HydrophobicContact CD1-CB 3.89Å; F247-R274 HydrophobicContact CD2-CB 4.01Å; F247-R274 HydrophobicContact CE1-CB 3.68Å; F247-R274 HydrophobicContact CE2-CB 3.83Å; F247-R274 VanDerWaalsContact CE2-CD 3.46Å; F247-R274 HydrophobicContact CE2-CG 4.25Å; F247-R274 HydrophobicContact CG-CB 4.05Å; F247-R274 HydrophobicContact CZ-CB 3.65Å; F247-R274 HydrophobicContact CZ-CG 4.27Å; D270-R274 VanDerWaalsContact O-CG 3.27Å; D270-R274 WeakPolarHBondContact O-CG 3.38Å; D270-R274 PolarHBondContact O-N 3.3Å; D271-R274 PolarHBondContact O-N 3.07Å; I272-R274 VanDerWaalsContact C-N 3.27Å; I272-R274 PolarHBondContact O-N 3.45Å; R274-A278 WeakPolarHBondContact O-CB 3.48Å; R274-A278 PolarHBondContact O-N 3.3Å
275	V	95.4	Very high	92.7	Very high	1 Å²	1	48.3 Å²	48.3	1%	0.006	24%	0.244	C	C	.	.	H	α-helix	trans	-65.6	-47.3	174.2	170.1	0	0	0	0	110.3	L206 I238 F247 I251 D271 I272 Q277 A278 A279	L206-V275 HydrophobicContact CD2-CB 4.44Å; L206-V275 HydrophobicContact CD2-CG1 3.91Å; L206-V275 HydrophobicContact CD2-CG2 3.75Å; I238-V275 HydrophobicContact CD1-CG2 3.96Å; F247-V275 HydrophobicContact CD1-CG2 3.77Å; F247-V275 HydrophobicContact CE1-CG2 3.97Å; I251-V275 HydrophobicContact CD1-CG1 4.25Å; D271-V275 WeakPolarHBondContact O-CG2 3.23Å; D271-V275 PolarHBondContact O-N 3.06Å; I272-V275 PolarHBondContact O-N 3.23Å; I272-V275 VanDerWaalsContact O-N 3.11Å; V275-Q277 VanDerWaalsContact C-N 3.35Å; V275-Q277 PolarHBondContact O-N 3.05Å; V275-A278 PolarHBondContact O-N 3.06Å; V275-A279 PolarHBondContact O-N 3.37Å
276	L	95.7	Very high	92.3	Very high	1 Å²	1	49.1 Å²	49.1	1%	0.005	25%	0.252	C	S	.	.	H	α-helix	trans	-61.6	-43.2	176.6	-63.4	176.8	0	0	0	111.4	I272 K273 A278 A279 K280 F290 W296 I303 Q306 V309 A310	I272-L276 HydrophobicContact CG2-CD1 3.99Å; I272-L276 HydrophobicContact CG2-CG 4.33Å; I272-L276 WeakPolarHBondContact O-CG 3.46Å; I272-L276 PolarHBondContact O-N 2.89Å; K273-L276 PolarHBondContact O-N 2.95Å; L276-A278 PolarHBondContact O-N 2.94Å; L276-A279 PolarHBondContact O-N 3.29Å; L276-K280 PolarHBondContact O-N 3.3Å; L276-F290 HydrophobicContact CD2-CD2 3.89Å; L276-F290 HydrophobicContact CD2-CE2 3.55Å; L276-F290 HydrophobicContact CD2-CZ 3.93Å; L276-W296 HydrophobicContact CD1-CH2 3.9Å; L276-W296 HydrophobicContact CD1-CZ2 4.03Å; L276-W296 HydrophobicContact CD2-CH2 3.96Å; L276-W296 HydrophobicContact CG-CH2 4.43Å; L276-I303 HydrophobicContact CD1-CG2 4.02Å; L276-Q306 HydrophobicContact CB-CB 3.88Å; L276-Q306 HydrophobicContact CB-CG 4.2Å; L276-Q306 HydrophobicContact CD1-CB 4.49Å; L276-V309 HydrophobicContact CB-CG1 4.47Å; L276-V309 HydrophobicContact CD2-CG1 3.93Å; L276-A310 HydrophobicContact CD1-CB 4.39Å
277	Q	94.8	Very high	92.2	Very high	108 Å²	108	51.3 Å²	51.3	51%	0.505	26%	0.262	S	S	.	.	H	α-helix	trans	-61.3	-41.5	175.3	-171.7	-177.6	15.4	0	0	112.6	K273 V275 K280 K281 Q306	K273-Q277 WeakPolarHBondContact O-CB 3.49Å; K273-Q277 PolarHBondContact O-N 3.4Å; V275-Q277 VanDerWaalsContact C-N 3.35Å; V275-Q277 PolarHBondContact O-N 3.05Å; Q277-K280 PolarHBondContact O-N 2.84Å; Q277-K281 WeakPolarHBondContact O-CB 3.37Å; Q277-K281 PolarHBondContact O-N 2.94Å; Q277-Q306 HydrophobicContact CB-CG 4.37Å
278	A	95.1	Very high	92.3	Very high	6 Å²	6	51.5 Å²	51.5	5%	0.05	26%	0.263	C	S	.	.	H	α-helix	trans	-66.9	-37.6	176.4	0	0	0	0	0	111.9	F247 I251 R274 V275 L276 K281 A282	F247-A278 HydrophobicContact CB-CB 3.84Å; I251-A278 HydrophobicContact CG1-CB 3.71Å; R274-A278 WeakPolarHBondContact O-CB 3.48Å; R274-A278 PolarHBondContact O-N 3.3Å; V275-A278 PolarHBondContact O-N 3.06Å; L276-A278 PolarHBondContact O-N 2.94Å; A278-K281 PolarHBondContact O-N 3.3Å; A278-A282 WeakPolarHBondContact O-CB 3.16Å; A278-A282 PolarHBondContact O-N 3.19Å
279	A	95.7	Very high	92.7	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.008	24%	0.244	C	C	.	.	H	α-helix	trans	-65.2	-42	173.8	0	0	0	0	0	112	I251 V275 L276 A282 N283 L284 V309	I251-A279 HydrophobicContact CD1-CB 3.99Å; V275-A279 PolarHBondContact O-N 3.37Å; L276-A279 PolarHBondContact O-N 3.29Å; A279-A282 PolarHBondContact O-N 2.83Å; A279-N283 PolarHBondContact O-N 3.02Å; A279-L284 PolarHBondContact O-N 2.94Å; A279-V309 HydrophobicContact CB-CG1 3.99Å
280	K	94.9	Very high	93.3	Very high	66 Å²	66	47.2 Å²	47.2	29%	0.287	24%	0.24	S	C	.	.	H	α-helix	trans	-58.6	-49.1	173.1	-165.2	169.2	-178.5	161.8	0	111.2	L276 Q277 A282 N283 D305 E308 V309	L276-K280 PolarHBondContact O-N 3.3Å; Q277-K280 PolarHBondContact O-N 2.84Å; K280-A282 PolarHBondContact O-N 2.96Å; K280-N283 PolarHBondContact O-N 2.8Å; K280-D305 PolarHBondContact NZ-O 3.03Å; K280-E308 IonicContact NZ-OE2 2.77Å; K280-E308 PolarHBondContact NZ-OE2 3.35Å; K280-V309 HydrophobicContact CB-CG2 3.71Å; K280-V309 HydrophobicContact CD-CG2 4.37Å; K280-V309 HydrophobicContact CG-CG2 4.04Å
281	K	94.7	Very high	94	Very high	141 Å²	141	41.8 Å²	41.8	61%	0.613	21%	0.211	S	C	*	.	H	α-helix	trans	-61	-29.5	178.3	-176.6	-174.7	169.2	-160.3	0	113	D248 Q277 A278 N283	D248-K281 IonicContact OD1-NZ 3.62Å; D248-K281 PolarHBondContact OD1-NZ 2.87Å; D248-K281 IonicContact OD2-NZ 3.64Å; D248-K281 PolarHBondContact OD2-NZ 2.95Å; Q277-K281 WeakPolarHBondContact O-CB 3.37Å; Q277-K281 PolarHBondContact O-N 2.94Å; A278-K281 PolarHBondContact O-N 3.3Å; K281-N283 VanDerWaalsContact C-N 3.3Å
282	A	94.9	Very high	94.2	Very high	50 Å²	50	41 Å²	41	41%	0.413	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	3	176.2	0	0	0	0	0	113.9	I251 A278 A279 K280 L284	I251-A282 HydrophobicContact CG2-CB 3.92Å; A278-A282 WeakPolarHBondContact O-CB 3.16Å; A278-A282 PolarHBondContact O-N 3.19Å; A279-A282 PolarHBondContact O-N 2.83Å; K280-A282 PolarHBondContact O-N 2.96Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 HydrophobicContact CB-CD1 3.88Å; A282-L284 HydrophobicContact CB-CG 4Å; A282-L284 PolarHBondContact O-N 3.48Å
283	N	94.5	Very high	94.3	Very high	145 Å²	145	41 Å²	41	78%	0.775	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.5	39.7	-174.3	-63.9	-23.7	0	0	0	113.5	A279 K280 K281	A279-N283 PolarHBondContact O-N 3.02Å; K280-N283 PolarHBondContact O-N 2.8Å; K281-N283 VanDerWaalsContact C-N 3.3Å
284	L	93.3	Very high	94.2	Very high	27 Å²	27	38.5 Å²	38.5	14%	0.141	20%	0.197	C	C	.	.			trans	-105.3	23.6	-179.8	-62.7	174	0	0	0	113.1	I251 M255 A279 A282 G286 H287 F288	I251-L284 HydrophobicContact CG2-CD1 3.42Å; I251-L284 VanDerWaalsContact CG2-CD1 3.42Å; M255-L284 HydrophobicContact CE-CD2 4.05Å; M255-L284 HydrophobicContact CG-CD1 3.69Å; M255-L284 HydrophobicContact SD-CD1 3.66Å; M255-L284 HydrophobicContact SD-CD2 3.74Å; M255-L284 HydrophobicContact SD-CG 4.36Å; A279-L284 PolarHBondContact O-N 2.94Å; A282-L284 VanDerWaalsContact C-N 3.31Å; A282-L284 HydrophobicContact CB-CD1 3.88Å; A282-L284 HydrophobicContact CB-CG 4Å; A282-L284 PolarHBondContact O-N 3.48Å; L284-G286 PolarHBondContact O-N 3.45Å; L284-H287 HydrophobicContact CB-CB 4.3Å; L284-H287 WeakPolarHBondContact O-CB 3.3Å; L284-H287 PolarHBondContact O-N 2.65Å; L284-H287 VanDerWaalsContact O-N 3.09Å; L284-F288 HydrophobicContact CB-CD2 4.48Å; L284-F288 HydrophobicContact CB-CE2 4.41Å; L284-F288 HydrophobicContact CD1-CE2 3.7Å; L284-F288 HydrophobicContact CD1-CZ 4.41Å
285	T	90.9	Very high	93.9	Very high	67 Å²	67	33.7 Å²	33.7	41%	0.411	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	129	175.5	-51.8	0	0	0	0	110.4	H287 E308 V309	T285-H287 PolarHBondContact O-N 2.6Å; T285-E308 HydrophobicContact CG2-CB 4.1Å; T285-E308 VanDerWaalsContact CG2-O 3.31Å; T285-E308 WeakPolarHBondContact CG2-O 3.16Å; T285-V309 HydrophobicContact CG2-CG2 4.26Å
286	G	88.4	Confident	93.7	Very high	18 Å²	18	33.6 Å²	33.6	19%	0.186	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.9	-3.7	-177.8	0	0	0	0	0	115.6	R261 L284	R261-G286 PolarHBondContact NH2-O 3.46Å; L284-G286 PolarHBondContact O-N 3.45Å
287	H	92.7	Very high	93.4	Very high	45 Å²	45	33.6 Å²	33.6	21%	0.208	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.7	-56.7	176.3	-178.6	62.5	0	0	0	111.4	S258 R261 L284 T285	S258-H287 PolarHBondContact O-CE1 2.96Å; S258-H287 PolarHBondContact O-NE2 3.1Å; R261-H287 PolarHBondContact NE-O 3.16Å; R261-H287 PolarHBondContact NH2-O 2.85Å; L284-H287 HydrophobicContact CB-CB 4.3Å; L284-H287 WeakPolarHBondContact O-CB 3.3Å; L284-H287 PolarHBondContact O-N 2.65Å; L284-H287 VanDerWaalsContact O-N 3.09Å; T285-H287 PolarHBondContact O-N 2.6Å
288	F	94.8	Very high	93	Very high	4 Å²	4	29.7 Å²	29.7	2%	0.018	17%	0.166	C	C	.	.	S	Bend	trans	-85.1	143.9	178.1	-63.1	-60	0	0	0	111.6	L254 M255 R261 V263 L284 F290	L254-F288 HydrophobicContact CB-CE1 3.93Å; L254-F288 HydrophobicContact CB-CE2 4.21Å; L254-F288 HydrophobicContact CB-CZ 3.52Å; M255-F288 HydrophobicContact CG-CZ 4.12Å; M255-F288 HydrophobicContact SD-CE1 4.37Å; M255-F288 HydrophobicContact SD-CE2 4.12Å; M255-F288 HydrophobicContact SD-CZ 3.56Å; M255-F288 VanDerWaalsContact SD-CZ 3.56Å; R261-F288 CarbonylContact O-C 3.56Å; R261-F288 WeakPolarHBondContact O-CA 3.24Å; V263-F288 HydrophobicContact CG2-CB 4.18Å; V263-F288 HydrophobicContact CG2-CD1 3.8Å; V263-F288 HydrophobicContact CG2-CG 4.18Å; L284-F288 HydrophobicContact CB-CD2 4.48Å; L284-F288 HydrophobicContact CB-CE2 4.41Å; L284-F288 HydrophobicContact CD1-CE2 3.7Å; L284-F288 HydrophobicContact CD1-CZ 4.41Å; F288-F290 HydrophobicContact CB-CE1 4.05Å; F288-F290 HydrophobicContact CB-CE2 4.08Å; F288-F290 HydrophobicContact CB-CZ 3.67Å; F288-F290 HydrophobicContact CG-CZ 4.5Å
289	L	94.6	Very high	92.5	Very high	4 Å²	4	31.1 Å²	31.1	2%	0.021	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	113.9	179.8	-57.5	167.5	0	0	0	107.6	W200 R261 G262 V263 W497 P505	W200-L289 HydrophobicContact CH2-CB 3.44Å; W200-L289 VanDerWaalsContact CH2-CB 3.44Å; W200-L289 HydrophobicContact CH2-CD1 4.1Å; W200-L289 HydrophobicContact CH2-CG 4.42Å; W200-L289 HydrophobicContact CZ2-CB 3.77Å; W200-L289 HydrophobicContact CZ2-CD1 3.5Å; W200-L289 HydrophobicContact CZ2-CG 4.28Å; R261-L289 HydrophobicContact CB-CD1 4.42Å; R261-L289 PolarHBondContact O-N 3.27Å; G262-L289 CarbonylContact C-O 3.58Å; G262-L289 WeakPolarHBondContact CA-O 3.25Å; V263-L289 PolarHBondContact N-O 3.04Å; L289-W497 HydrophobicContact CD2-CE3 3.82Å; L289-W497 HydrophobicContact CD2-CZ3 4.02Å; L289-P505 HydrophobicContact CD1-CB 3.64Å; L289-P505 HydrophobicContact CD1-CG 3.62Å; L289-P505 HydrophobicContact CD2-CG 4.22Å
290	F	96.3	Very high	91.9	Very high	6 Å²	6	35 Å²	35	3%	0.026	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	133.4	-170.4	-59.6	-72.6	0	0	0	111.3	V263 I265 L276 F288 W296 V309 A313 V314	V263-F290 HydrophobicContact CB-CD1 3.88Å; V263-F290 HydrophobicContact CB-CE1 4.12Å; V263-F290 HydrophobicContact CG1-CD1 4.26Å; V263-F290 HydrophobicContact CG1-CE1 4.35Å; V263-F290 HydrophobicContact CG2-CE1 4.39Å; V263-F290 WeakPolarHBondContact O-CA 3.47Å; I265-F290 HydrophobicContact CD1-CB 4.49Å; I265-F290 HydrophobicContact CD1-CD1 3.35Å; I265-F290 HydrophobicContact CD1-CE1 3.87Å; I265-F290 HydrophobicContact CD1-CG 4.22Å; I265-F290 HydrophobicContact CG1-CD1 4.2Å; L276-F290 HydrophobicContact CD2-CD2 3.89Å; L276-F290 HydrophobicContact CD2-CE2 3.55Å; L276-F290 HydrophobicContact CD2-CZ 3.93Å; F288-F290 HydrophobicContact CB-CE1 4.05Å; F288-F290 HydrophobicContact CB-CE2 4.08Å; F288-F290 HydrophobicContact CB-CZ 3.67Å; F288-F290 HydrophobicContact CG-CZ 4.5Å; F290-W296 HydrophobicContact CB-CH2 3.94Å; F290-W296 HydrophobicContact CB-CZ3 3.73Å; F290-W296 HydrophobicContact CD2-CH2 4.29Å; F290-W296 HydrophobicContact CG-CH2 4.22Å; F290-W296 HydrophobicContact CG-CZ3 4.14Å; F290-V309 HydrophobicContact CE2-CG1 4.15Å; F290-A313 HydrophobicContact CB-CB 4.07Å; F290-A313 CarbonylContact O-C 3.52Å; F290-A313 WeakPolarHBondContact O-CA 3.28Å; F290-V314 PolarHBondContact O-N 3.2Å
291	V	97.4	Very high	91.3	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	105.5	164.7	-171.1	0	0	0	0	107.5	M191 V195 M198 W200 V263 I264 I265 V314	M191-V291 HydrophobicContact CB-CG1 4.46Å; M191-V291 HydrophobicContact CE-CB 4.21Å; M191-V291 HydrophobicContact CE-CG1 3.72Å; M191-V291 WeakPolarHBondContact CE-O 3.29Å; M191-V291 HydrophobicContact CG-CG1 4.29Å; V195-V291 HydrophobicContact CG2-CG2 4.31Å; M198-V291 HydrophobicContact CE-CG2 4Å; W200-V291 HydrophobicContact CH2-CG2 4.31Å; W200-V291 HydrophobicContact CZ3-CG2 3.83Å; V263-V291 PolarHBondContact O-N 3.13Å; I264-V291 WeakPolarHBondContact CA-O 3.34Å; I264-V291 HydrophobicContact CD1-CB 3.77Å; I264-V291 HydrophobicContact CD1-CG1 4.48Å; I264-V291 HydrophobicContact CD1-CG2 3.96Å; I265-V291 PolarHBondContact N-O 3.23Å; V291-V314 CarbonylContact C-O 3.45Å; V291-V314 WeakPolarHBondContact CA-O 3.36Å
292	G	96.1	Very high	90.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	143.3	-172.7	0	0	0	0	0	113.7	V314 T315 I316	G292-V314 PolarHBondContact N-O 2.79Å; G292-T315 WeakPolarHBondContact O-CA 3.19Å; G292-I316 PolarHBondContact O-N 3.4Å
293	S	94.6	Very high	90.7	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	16%	0.156	C	C	.	.			trans	-70	-177.9	167.8	49.5	0	0	0	0	112.7	Y212 I265 S295 W296 G297	Y212-S293 PolarHBondContact OH-OG 3.29Å; I265-S293 PolarHBondContact O-N 3.1Å; I265-S293 VanDerWaalsContact O-N 3.07Å; I265-S293 PolarHBondContact O-OG 3.25Å; S293-S295 PolarHBondContact O-N 3.06Å; S293-S295 PolarHBondContact OG-OG 2.88Å; S293-W296 WeakPolarHBondContact O-CB 3.46Å; S293-W296 PolarHBondContact O-N 3.14Å; S293-W296 VanDerWaalsContact O-N 3.1Å; S293-G297 PolarHBondContact O-N 3.49Å
294	D	90.6	Very high	90.4	Very high	5 Å²	5	23.5 Å²	23.5	3%	0.027	14%	0.141	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-17.3	-176.3	72.2	-50.6	0	0	0	114	Q187 Y212 W296 K299 I316 L317 P318 K387	Q187-D294 PolarHBondContact NE2-OD1 2.87Å; Y212-D294 PolarHBondContact OH-OD1 3.2Å; D294-W296 VanDerWaalsContact C-N 3.26Å; D294-W296 PolarHBondContact O-N 3.49Å; D294-K299 PolarHBondContact O-NZ 3.15Å; D294-I316 WeakPolarHBondContact CA-O 3.48Å; D294-I316 PolarHBondContact N-O 3.49Å; D294-L317 HydrophobicContact CB-CD2 4.28Å; D294-P318 HydrophobicContact CB-CG 4.36Å; D294-K387 IonicContact OD2-NZ 3.8Å
295	S	87.3	Confident	90.3	Very high	12 Å²	12	27.1 Å²	27.1	8%	0.084	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-43.8	167.7	64.4	0	0	0	0	110.3	Y212 A267 E269 S293 K299	Y212-S295 PolarHBondContact OH-N 3.07Å; A267-S295 WeakPolarHBondContact O-CB 3.4Å; A267-S295 PolarHBondContact O-OG 3.48Å; E269-S295 WeakPolarHBondContact CG-O 3.38Å; S293-S295 PolarHBondContact O-N 3.06Å; S293-S295 PolarHBondContact OG-OG 2.88Å; S295-K299 PolarHBondContact O-NZ 2.73Å
296	W	91	Very high	90.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-66	172.1	-165.8	-29.3	0	0	0	110.1	I265 I272 L276 F290 S293 D294 A298 K299 I303 A310 A313 T315 Y478	I265-W296 HydrophobicContact CD1-CZ3 4.44Å; I272-W296 HydrophobicContact CD1-CB 3.86Å; I272-W296 HydrophobicContact CD1-CE3 4.35Å; I272-W296 HydrophobicContact CD1-CG 4.41Å; I272-W296 HydrophobicContact CG2-CD2 3.9Å; I272-W296 HydrophobicContact CG2-CE3 3.59Å; I272-W296 HydrophobicContact CG2-CH2 4.37Å; I272-W296 HydrophobicContact CG2-CZ3 3.84Å; L276-W296 HydrophobicContact CD1-CH2 3.9Å; L276-W296 HydrophobicContact CD1-CZ2 4.03Å; L276-W296 HydrophobicContact CD2-CH2 3.96Å; L276-W296 HydrophobicContact CG-CH2 4.43Å; F290-W296 HydrophobicContact CB-CH2 3.94Å; F290-W296 HydrophobicContact CB-CZ3 3.73Å; F290-W296 HydrophobicContact CD2-CH2 4.29Å; F290-W296 HydrophobicContact CG-CH2 4.22Å; F290-W296 HydrophobicContact CG-CZ3 4.14Å; S293-W296 WeakPolarHBondContact O-CB 3.46Å; S293-W296 PolarHBondContact O-N 3.14Å; S293-W296 VanDerWaalsContact O-N 3.1Å; D294-W296 VanDerWaalsContact C-N 3.26Å; D294-W296 PolarHBondContact O-N 3.49Å; W296-A298 PolarHBondContact O-N 3.1Å; W296-K299 WeakPolarHBondContact O-CB 3.41Å; W296-K299 PolarHBondContact O-N 2.91Å; W296-I303 HydrophobicContact CZ2-CG2 3.46Å; W296-I303 VanDerWaalsContact CZ2-CG2 3.46Å; W296-A310 HydrophobicContact CH2-CB 4.48Å; W296-A310 HydrophobicContact CZ2-CB 3.93Å; W296-A313 HydrophobicContact CH2-CB 3.77Å; W296-A313 HydrophobicContact CZ2-CB 3.83Å; W296-T315 HydrophobicContact CB-CG2 4.13Å; W296-T315 HydrophobicContact CD2-CG2 3.8Å; W296-T315 HydrophobicContact CE3-CG2 4.4Å; W296-T315 HydrophobicContact CG-CG2 3.67Å; W296-Y478 VanDerWaalsContact CD1-OH 3.31Å; W296-Y478 AromaticContact NE1-CZ 3.86Å; W296-Y478 PolarHBondContact NE1-OH 2.87Å
297	G	89.1	Confident	90.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	47.9	-137.6	-175.8	0	0	0	0	0	113.7	S293 T315 L317 Y478	S293-G297 PolarHBondContact O-N 3.49Å; G297-T315 VanDerWaalsContact C-OG1 3.24Å; G297-T315 WeakPolarHBondContact O-CB 3.4Å; G297-T315 PolarHBondContact O-OG1 3.45Å; G297-L317 VanDerWaalsContact CA-CG 3.43Å; G297-Y478 WeakPolarHBondContact O-CE1 3.35Å
298	A	87	Confident	90.4	Very high	27 Å²	27	29.5 Å²	29.5	22%	0.223	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.8	29.1	177.4	0	0	0	0	0	113.4	W296 L317 F466 Y478	W296-A298 PolarHBondContact O-N 3.1Å; A298-L317 HydrophobicContact CB-CD1 3.64Å; A298-F466 HydrophobicContact CB-CD1 4.03Å; A298-F466 HydrophobicContact CB-CD2 4.33Å; A298-F466 HydrophobicContact CB-CE1 4.16Å; A298-F466 HydrophobicContact CB-CE2 4.49Å; A298-F466 HydrophobicContact CB-CG 4.11Å; A298-F466 HydrophobicContact CB-CZ 4.4Å; A298-Y478 VanDerWaalsContact C-CD2 3.49Å; A298-Y478 HydrophobicContact CB-CD1 4.36Å; A298-Y478 HydrophobicContact CB-CD2 3.97Å; A298-Y478 HydrophobicContact CB-CG 3.83Å; A298-Y478 WeakPolarHBondContact O-CD2 3.42Å; A298-Y478 WeakPolarHBondContact O-CE2 3.27Å
299	K	84.6	Confident	90.3	Very high	36 Å²	36	29.5 Å²	29.5	16%	0.157	16%	0.163	C	C	.	.			trans	-86.8	144.1	-179.1	-58.6	174.4	-168.3	145	0	111.3	E269 D294 S295 W296 P302 Y478	E269-K299 IonicContact OE1-NZ 2.78Å; E269-K299 PolarHBondContact OE1-NZ 2.95Å; D294-K299 PolarHBondContact O-NZ 3.15Å; S295-K299 PolarHBondContact O-NZ 2.73Å; W296-K299 WeakPolarHBondContact O-CB 3.41Å; W296-K299 PolarHBondContact O-N 2.91Å; K299-P302 HydrophobicContact CB-CG 4.36Å; K299-P302 WeakPolarHBondContact O-CD 3.34Å; K299-Y478 VanDerWaalsContact O-CE2 3.25Å; K299-Y478 WeakPolarHBondContact O-CE2 3.1Å; K299-Y478 PolarHBondContact O-OH 3.22Å
300	S	82.8	Confident	90.2	Very high	81 Å²	81	29.3 Å²	29.3	57%	0.566	16%	0.162	S	C	*	.	S	Bend	trans	-78.4	-33.5	174.8	52	0	0	0	0	113	P302 I303 E304	S300-P302 VanDerWaalsContact C-CD 3.5Å; S300-I303 WeakPolarHBondContact O-CG1 3.27Å; S300-I303 PolarHBondContact O-N 2.7Å; S300-E304 PolarHBondContact O-N 2.82Å
301	S	82.3	Confident	90	Very high	57 Å²	57	30.6 Å²	30.6	40%	0.399	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52	-42.8	-175.6	178.5	0	0	0	0	115.8	I303	S301-I303 VanDerWaalsContact C-N 3.29Å; S301-I303 PolarHBondContact O-N 3.25Å
302	P	86.6	Confident	89.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.8	-23	-179.9	-19.4	33.3	0	0	0	114.3	E269 I272 K273 K299 S300	E269-P302 HydrophobicContact CB-CG 4.05Å; E269-P302 HydrophobicContact CG-CG 3.89Å; I272-P302 HydrophobicContact CB-CB 4.3Å; I272-P302 HydrophobicContact CG2-CB 3.89Å; K273-P302 VanDerWaalsContact CA-O 3.27Å; K273-P302 WeakPolarHBondContact CA-O 3.44Å; K273-P302 WeakPolarHBondContact CB-O 3.48Å; K299-P302 HydrophobicContact CB-CG 4.36Å; K299-P302 WeakPolarHBondContact O-CD 3.34Å; S300-P302 VanDerWaalsContact C-CD 3.5Å
303	I	90.9	Very high	89.7	Confident	5 Å²	5	30.7 Å²	30.7	3%	0.026	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-108	-6.7	-172.7	62	163.8	0	0	0	113.4	L276 W296 S300 S301 D305 Q306 E307 A310 Y468 Y478	L276-I303 HydrophobicContact CD1-CG2 4.02Å; W296-I303 HydrophobicContact CZ2-CG2 3.46Å; W296-I303 VanDerWaalsContact CZ2-CG2 3.46Å; S300-I303 WeakPolarHBondContact O-CG1 3.27Å; S300-I303 PolarHBondContact O-N 2.7Å; S301-I303 VanDerWaalsContact C-N 3.29Å; S301-I303 PolarHBondContact O-N 3.25Å; I303-D305 PolarHBondContact O-N 3.13Å; I303-Q306 CarbonylContact O-C 3.54Å; I303-Q306 VanDerWaalsContact O-C 3.29Å; I303-Q306 WeakPolarHBondContact O-CA 3.46Å; I303-Q306 PolarHBondContact O-N 3.27Å; I303-E307 PolarHBondContact O-N 3.19Å; I303-A310 HydrophobicContact CB-CB 4.01Å; I303-A310 HydrophobicContact CG2-CB 3.55Å; I303-Y468 HydrophobicContact CD1-CD2 3.62Å; I303-Y468 HydrophobicContact CD1-CE1 4.25Å; I303-Y468 HydrophobicContact CD1-CE2 3.25Å; I303-Y468 HydrophobicContact CD1-CG 4.25Å; I303-Y478 HydrophobicContact CD1-CE2 4Å; I303-Y478 WeakPolarHBondContact CD1-OH 3.31Å
304	E	87.6	Confident	89.8	Confident	100 Å²	100	30.8 Å²	30.8	47%	0.467	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.1	125.6	179.1	-174	-174.5	-143.6	0	0	111.2	K273 S300 Q306 E307	K273-E304 WeakPolarHBondContact CE-O 3.46Å; K273-E304 IonicContact NZ-OE2 2.83Å; K273-E304 PolarHBondContact NZ-OE2 2.92Å; S300-E304 PolarHBondContact O-N 2.82Å; E304-Q306 PolarHBondContact O-N 3.06Å; E304-E307 WeakPolarHBondContact CA-OE1 3.39Å
305	D	89.9	Confident	90.1	Very high	103 Å²	103	30.5 Å²	30.5	55%	0.551	17%	0.168	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.1	-1.8	-173.5	-51.5	-56.8	0	0	0	115.6	K280 I303 E307	K280-D305 PolarHBondContact NZ-O 3.03Å; I303-D305 PolarHBondContact O-N 3.13Å; D305-E307 VanDerWaalsContact CA-OE2 3.3Å; D305-E307 WeakPolarHBondContact CA-OE2 3.11Å; D305-E307 PolarHBondContact N-OE1 3Å; D305-E307 PolarHBondContact N-OE2 3.42Å
306	Q	93	Very high	90.4	Very high	16 Å²	16	30 Å²	30	8%	0.075	16%	0.164	C	C	.	.			trans	-124.7	21.3	-176	-47.4	-51.7	-45.4	0	0	112.8	L276 Q277 I303 E304 E308 V309 A310	L276-Q306 HydrophobicContact CB-CB 3.88Å; L276-Q306 HydrophobicContact CB-CG 4.2Å; L276-Q306 HydrophobicContact CD1-CB 4.49Å; Q277-Q306 HydrophobicContact CB-CG 4.37Å; I303-Q306 CarbonylContact O-C 3.54Å; I303-Q306 VanDerWaalsContact O-C 3.29Å; I303-Q306 WeakPolarHBondContact O-CA 3.46Å; I303-Q306 PolarHBondContact O-N 3.27Å; E304-Q306 PolarHBondContact O-N 3.06Å; Q306-E308 VanDerWaalsContact C-N 3.31Å; Q306-E308 PolarHBondContact O-N 3.37Å; Q306-V309 PolarHBondContact O-N 2.96Å; Q306-A310 PolarHBondContact O-N 3.49Å; Q306-A310 VanDerWaalsContact O-N 3.17Å
307	E	91.2	Very high	90.5	Very high	63 Å²	63	30.3 Å²	30.3	29%	0.294	17%	0.166	S	C	.	.	H	α-helix	trans	-57.9	-42.1	-173.2	-64.2	80.7	-177.3	0	0	112	I303 E304 D305 V309 A310 E311 Y468 M470	I303-E307 PolarHBondContact O-N 3.19Å; E304-E307 WeakPolarHBondContact CA-OE1 3.39Å; D305-E307 VanDerWaalsContact CA-OE2 3.3Å; D305-E307 WeakPolarHBondContact CA-OE2 3.11Å; D305-E307 PolarHBondContact N-OE1 3Å; D305-E307 PolarHBondContact N-OE2 3.42Å; E307-V309 PolarHBondContact O-N 3.44Å; E307-A310 CarbonylContact O-C 3.52Å; E307-A310 PolarHBondContact O-N 2.89Å; E307-E311 PolarHBondContact O-N 3.19Å; E307-Y468 HydrophobicContact CB-CE1 4.04Å; E307-Y468 WeakPolarHBondContact CB-OH 3.36Å; E307-Y468 VanDerWaalsContact CG-OH 3.28Å; E307-Y468 WeakPolarHBondContact CG-OH 3.5Å; E307-M470 VanDerWaalsContact C-SD 3.6Å; E307-M470 HydrophobicContact CB-CE 4.38Å; E307-M470 HydrophobicContact CB-SD 4.09Å
308	E	90.3	Very high	90.5	Very high	100 Å²	100	30.9 Å²	30.9	47%	0.467	17%	0.169	S	C	.	.	H	α-helix	trans	-58.3	-33.3	178.2	-61.5	172	163.2	0	0	112.8	K280 T285 Q306 M470	K280-E308 IonicContact NZ-OE2 2.77Å; K280-E308 PolarHBondContact NZ-OE2 3.35Å; T285-E308 HydrophobicContact CG2-CB 4.1Å; T285-E308 VanDerWaalsContact CG2-O 3.31Å; T285-E308 WeakPolarHBondContact CG2-O 3.16Å; Q306-E308 VanDerWaalsContact C-N 3.31Å; Q306-E308 PolarHBondContact O-N 3.37Å; E308-M470 HydrophobicContact CG-CE 4.29Å
309	V	93.3	Very high	90.4	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.03	17%	0.174	C	C	.	.	H	α-helix	trans	-83.8	-28	179.1	-176.6	0	0	0	0	111.3	L276 A279 K280 T285 F290 Q306 E307 E311	L276-V309 HydrophobicContact CB-CG1 4.47Å; L276-V309 HydrophobicContact CD2-CG1 3.93Å; A279-V309 HydrophobicContact CB-CG1 3.99Å; K280-V309 HydrophobicContact CB-CG2 3.71Å; K280-V309 HydrophobicContact CD-CG2 4.37Å; K280-V309 HydrophobicContact CG-CG2 4.04Å; T285-V309 HydrophobicContact CG2-CG2 4.26Å; F290-V309 HydrophobicContact CE2-CG1 4.15Å; Q306-V309 PolarHBondContact O-N 2.96Å; E307-V309 PolarHBondContact O-N 3.44Å; V309-E311 VanDerWaalsContact C-N 3.29Å
310	A	93.1	Very high	90.5	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-79.4	-9.6	176.3	0	0	0	0	0	113.3	L276 W296 I303 Q306 E307 G312 A313 Y468	L276-A310 HydrophobicContact CD1-CB 4.39Å; W296-A310 HydrophobicContact CH2-CB 4.48Å; W296-A310 HydrophobicContact CZ2-CB 3.93Å; I303-A310 HydrophobicContact CB-CB 4.01Å; I303-A310 HydrophobicContact CG2-CB 3.55Å; Q306-A310 PolarHBondContact O-N 3.49Å; Q306-A310 VanDerWaalsContact O-N 3.17Å; E307-A310 CarbonylContact O-C 3.52Å; E307-A310 PolarHBondContact O-N 2.89Å; A310-G312 PolarHBondContact O-N 3.41Å; A310-A313 WeakPolarHBondContact O-CB 3.33Å; A310-A313 PolarHBondContact O-N 2.9Å; A310-Y468 HydrophobicContact CB-CD1 4.03Å; A310-Y468 HydrophobicContact CB-CE1 4.44Å
311	E	92.3	Very high	90.4	Very high	32 Å²	32	32.2 Å²	32.2	15%	0.15	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.8	126.9	179	-167.8	-174.3	-171.2	0	0	111.8	E307 V309 A313 M470 S498	E307-E311 PolarHBondContact O-N 3.19Å; V309-E311 VanDerWaalsContact C-N 3.29Å; E311-A313 VanDerWaalsContact C-N 3.27Å; E311-A313 PolarHBondContact O-N 3.44Å; E311-M470 HydrophobicContact CB-SD 4.23Å; E311-M470 HydrophobicContact CG-CB 4.16Å; E311-M470 HydrophobicContact CG-CG 4.33Å; E311-M470 HydrophobicContact CG-SD 4.47Å; E311-S498 WeakPolarHBondContact OE2-CA 3.41Å
312	G	92.1	Very high	90.5	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.01	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	81.2	-2.6	-177.3	0	0	0	0	0	114.6	A310 V314 Q467 Y468 W497	A310-G312 PolarHBondContact O-N 3.41Å; G312-V314 PolarHBondContact O-N 2.92Å; G312-Q467 PolarHBondContact O-NE2 3.19Å; G312-Y468 PolarHBondContact N-O 3.05Å; G312-W497 WeakPolarHBondContact O-CZ3 3.17Å
313	A	95.3	Very high	90.6	Very high	1 Å²	1	32.8 Å²	32.8	1%	0.008	17%	0.166	C	C	.	.			trans	-60.7	130.4	175.9	0	0	0	0	0	110.8	F290 W296 A310 E311 Q467 Y468	F290-A313 HydrophobicContact CB-CB 4.07Å; F290-A313 CarbonylContact O-C 3.52Å; F290-A313 WeakPolarHBondContact O-CA 3.28Å; W296-A313 HydrophobicContact CH2-CB 3.77Å; W296-A313 HydrophobicContact CZ2-CB 3.83Å; A310-A313 WeakPolarHBondContact O-CB 3.33Å; A310-A313 PolarHBondContact O-N 2.9Å; E311-A313 VanDerWaalsContact C-N 3.27Å; E311-A313 PolarHBondContact O-N 3.44Å; A313-Q467 VanDerWaalsContact O-CA 3.3Å; A313-Q467 WeakPolarHBondContact O-CA 3.33Å; A313-Y468 PolarHBondContact O-N 3.36Å
314	V	96.3	Very high	90.4	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.012	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	125.6	176.3	-180	0	0	0	0	108.1	I194 M198 F290 V291 G292 G312 I465 F466 Q467 I481 M495 W497	I194-V314 HydrophobicContact CG2-CG1 4.02Å; M198-V314 HydrophobicContact SD-CG2 4.42Å; F290-V314 PolarHBondContact O-N 3.2Å; V291-V314 CarbonylContact C-O 3.45Å; V291-V314 WeakPolarHBondContact CA-O 3.36Å; G292-V314 PolarHBondContact N-O 2.79Å; G312-V314 PolarHBondContact O-N 2.92Å; V314-I465 HydrophobicContact CG1-CG2 3.71Å; V314-F466 CarbonylContact C-O 3.13Å; V314-F466 VanDerWaalsContact CA-O 3.31Å; V314-F466 WeakPolarHBondContact CA-O 3.19Å; V314-Q467 HydrophobicContact CG2-CG 4.26Å; V314-I481 HydrophobicContact CG1-CD1 4.33Å; V314-I481 HydrophobicContact CG2-CD1 4.45Å; V314-M495 HydrophobicContact CG2-CE 3.72Å; V314-W497 HydrophobicContact CG2-CH2 4.33Å
315	T	95.9	Very high	90.5	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	157.8	-179	65.3	0	0	0	0	110.2	G292 W296 G297 F466	G292-T315 WeakPolarHBondContact O-CA 3.19Å; W296-T315 HydrophobicContact CB-CG2 4.13Å; W296-T315 HydrophobicContact CD2-CG2 3.8Å; W296-T315 HydrophobicContact CE3-CG2 4.4Å; W296-T315 HydrophobicContact CG-CG2 3.67Å; G297-T315 VanDerWaalsContact C-OG1 3.24Å; G297-T315 WeakPolarHBondContact O-CB 3.4Å; G297-T315 PolarHBondContact O-OG1 3.45Å; T315-F466 PolarHBondContact N-O 3.41Å; T315-F466 PolarHBondContact O-N 3.49Å
316	I	94.8	Very high	90.7	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	144.9	178.9	61.2	-173	0	0	0	110.3	Q187 M191 I194 G292 D294 I465	Q187-I316 HydrophobicContact CB-CD1 4.39Å; Q187-I316 HydrophobicContact CG-CD1 3.23Å; Q187-I316 HydrophobicContact CG-CG1 4.08Å; M191-I316 HydrophobicContact CG-CD1 3.41Å; M191-I316 VanDerWaalsContact CG-CD1 3.41Å; M191-I316 HydrophobicContact SD-CD1 3.96Å; I194-I316 HydrophobicContact CD1-CG2 3.6Å; G292-I316 PolarHBondContact O-N 3.4Å; D294-I316 WeakPolarHBondContact CA-O 3.48Å; D294-I316 PolarHBondContact N-O 3.49Å; I316-I465 HydrophobicContact CG2-CG1 4.13Å; I316-I465 HydrophobicContact CG2-CG2 4.34Å
317	L	91.4	Very high	90.6	Very high	8 Å²	8	27.4 Å²	27.4	4%	0.042	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	140	173.5	-83.2	175.7	0	0	0	109.9	D294 G297 A298 K319 Y463 D464 F466	D294-L317 HydrophobicContact CB-CD2 4.28Å; G297-L317 VanDerWaalsContact CA-CG 3.43Å; A298-L317 HydrophobicContact CB-CD1 3.64Å; L317-K319 PolarHBondContact O-N 3.28Å; L317-Y463 CarbonylContact O-C 3.56Å; L317-Y463 WeakPolarHBondContact O-CA 3.25Å; L317-Y463 WeakPolarHBondContact O-CB 3.37Å; L317-D464 PolarHBondContact N-O 3.17Å; L317-D464 PolarHBondContact O-N 2.84Å; L317-F466 HydrophobicContact CB-CD2 4.47Å; L317-F466 HydrophobicContact CB-CE2 4.02Å; L317-F466 HydrophobicContact CD1-CD2 4.36Å; L317-F466 HydrophobicContact CD1-CE2 3.95Å; L317-F466 HydrophobicContact CG-CE2 4.38Å
318	P	89.5	Confident	90.7	Very high	11 Å²	11	31.1 Å²	31.1	7%	0.071	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.9	134.5	165.4	-24.1	33.3	0	0	0	109.6	D294 R320 F390 R462 Y463	D294-P318 HydrophobicContact CB-CG 4.36Å; P318-R320 PolarHBondContact O-N 3.11Å; P318-F390 HydrophobicContact CB-CE2 4.2Å; P318-F390 HydrophobicContact CB-CZ 3.85Å; P318-R462 WeakPolarHBondContact CA-O 3.16Å; P318-Y463 HydrophobicContact CB-CE1 4.5Å; P318-Y463 HydrophobicContact CG-CD1 4.26Å; P318-Y463 HydrophobicContact CG-CE1 4.01Å
319	K	86.1	Confident	90.9	Very high	74 Å²	74	27.1 Å²	27.1	32%	0.322	14%	0.142	S	C	.	.			trans	-58	124.2	-179.8	-177.4	163.3	-173.7	167.3	0	109.6	L317 R462	L317-K319 PolarHBondContact O-N 3.28Å; K319-R462 HydrophobicContact CB-CB 4.12Å; K319-R462 PolarHBondContact N-O 3.11Å
320	R	85.2	Confident	90.9	Very high	72 Å²	72	26.9 Å²	26.9	27%	0.272	14%	0.14	S	C	.	.			trans	-146	157.8	-174.7	62.7	175.8	-175.4	-171.7	10.1	110.8	P318 G386 F390	P318-R320 PolarHBondContact O-N 3.11Å; R320-G386 WeakPolarHBondContact CD-O 3.27Å; R320-G386 VanDerWaalsContact CZ-CA 3.46Å; R320-G386 PolarHBondContact NH1-O 3.45Å; R320-G386 VanDerWaalsContact NH1-O 3.11Å; R320-F390 HydrophobicContact CB-CE2 4.38Å; R320-F390 HydrophobicContact CB-CZ 4.26Å
321	A	82.1	Confident	90.9	Very high	27 Å²	27	28.8 Å²	28.8	22%	0.223	15%	0.152	C	C	.	.			trans	-126.9	156.7	171.2	0	0	0	0	0	110.7	Q389 G445 A447	A321-Q389 PolarHBondContact O-OE1 2.95Å; A321-G445 WeakPolarHBondContact CB-O 3.39Å; A321-A447 HydrophobicContact CB-CB 4.01Å
322	S	84.2	Confident	90.9	Very high	65 Å²	65	29.9 Å²	29.9	46%	0.455	16%	0.163	S	C	.	.			trans	-75.2	143.5	169.2	53.1	0	0	0	0	110.6
323	I	87.4	Confident	90.9	Very high	3 Å²	3	31.4 Å²	31.4	2%	0.015	17%	0.169	C	C	.	.			trans	-104.2	98.5	177.9	-55.6	-72.1	0	0	0	108.8	G325 F326 D327 Q384 Q389 I392 L441	I323-G325 PolarHBondContact O-N 3.46Å; I323-F326 HydrophobicContact CB-CB 4.12Å; I323-F326 HydrophobicContact CG2-CB 4.03Å; I323-F326 WeakPolarHBondContact O-CB 3.29Å; I323-F326 PolarHBondContact O-N 3.23Å; I323-D327 PolarHBondContact O-N 2.62Å; I323-D327 VanDerWaalsContact O-N 3.15Å; I323-Q384 PolarHBondContact O-NE2 3.17Å; I323-Q389 HydrophobicContact CD1-CG 4.27Å; I323-Q389 HydrophobicContact CG1-CB 4.34Å; I323-I392 HydrophobicContact CG1-CD1 4.27Å; I323-I392 HydrophobicContact CG2-CD1 4.33Å; I323-L441 HydrophobicContact CG2-CD1 4.25Å
324	D	88.3	Confident	90.7	Very high	64 Å²	64	31.9 Å²	31.9	34%	0.342	17%	0.172	S	C	.	.	H	α-helix	trans	-56.5	-37.1	-177.4	-62.3	-16.2	0	0	0	112.7	F326 D327 Q328	D324-F326 VanDerWaalsContact C-N 3.29Å; D324-F326 PolarHBondContact O-N 3.26Å; D324-D327 PolarHBondContact O-N 3.04Å; D324-Q328 WeakPolarHBondContact O-CG 3.48Å; D324-Q328 PolarHBondContact O-N 2.82Å
325	G	89.6	Confident	90.3	Very high	10 Å²	10	33.9 Å²	33.9	10%	0.103	18%	0.182	C	C	.	.	H	α-helix	trans	-62.6	-35.4	177	0	0	0	0	0	112.9	I323 Y329	I323-G325 PolarHBondContact O-N 3.46Å; G325-Y329 VanDerWaalsContact O-CB 3.27Å; G325-Y329 WeakPolarHBondContact O-CB 3.35Å; G325-Y329 PolarHBondContact O-N 3.32Å
326	F	92.4	Very high	89.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-71.7	-37.7	174.1	179.8	-97.1	0	0	0	111.3	H59 E62 A63 Y66 I323 D324 Q328 Y329 F330 Q384 V388	H59-F326 HydrophobicContact CB-CE1 4.47Å; H59-F326 HydrophobicContact CB-CZ 4.47Å; H59-F326 VanDerWaalsContact O-CZ 3.29Å; H59-F326 WeakPolarHBondContact O-CZ 3.33Å; E62-F326 HydrophobicContact CB-CE2 4.19Å; E62-F326 HydrophobicContact CB-CZ 4.2Å; A63-F326 VanDerWaalsContact CA-CE2 3.42Å; A63-F326 HydrophobicContact CB-CD2 4.29Å; A63-F326 HydrophobicContact CB-CE2 3.86Å; A63-F326 HydrophobicContact CB-CZ 4.22Å; Y66-F326 HydrophobicContact CD1-CB 4.23Å; Y66-F326 AromaticContact CD1-CD2 3.91Å; Y66-F326 HydrophobicContact CD1-CD2 3.91Å; Y66-F326 HydrophobicContact CE1-CB 4.19Å; Y66-F326 AromaticContact CG-CD2 3.96Å; Y66-F326 HydrophobicContact CG-CD2 3.96Å; I323-F326 HydrophobicContact CB-CB 4.12Å; I323-F326 HydrophobicContact CG2-CB 4.03Å; I323-F326 WeakPolarHBondContact O-CB 3.29Å; I323-F326 PolarHBondContact O-N 3.23Å; D324-F326 VanDerWaalsContact C-N 3.29Å; D324-F326 PolarHBondContact O-N 3.26Å; F326-Q328 PolarHBondContact O-N 3.35Å; F326-Y329 AromaticContact CD2-CD1 3.97Å; F326-Y329 HydrophobicContact CD2-CD1 3.97Å; F326-Y329 AromaticContact CE2-CD1 3.9Å; F326-Y329 HydrophobicContact CE2-CD1 3.9Å; F326-Y329 HydrophobicContact CE2-CE1 4.14Å; F326-Y329 CarbonylContact O-C 3.57Å; F326-Y329 WeakPolarHBondContact O-CB 3.34Å; F326-Y329 PolarHBondContact O-N 2.87Å; F326-F330 HydrophobicContact CD1-CB 4.42Å; F326-F330 HydrophobicContact CE1-CB 4.03Å; F326-F330 HydrophobicContact CE1-CD2 4.32Å; F326-F330 HydrophobicContact CE1-CG 4.28Å; F326-F330 HydrophobicContact CZ-CB 4.11Å; F326-F330 AromaticContact CZ-CD2 3.85Å; F326-F330 HydrophobicContact CZ-CD2 3.85Å; F326-F330 HydrophobicContact CZ-CG 4.23Å; F326-F330 WeakPolarHBondContact O-CB 3.35Å; F326-F330 PolarHBondContact O-N 3.22Å; F326-Q384 HydrophobicContact CD1-CG 4.18Å; F326-V388 HydrophobicContact CB-CG1 4.3Å; F326-V388 HydrophobicContact CD1-CG1 3.7Å; F326-V388 HydrophobicContact CD1-CG2 4.37Å; F326-V388 HydrophobicContact CD2-CG1 4.29Å; F326-V388 HydrophobicContact CE1-CG1 4.03Å; F326-V388 HydrophobicContact CE1-CG2 3.94Å; F326-V388 HydrophobicContact CG-CG1 3.8Å; F326-V388 HydrophobicContact CZ-CG1 4.48Å; F326-V388 HydrophobicContact CZ-CG2 4.38Å
327	D	92.6	Very high	89.5	Confident	37 Å²	37	45.7 Å²	45.7	20%	0.198	24%	0.24	C	C	.	.	H	α-helix	trans	-63.7	-44.2	179	-66.3	-13.5	0	0	0	111	I323 D324 F330 T331 Y382 Q384	I323-D327 PolarHBondContact O-N 2.62Å; I323-D327 VanDerWaalsContact O-N 3.15Å; D324-D327 PolarHBondContact O-N 3.04Å; D327-F330 PolarHBondContact O-N 3.48Å; D327-T331 WeakPolarHBondContact O-CB 2.95Å; D327-T331 WeakPolarHBondContact O-CG2 3.47Å; D327-T331 PolarHBondContact O-N 2.67Å; D327-T331 PolarHBondContact O-OG1 3.42Å; D327-Y382 HydrophobicContact CB-CE1 4.09Å; D327-Y382 PolarHBondContact OD1-OH 3.34Å; D327-Q384 WeakPolarHBondContact OD1-CB 3.32Å; D327-Q384 WeakPolarHBondContact OD1-CG 3.49Å; D327-Q384 PolarHBondContact OD1-NE2 3.37Å
328	Q	92.8	Very high	89.4	Confident	141 Å²	141	45.6 Å²	45.6	66%	0.659	24%	0.24	S	C	*	.	H	α-helix	trans	-62.1	-45.1	172.4	-67	174.7	18.1	0	0	111.3	D324 F326 F330 T331 S332	D324-Q328 WeakPolarHBondContact O-CG 3.48Å; D324-Q328 PolarHBondContact O-N 2.82Å; F326-Q328 PolarHBondContact O-N 3.35Å; Q328-F330 PolarHBondContact O-N 3.31Å; Q328-T331 PolarHBondContact O-OG1 2.89Å; Q328-S332 WeakPolarHBondContact O-CB 3.38Å; Q328-S332 PolarHBondContact O-N 2.69Å; Q328-S332 PolarHBondContact O-OG 3.23Å
329	Y	93.6	Very high	89.2	Confident	16 Å²	16	55 Å²	55	6%	0.063	27%	0.274	C	S	.	.	H	α-helix	trans	-57.8	-49.6	177.4	162.6	-84.5	0	0	0	111.2	E62 Y66 G325 F326 S332 R333 R340	E62-Y329 HydrophobicContact CB-CE1 4.21Å; E62-Y329 PolarHBondContact OE2-OH 3.17Å; Y66-Y329 HydrophobicContact CD2-CD1 4.17Å; Y66-Y329 AromaticContact CD2-CD2 3.48Å; Y66-Y329 HydrophobicContact CD2-CD2 3.48Å; Y66-Y329 VanDerWaalsContact CD2-CD2 3.48Å; Y66-Y329 HydrophobicContact CD2-CE2 4.15Å; Y66-Y329 AromaticContact CD2-CG 3.5Å; Y66-Y329 HydrophobicContact CD2-CG 3.5Å; Y66-Y329 HydrophobicContact CE2-CD2 4.32Å; Y66-Y329 HydrophobicContact CE2-CG 4.25Å; Y66-Y329 HydrophobicContact CG-CD1 4.33Å; Y66-Y329 HydrophobicContact CG-CD2 4.26Å; Y66-Y329 HydrophobicContact CG-CG 4.11Å; G325-Y329 VanDerWaalsContact O-CB 3.27Å; G325-Y329 WeakPolarHBondContact O-CB 3.35Å; G325-Y329 PolarHBondContact O-N 3.32Å; F326-Y329 AromaticContact CD2-CD1 3.97Å; F326-Y329 HydrophobicContact CD2-CD1 3.97Å; F326-Y329 AromaticContact CE2-CD1 3.9Å; F326-Y329 HydrophobicContact CE2-CD1 3.9Å; F326-Y329 HydrophobicContact CE2-CE1 4.14Å; F326-Y329 CarbonylContact O-C 3.57Å; F326-Y329 WeakPolarHBondContact O-CB 3.34Å; F326-Y329 PolarHBondContact O-N 2.87Å; Y329-S332 PolarHBondContact O-N 3.45Å; Y329-S332 PolarHBondContact O-OG 3.4Å; Y329-R333 HydrophobicContact CE1-CG 4.39Å; Y329-R333 VanDerWaalsContact CZ-NE 3.31Å; Y329-R333 WeakPolarHBondContact O-CG 3.35Å; Y329-R333 PolarHBondContact O-NE 3.08Å; Y329-R333 PolarHBondContact OH-NE 2.97Å; Y329-R340 PolarHBondContact OH-NH2 2.64Å
330	F	93.9	Very high	89.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-74.2	-43.7	-172	-169.5	-94.9	0	0	0	111.7	I58 H59 E62 F326 D327 Q328 S332 R333 F347 I376 Y382	I58-F330 HydrophobicContact CG2-CE2 4.15Å; I58-F330 HydrophobicContact CG2-CZ 4.3Å; H59-F330 AromaticContact CD2-CE1 3.67Å; H59-F330 AromaticContact CD2-CE2 3.75Å; H59-F330 AromaticContact CD2-CZ 3.26Å; H59-F330 WeakPolarHBondContact CD2-CZ 3.46Å; H59-F330 AromaticContact NE2-CE1 3.49Å; H59-F330 WeakPolarHBondContact NE2-CE1 3.33Å; H59-F330 AromaticContact NE2-CZ 3.55Å; E62-F330 HydrophobicContact CB-CD2 3.99Å; E62-F330 HydrophobicContact CB-CE2 4.07Å; E62-F330 HydrophobicContact CG-CD2 4.19Å; E62-F330 HydrophobicContact CG-CE2 3.91Å; F326-F330 HydrophobicContact CD1-CB 4.42Å; F326-F330 HydrophobicContact CE1-CB 4.03Å; F326-F330 HydrophobicContact CE1-CD2 4.32Å; F326-F330 HydrophobicContact CE1-CG 4.28Å; F326-F330 HydrophobicContact CZ-CB 4.11Å; F326-F330 AromaticContact CZ-CD2 3.85Å; F326-F330 HydrophobicContact CZ-CD2 3.85Å; F326-F330 HydrophobicContact CZ-CG 4.23Å; F326-F330 WeakPolarHBondContact O-CB 3.35Å; F326-F330 PolarHBondContact O-N 3.22Å; D327-F330 PolarHBondContact O-N 3.48Å; Q328-F330 PolarHBondContact O-N 3.31Å; F330-S332 PolarHBondContact O-N 2.99Å; F330-R333 WeakPolarHBondContact O-CB 3.28Å; F330-R333 PolarHBondContact O-N 3.25Å; F330-F347 HydrophobicContact CE1-CZ 4.18Å; F330-F347 HydrophobicContact CZ-CE1 4.09Å; F330-F347 HydrophobicContact CZ-CE2 4.5Å; F330-F347 AromaticContact CZ-CZ 3.8Å; F330-F347 HydrophobicContact CZ-CZ 3.8Å; F330-I376 HydrophobicContact CD1-CD1 4.26Å; F330-I376 HydrophobicContact CD1-CG2 4.12Å; F330-I376 HydrophobicContact CE1-CD1 3.93Å; F330-I376 HydrophobicContact CE1-CG2 4.03Å; F330-I376 HydrophobicContact CZ-CD1 4.44Å; F330-Y382 HydrophobicContact CB-CE2 4.47Å; F330-Y382 AromaticContact CD1-CD2 3.79Å; F330-Y382 HydrophobicContact CD1-CD2 3.79Å; F330-Y382 AromaticContact CD1-CE2 3.22Å; F330-Y382 HydrophobicContact CD1-CE2 3.22Å; F330-Y382 AromaticContact CD1-CZ 3.85Å; F330-Y382 AromaticContact CE1-CD2 3.93Å; F330-Y382 HydrophobicContact CE1-CD2 3.93Å; F330-Y382 AromaticContact CE1-CE2 3.65Å; F330-Y382 HydrophobicContact CE1-CE2 3.65Å; F330-Y382 HydrophobicContact CG-CE2 4.07Å
331	T	93.3	Very high	89.8	Confident	41 Å²	41	51.4 Å²	51.4	25%	0.252	26%	0.259	S	S	.	.	H	α-helix	trans	-65.7	-24.6	177.1	55.2	0	0	0	0	113.3	D327 Q328 R333 I376 Y382	D327-T331 WeakPolarHBondContact O-CB 2.95Å; D327-T331 WeakPolarHBondContact O-CG2 3.47Å; D327-T331 PolarHBondContact O-N 2.67Å; D327-T331 PolarHBondContact O-OG1 3.42Å; Q328-T331 PolarHBondContact O-OG1 2.89Å; T331-R333 VanDerWaalsContact C-N 3.29Å; T331-R333 PolarHBondContact O-N 3.42Å; T331-I376 HydrophobicContact CG2-CG2 4.38Å; T331-Y382 HydrophobicContact CG2-CD1 3.77Å; T331-Y382 HydrophobicContact CG2-CE1 3.95Å; T331-Y382 HydrophobicContact CG2-CG 4.28Å
332	S	92.6	Very high	90.2	Very high	54 Å²	54	53.2 Å²	53.2	38%	0.378	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-13.6	174	78.7	0	0	0	0	114.2	Q328 Y329 F330	Q328-S332 WeakPolarHBondContact O-CB 3.38Å; Q328-S332 PolarHBondContact O-N 2.69Å; Q328-S332 PolarHBondContact O-OG 3.23Å; Y329-S332 PolarHBondContact O-N 3.45Å; Y329-S332 PolarHBondContact O-OG 3.4Å; F330-S332 PolarHBondContact O-N 2.99Å
333	R	92	Very high	90.6	Very high	34 Å²	34	51.4 Å²	51.4	13%	0.128	25%	0.247	C	C	.	.			trans	-72.2	139.3	-175.5	-62.1	-68.2	148.7	-167.3	-3	111.3	Y329 F330 T331 F344	Y329-R333 HydrophobicContact CE1-CG 4.39Å; Y329-R333 VanDerWaalsContact CZ-NE 3.31Å; Y329-R333 WeakPolarHBondContact O-CG 3.35Å; Y329-R333 PolarHBondContact O-NE 3.08Å; Y329-R333 PolarHBondContact OH-NE 2.97Å; F330-R333 WeakPolarHBondContact O-CB 3.28Å; F330-R333 PolarHBondContact O-N 3.25Å; T331-R333 VanDerWaalsContact C-N 3.29Å; T331-R333 PolarHBondContact O-N 3.42Å; R333-F344 HydrophobicContact CB-CE1 4.32Å; R333-F344 HydrophobicContact CB-CE2 4.19Å; R333-F344 HydrophobicContact CB-CZ 3.6Å
334	S	90.5	Very high	90.9	Very high	10 Å²	10	51.3 Å²	51.3	7%	0.07	25%	0.247	C	C	.	.			trans	-138.1	166.4	174.7	70.7	0	0	0	0	109.8	E336 N337 N338	S334-E336 PolarHBondContact O-N 3.34Å; S334-E336 VanDerWaalsContact O-N 3.17Å; S334-E336 PolarHBondContact OG-N 3.38Å; S334-N337 PolarHBondContact O-N 3.22Å; S334-N337 PolarHBondContact OG-N 2.98Å; S334-N338 PolarHBondContact O-N 3.42Å
335	L	87.9	Confident	90.9	Very high	44 Å²	44	49.8 Å²	49.8	23%	0.23	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-23.8	175.1	-68.1	172.2	0	0	0	113.4	F344 A345 W348 L356	L335-F344 HydrophobicContact CD2-CD1 4.28Å; L335-A345 HydrophobicContact CD2-CB 4.35Å; L335-W348 HydrophobicContact CD1-CD2 4.13Å; L335-W348 HydrophobicContact CD1-CG 3.84Å; L335-W348 HydrophobicContact CD2-CB 3.84Å; L335-W348 HydrophobicContact CD2-CD2 4.17Å; L335-W348 HydrophobicContact CD2-CG 3.87Å; L335-W348 HydrophobicContact CG-CB 4.37Å; L335-W348 HydrophobicContact CG-CD2 3.82Å; L335-W348 HydrophobicContact CG-CE3 4.32Å; L335-W348 HydrophobicContact CG-CG 3.85Å; L335-L356 HydrophobicContact CD1-CD1 4.12Å; L335-L356 HydrophobicContact CD1-CD2 3.44Å; L335-L356 VanDerWaalsContact CD1-CD2 3.44Å; L335-L356 HydrophobicContact CD1-CG 4.4Å; L335-L356 HydrophobicContact CD2-CD1 4.24Å
336	E	85.8	Confident	91	Very high	155 Å²	155	53 Å²	53	72%	0.724	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-43.1	177.6	-62.2	-177.7	163.3	0	0	111.9	S334	S334-E336 PolarHBondContact O-N 3.34Å; S334-E336 VanDerWaalsContact O-N 3.17Å; S334-E336 PolarHBondContact OG-N 3.38Å
337	N	88.9	Confident	91	Very high	94 Å²	94	53.1 Å²	53.1	50%	0.503	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-28.3	-174.7	-171.2	14.4	0	0	0	112.7	S334	S334-N337 PolarHBondContact O-N 3.22Å; S334-N337 PolarHBondContact OG-N 2.98Å
338	N	89.1	Confident	90.9	Very high	5 Å²	5	51.3 Å²	51.3	3%	0.027	25%	0.246	C	C	.	.			trans	-108.6	73.6	-176.8	-165.2	9.7	0	0	0	112.5	E62 S334 R340 N341 F344	E62-N338 PolarHBondContact OE1-ND2 3.36Å; S334-N338 PolarHBondContact O-N 3.42Å; N338-R340 VanDerWaalsContact OD1-CG 3.24Å; N338-R340 WeakPolarHBondContact OD1-CG 3.2Å; N338-N341 PolarHBondContact OD1-N 2.87Å; N338-F344 HydrophobicContact CB-CD1 3.84Å; N338-F344 HydrophobicContact CB-CE1 3.97Å; N338-F344 HydrophobicContact CB-CG 4.21Å; N338-F344 HydrophobicContact CB-CZ 4.45Å; N338-F344 WeakPolarHBondContact ND2-CD2 3.37Å; N338-F344 WeakPolarHBondContact ND2-CG 3.27Å
339	R	85.6	Confident	90.7	Very high	209 Å²	209	45.6 Å²	45.6	79%	0.789	22%	0.219	S	C	*	.			trans	-90.2	-11.4	172	-63.7	-168.7	-178.7	178.1	2.3	113.9
340	R	90.8	Very high	90.5	Very high	65 Å²	65	46.8 Å²	46.8	25%	0.245	23%	0.227	C	C	.	.	S	Bend	trans	-72	-32.3	179.8	64.6	174.9	-178.6	-172	0	112.6	L25 I27 L65 D69 Y329 N338	L25-R340 WeakPolarHBondContact CG-O 3.32Å; I27-R340 HydrophobicContact CD1-CB 4.18Å; L65-R340 HydrophobicContact CD1-CG 4.37Å; D69-R340 VanDerWaalsContact CG-NH1 3.27Å; D69-R340 IonicContact OD1-CZ 3.96Å; D69-R340 IonicContact OD1-NH1 2.84Å; D69-R340 PolarHBondContact OD1-NH1 2.7Å; D69-R340 IonicContact OD1-NH2 3.7Å; D69-R340 IonicContact OD2-CZ 3.32Å; D69-R340 VanDerWaalsContact OD2-CZ 3.28Å; D69-R340 IonicContact OD2-NH1 3.85Å; D69-R340 PolarHBondContact OD2-NH1 2.78Å; D69-R340 IonicContact OD2-NH2 3.29Å; D69-R340 PolarHBondContact OD2-NH2 3.33Å; Y329-R340 PolarHBondContact OH-NH2 2.64Å; N338-R340 VanDerWaalsContact OD1-CG 3.24Å; N338-R340 WeakPolarHBondContact OD1-CG 3.2Å
341	N	91.8	Very high	90.3	Very high	5 Å²	5	47.7 Å²	47.7	3%	0.027	23%	0.232	C	C	.	.			trans	-91.7	107.7	177.3	-179.7	0.4	0	0	0	111.2	L25 E62 N338 W343 F344	L25-N341 HydrophobicContact CD1-CB 4.07Å; E62-N341 VanDerWaalsContact OE1-CB 3.28Å; E62-N341 WeakPolarHBondContact OE1-CB 3.49Å; E62-N341 PolarHBondContact OE1-ND2 3.39Å; N338-N341 PolarHBondContact OD1-N 2.87Å; N341-W343 PolarHBondContact O-N 3.03Å; N341-W343 PolarHBondContact OD1-N 3.46Å; N341-F344 HydrophobicContact CB-CB 3.96Å; N341-F344 VanDerWaalsContact O-CB 3.27Å; N341-F344 WeakPolarHBondContact O-CB 3.32Å; N341-F344 PolarHBondContact O-N 2.92Å; N341-F344 VanDerWaalsContact O-N 3.13Å; N341-F344 PolarHBondContact OD1-N 3.33Å
342	I	91.3	Very high	90.1	Very high	66 Å²	66	46.3 Å²	46.3	34%	0.338	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-25.7	-178.1	64	176.6	0	0	0	113.5	Q22	Q22-I342 WeakPolarHBondContact O-CD1 3.09Å
343	W	93.2	Very high	90	Very high	26 Å²	26	49.8 Å²	49.8	10%	0.098	23%	0.231	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.2	-4.5	179.4	-58.5	-70.7	0	0	0	112.8	L25 V39 H40 I52 I58 L61 I87 D89 N341 A345 E346 F347	L25-W343 HydrophobicContact CB-CH2 4.35Å; L25-W343 HydrophobicContact CB-CZ3 3.85Å; L25-W343 HydrophobicContact CD1-CZ3 4.4Å; V39-W343 HydrophobicContact CG1-CB 3.86Å; V39-W343 HydrophobicContact CG1-CD2 3.93Å; V39-W343 HydrophobicContact CG1-CE3 4.38Å; V39-W343 HydrophobicContact CG1-CG 3.7Å; V39-W343 HydrophobicContact CG2-CD2 4.29Å; V39-W343 HydrophobicContact CG2-CE3 4.07Å; V39-W343 HydrophobicContact CG2-CZ3 4.24Å; H40-W343 AromaticContact CE1-CD1 3.71Å; H40-W343 AromaticContact CE1-NE1 3.95Å; I52-W343 HydrophobicContact CD1-CB 4.37Å; I58-W343 HydrophobicContact CD1-CB 3.93Å; L61-W343 HydrophobicContact CD1-CE3 3.55Å; L61-W343 HydrophobicContact CD1-CZ3 3.57Å; I87-W343 HydrophobicContact CG2-CZ3 4.34Å; D89-W343 HydrophobicContact CB-CH2 4.47Å; D89-W343 HydrophobicContact CB-CZ2 4.04Å; N341-W343 PolarHBondContact O-N 3.03Å; N341-W343 PolarHBondContact OD1-N 3.46Å; W343-A345 VanDerWaalsContact C-N 3.31Å; W343-A345 PolarHBondContact O-N 2.85Å; W343-E346 PolarHBondContact O-N 3.33Å; W343-F347 PolarHBondContact O-N 3.47Å
344	F	92	Very high	89.8	Confident	1 Å²	1	48.4 Å²	48.4	0%	0.004	23%	0.226	C	C	.	.	H	α-helix	trans	-66.7	-32.6	-177.4	-162.7	-105.7	0	0	0	112.7	R333 L335 N338 N341 F347 W348 I376	R333-F344 HydrophobicContact CB-CE1 4.32Å; R333-F344 HydrophobicContact CB-CE2 4.19Å; R333-F344 HydrophobicContact CB-CZ 3.6Å; L335-F344 HydrophobicContact CD2-CD1 4.28Å; N338-F344 HydrophobicContact CB-CD1 3.84Å; N338-F344 HydrophobicContact CB-CE1 3.97Å; N338-F344 HydrophobicContact CB-CG 4.21Å; N338-F344 HydrophobicContact CB-CZ 4.45Å; N338-F344 WeakPolarHBondContact ND2-CD2 3.37Å; N338-F344 WeakPolarHBondContact ND2-CG 3.27Å; N341-F344 HydrophobicContact CB-CB 3.96Å; N341-F344 VanDerWaalsContact O-CB 3.27Å; N341-F344 WeakPolarHBondContact O-CB 3.32Å; N341-F344 PolarHBondContact O-N 2.92Å; N341-F344 VanDerWaalsContact O-N 3.13Å; N341-F344 PolarHBondContact OD1-N 3.33Å; F344-F347 AromaticContact CD2-CD1 3.98Å; F344-F347 HydrophobicContact CD2-CD1 3.98Å; F344-F347 AromaticContact CE2-CD1 3.83Å; F344-F347 HydrophobicContact CE2-CD1 3.83Å; F344-F347 HydrophobicContact CE2-CE1 4.02Å; F344-F347 HydrophobicContact CZ-CD1 4.36Å; F344-F347 HydrophobicContact CZ-CE1 4.41Å; F344-F347 WeakPolarHBondContact O-CB 3.38Å; F344-F347 PolarHBondContact O-N 2.87Å; F344-W348 AromaticContact CE1-CE3 3.78Å; F344-W348 HydrophobicContact CE1-CE3 3.78Å; F344-W348 HydrophobicContact CE1-CZ3 4.02Å; F344-W348 HydrophobicContact CZ-CE3 4.08Å; F344-W348 HydrophobicContact CZ-CZ3 4.13Å; F344-W348 WeakPolarHBondContact O-CB 3.45Å; F344-W348 PolarHBondContact O-N 2.82Å; F344-I376 HydrophobicContact CZ-CD1 4.2Å
345	A	89.8	Confident	89.6	Confident	32 Å²	32	51.7 Å²	51.7	26%	0.264	24%	0.239	S	C	.	.	H	α-helix	trans	-66.8	-38.5	175.2	0	0	0	0	0	112.3	L335 W343 W348 E349 L356	L335-A345 HydrophobicContact CD2-CB 4.35Å; W343-A345 VanDerWaalsContact C-N 3.31Å; W343-A345 PolarHBondContact O-N 2.85Å; A345-W348 PolarHBondContact O-N 3.31Å; A345-E349 PolarHBondContact O-N 2.82Å; A345-L356 HydrophobicContact CB-CD1 3.91Å
346	E	90.8	Very high	89.4	Confident	78 Å²	78	51.6 Å²	51.6	36%	0.364	24%	0.239	S	C	.	.	H	α-helix	trans	-69.4	-41.2	175.3	-179.6	170.9	-170.4	0	0	111.4	H40 I52 W343 W348 E349 D350	H40-E346 IonicContact CD2-OE1 3.18Å; H40-E346 IonicContact CE1-OE2 3.77Å; H40-E346 IonicContact NE2-OE1 2.71Å; H40-E346 PolarHBondContact NE2-OE1 2.92Å; H40-E346 IonicContact NE2-OE2 3.86Å; H40-E346 PolarHBondContact NE2-OE2 2.76Å; I52-E346 HydrophobicContact CB-CG 4.3Å; I52-E346 HydrophobicContact CD1-CB 3.98Å; I52-E346 HydrophobicContact CD1-CG 3.83Å; I52-E346 HydrophobicContact CG2-CG 4.37Å; W343-E346 PolarHBondContact O-N 3.33Å; E346-W348 VanDerWaalsContact C-N 3.31Å; E346-W348 PolarHBondContact O-N 2.88Å; E346-E349 PolarHBondContact O-N 3.09Å; E346-D350 PolarHBondContact O-N 3.29Å; E346-D350 VanDerWaalsContact O-N 3.09Å
347	F	92	Very high	88.9	Confident	2 Å²	2	48.5 Å²	48.5	1%	0.009	23%	0.23	C	C	.	.	H	α-helix	trans	-56.7	-45.1	172.4	165.3	-101.5	0	0	0	111.8	I52 R54 I58 F330 W343 F344 E349 D350 D351 I376	I52-F347 HydrophobicContact CD1-CB 3.94Å; R54-F347 HydrophobicContact CB-CD2 4.24Å; R54-F347 HydrophobicContact CB-CE2 3.9Å; R54-F347 HydrophobicContact CG-CD2 3.89Å; R54-F347 HydrophobicContact CG-CE2 3.83Å; I58-F347 HydrophobicContact CB-CD2 4.06Å; I58-F347 HydrophobicContact CB-CG 4.41Å; I58-F347 HydrophobicContact CD1-CB 4.4Å; I58-F347 HydrophobicContact CG1-CB 4.04Å; I58-F347 HydrophobicContact CG1-CD2 4.02Å; I58-F347 HydrophobicContact CG1-CG 4.21Å; I58-F347 HydrophobicContact CG2-CB 4.46Å; I58-F347 HydrophobicContact CG2-CD1 4.35Å; I58-F347 HydrophobicContact CG2-CD2 4.03Å; I58-F347 HydrophobicContact CG2-CE2 4.41Å; I58-F347 HydrophobicContact CG2-CG 4.01Å; F330-F347 HydrophobicContact CE1-CZ 4.18Å; F330-F347 HydrophobicContact CZ-CE1 4.09Å; F330-F347 HydrophobicContact CZ-CE2 4.5Å; F330-F347 AromaticContact CZ-CZ 3.8Å; F330-F347 HydrophobicContact CZ-CZ 3.8Å; W343-F347 PolarHBondContact O-N 3.47Å; F344-F347 AromaticContact CD2-CD1 3.98Å; F344-F347 HydrophobicContact CD2-CD1 3.98Å; F344-F347 AromaticContact CE2-CD1 3.83Å; F344-F347 HydrophobicContact CE2-CD1 3.83Å; F344-F347 HydrophobicContact CE2-CE1 4.02Å; F344-F347 HydrophobicContact CZ-CD1 4.36Å; F344-F347 HydrophobicContact CZ-CE1 4.41Å; F344-F347 WeakPolarHBondContact O-CB 3.38Å; F344-F347 PolarHBondContact O-N 2.87Å; F347-E349 VanDerWaalsContact C-N 3.34Å; F347-E349 PolarHBondContact O-N 2.97Å; F347-D350 PolarHBondContact O-N 2.58Å; F347-D351 HydrophobicContact CE1-CB 4.49Å; F347-D351 HydrophobicContact CE2-CB 4.18Å; F347-D351 HydrophobicContact CZ-CB 4.09Å; F347-D351 WeakPolarHBondContact O-CB 3.47Å; F347-D351 PolarHBondContact O-N 3.28Å; F347-I376 HydrophobicContact CE1-CD1 4.08Å
348	W	91.2	Very high	88.1	Confident	0 Å²	0	50 Å²	50	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-61.5	-41.5	179.8	-161	-88.7	0	0	0	112.7	L335 F344 A345 E346 D350 F352 E374 I376	L335-W348 HydrophobicContact CD1-CD2 4.13Å; L335-W348 HydrophobicContact CD1-CG 3.84Å; L335-W348 HydrophobicContact CD2-CB 3.84Å; L335-W348 HydrophobicContact CD2-CD2 4.17Å; L335-W348 HydrophobicContact CD2-CG 3.87Å; L335-W348 HydrophobicContact CG-CB 4.37Å; L335-W348 HydrophobicContact CG-CD2 3.82Å; L335-W348 HydrophobicContact CG-CE3 4.32Å; L335-W348 HydrophobicContact CG-CG 3.85Å; F344-W348 AromaticContact CE1-CE3 3.78Å; F344-W348 HydrophobicContact CE1-CE3 3.78Å; F344-W348 HydrophobicContact CE1-CZ3 4.02Å; F344-W348 HydrophobicContact CZ-CE3 4.08Å; F344-W348 HydrophobicContact CZ-CZ3 4.13Å; F344-W348 WeakPolarHBondContact O-CB 3.45Å; F344-W348 PolarHBondContact O-N 2.82Å; A345-W348 PolarHBondContact O-N 3.31Å; E346-W348 VanDerWaalsContact C-N 3.31Å; E346-W348 PolarHBondContact O-N 2.88Å; W348-D350 VanDerWaalsContact C-N 3.35Å; W348-F352 AromaticContact CD1-CD2 3.76Å; W348-F352 AromaticContact CD2-CD2 3.7Å; W348-F352 HydrophobicContact CD2-CD2 3.7Å; W348-F352 AromaticContact CD2-CE2 3.5Å; W348-F352 HydrophobicContact CD2-CE2 3.5Å; W348-F352 AromaticContact CE2-CD2 3.54Å; W348-F352 AromaticContact CE2-CE2 3.38Å; W348-F352 HydrophobicContact CE3-CD2 4.31Å; W348-F352 AromaticContact CE3-CE2 3.69Å; W348-F352 HydrophobicContact CE3-CE2 3.69Å; W348-F352 AromaticContact CG-CD2 3.89Å; W348-F352 HydrophobicContact CG-CD2 3.89Å; W348-F352 HydrophobicContact CG-CE2 4.18Å; W348-F352 AromaticContact CH2-CE2 3.67Å; W348-F352 HydrophobicContact CH2-CE2 3.67Å; W348-F352 HydrophobicContact CH2-CZ 4.16Å; W348-F352 HydrophobicContact CZ2-CD2 4.08Å; W348-F352 AromaticContact CZ2-CE2 3.51Å; W348-F352 HydrophobicContact CZ2-CE2 3.51Å; W348-F352 HydrophobicContact CZ2-CZ 4.18Å; W348-F352 AromaticContact CZ3-CE2 3.76Å; W348-F352 HydrophobicContact CZ3-CE2 3.76Å; W348-F352 HydrophobicContact CZ3-CZ 4.45Å; W348-F352 AromaticContact NE1-CD2 3.56Å; W348-F352 AromaticContact NE1-CE2 3.91Å; W348-F352 WeakPolarHBondContact O-CD2 3.41Å; W348-F352 PolarHBondContact O-N 3.42Å; W348-F352 VanDerWaalsContact O-N 3.16Å; W348-E374 WeakPolarHBondContact CH2-O 3.49Å; W348-E374 HydrophobicContact CZ2-CB 3.75Å; W348-E374 WeakPolarHBondContact CZ2-O 3.45Å; W348-E374 PolarHBondContact NE1-OE2 3.07Å; W348-I376 HydrophobicContact CZ3-CD1 4.06Å; W348-I376 HydrophobicContact CZ3-CG1 4Å
349	E	89.7	Confident	86.5	Confident	20 Å²	20	56.3 Å²	56.3	9%	0.093	27%	0.27	C	S	.	.	H	α-helix	trans	-63.4	-41	175.3	-70.8	-170.4	161.6	0	0	112	A345 E346 F347 K353 C354 K355 L356	A345-E349 PolarHBondContact O-N 2.82Å; E346-E349 PolarHBondContact O-N 3.09Å; F347-E349 VanDerWaalsContact C-N 3.34Å; F347-E349 PolarHBondContact O-N 2.97Å; E349-K353 VanDerWaalsContact O-CA 3.28Å; E349-K353 WeakPolarHBondContact O-CA 3.33Å; E349-K353 PolarHBondContact O-N 2.99Å; E349-K353 VanDerWaalsContact O-N 3.13Å; E349-C354 VanDerWaalsContact CA-O 3.25Å; E349-C354 WeakPolarHBondContact CA-O 3.49Å; E349-C354 WeakPolarHBondContact CB-O 3.05Å; E349-C354 WeakPolarHBondContact CG-O 3.39Å; E349-C354 PolarHBondContact O-N 3.05Å; E349-C354 VanDerWaalsContact O-N 3.1Å; E349-K355 HydrophobicContact CG-CD 4.39Å; E349-K355 WeakPolarHBondContact OE2-CD 3.19Å; E349-K355 IonicContact OE2-NZ 2.96Å; E349-K355 PolarHBondContact OE2-NZ 3.43Å; E349-L356 HydrophobicContact CG-CB 4.4Å; E349-L356 HydrophobicContact CG-CD1 4.03Å; E349-L356 HydrophobicContact CG-CG 3.95Å; E349-L356 WeakPolarHBondContact OE1-CB 3.41Å; E349-L356 PolarHBondContact OE1-N 2.77Å
350	D	88.5	Confident	85.2	Confident	41 Å²	41	50.4 Å²	50.4	22%	0.219	28%	0.275	C	S	.	.	H	α-helix	trans	-72.2	-40	178.5	-173.1	57.4	0	0	0	112.6	I52 R54 E346 F347 W348 K353	I52-D350 HydrophobicContact CG2-CB 3.67Å; R54-D350 WeakPolarHBondContact CD-OD2 3.12Å; R54-D350 WeakPolarHBondContact CG-OD2 3.18Å; R54-D350 IonicContact CZ-OD2 3.22Å; R54-D350 IonicContact NE-OD2 2.87Å; R54-D350 PolarHBondContact NE-OD2 2.02Å; E346-D350 PolarHBondContact O-N 3.29Å; E346-D350 VanDerWaalsContact O-N 3.09Å; F347-D350 PolarHBondContact O-N 2.58Å; W348-D350 VanDerWaalsContact C-N 3.35Å; D350-K353 WeakPolarHBondContact O-CD 3.5Å; D350-K353 WeakPolarHBondContact O-CE 3.47Å; D350-K353 PolarHBondContact O-NZ 2.95Å; D350-K353 IonicContact OD1-NZ 3.28Å; D350-K353 PolarHBondContact OD1-NZ 2.93Å; D350-K353 IonicContact OD2-NZ 2.69Å
351	D	89.3	Confident	84	Confident	20 Å²	20	52.9 Å²	52.9	11%	0.107	29%	0.292	C	S	.	.	H	α-helix	trans	-73.2	-43.8	-174.5	-160.3	49.5	0	0	0	112.3	R54 F347 S380	R54-D351 VanDerWaalsContact CD-OD1 3.28Å; R54-D351 WeakPolarHBondContact CD-OD1 3.09Å; R54-D351 IonicContact NH1-OD1 2.73Å; R54-D351 PolarHBondContact NH1-OD1 3.3Å; F347-D351 HydrophobicContact CE1-CB 4.49Å; F347-D351 HydrophobicContact CE2-CB 4.18Å; F347-D351 HydrophobicContact CZ-CB 4.09Å; F347-D351 WeakPolarHBondContact O-CB 3.47Å; F347-D351 PolarHBondContact O-N 3.28Å; D351-S380 WeakPolarHBondContact OD2-CB 3.43Å; D351-S380 PolarHBondContact OD2-OG 3.07Å
352	F	90.3	Very high	82.3	Confident	11 Å²	11	62.3 Å²	62.3	5%	0.048	33%	0.333	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	2.4	178.6	-63.1	-69.2	0	0	0	114	W348 C354 E374 I376 D379	W348-F352 AromaticContact CD1-CD2 3.76Å; W348-F352 AromaticContact CD2-CD2 3.7Å; W348-F352 HydrophobicContact CD2-CD2 3.7Å; W348-F352 AromaticContact CD2-CE2 3.5Å; W348-F352 HydrophobicContact CD2-CE2 3.5Å; W348-F352 AromaticContact CE2-CD2 3.54Å; W348-F352 AromaticContact CE2-CE2 3.38Å; W348-F352 HydrophobicContact CE3-CD2 4.31Å; W348-F352 AromaticContact CE3-CE2 3.69Å; W348-F352 HydrophobicContact CE3-CE2 3.69Å; W348-F352 AromaticContact CG-CD2 3.89Å; W348-F352 HydrophobicContact CG-CD2 3.89Å; W348-F352 HydrophobicContact CG-CE2 4.18Å; W348-F352 AromaticContact CH2-CE2 3.67Å; W348-F352 HydrophobicContact CH2-CE2 3.67Å; W348-F352 HydrophobicContact CH2-CZ 4.16Å; W348-F352 HydrophobicContact CZ2-CD2 4.08Å; W348-F352 AromaticContact CZ2-CE2 3.51Å; W348-F352 HydrophobicContact CZ2-CE2 3.51Å; W348-F352 HydrophobicContact CZ2-CZ 4.18Å; W348-F352 AromaticContact CZ3-CE2 3.76Å; W348-F352 HydrophobicContact CZ3-CE2 3.76Å; W348-F352 HydrophobicContact CZ3-CZ 4.45Å; W348-F352 AromaticContact NE1-CD2 3.56Å; W348-F352 AromaticContact NE1-CE2 3.91Å; W348-F352 WeakPolarHBondContact O-CD2 3.41Å; W348-F352 PolarHBondContact O-N 3.42Å; W348-F352 VanDerWaalsContact O-N 3.16Å; F352-C354 VanDerWaalsContact C-N 3.26Å; F352-C354 PolarHBondContact O-N 3.04Å; F352-E374 HydrophobicContact CB-CG 4.46Å; F352-E374 HydrophobicContact CD1-CB 3.8Å; F352-E374 HydrophobicContact CD1-CG 4.11Å; F352-E374 HydrophobicContact CD2-CB 4Å; F352-E374 HydrophobicContact CE1-CB 3.78Å; F352-E374 HydrophobicContact CE2-CB 3.98Å; F352-E374 HydrophobicContact CG-CB 3.92Å; F352-E374 HydrophobicContact CG-CG 4.09Å; F352-E374 HydrophobicContact CZ-CB 3.87Å; F352-I376 HydrophobicContact CE2-CG1 4.44Å; F352-I376 HydrophobicContact CZ-CG1 4.12Å; F352-D379 HydrophobicContact CD1-CB 4.12Å; F352-D379 HydrophobicContact CE1-CB 3.73Å
353	K	89.1	Confident	80.8	Confident	128 Å²	128	65 Å²	65	56%	0.557	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	47.7	-177.7	-56.4	-62	176.3	-150	0	112.1	E349 D350	E349-K353 VanDerWaalsContact O-CA 3.28Å; E349-K353 WeakPolarHBondContact O-CA 3.33Å; E349-K353 PolarHBondContact O-N 2.99Å; E349-K353 VanDerWaalsContact O-N 3.13Å; D350-K353 WeakPolarHBondContact O-CD 3.5Å; D350-K353 WeakPolarHBondContact O-CE 3.47Å; D350-K353 PolarHBondContact O-NZ 2.95Å; D350-K353 IonicContact OD1-NZ 3.28Å; D350-K353 PolarHBondContact OD1-NZ 2.93Å; D350-K353 IonicContact OD2-NZ 2.69Å
354	C	88.3	Confident	79.5	Confident	4 Å²	4	67.9 Å²	67.9	3%	0.027	36%	0.356	C	S	.	.			trans	-131.4	168.8	-177.7	67.8	0	0	0	0	111.4	E349 F352 R368 C370	E349-C354 VanDerWaalsContact CA-O 3.25Å; E349-C354 WeakPolarHBondContact CA-O 3.49Å; E349-C354 WeakPolarHBondContact CB-O 3.05Å; E349-C354 WeakPolarHBondContact CG-O 3.39Å; E349-C354 PolarHBondContact O-N 3.05Å; E349-C354 VanDerWaalsContact O-N 3.1Å; F352-C354 VanDerWaalsContact C-N 3.26Å; F352-C354 PolarHBondContact O-N 3.04Å; C354-R368 CarbonylContact C-O 3.59Å; C354-R368 WeakPolarHBondContact CA-O 3.44Å; C354-R368 HydrophobicContact CB-CG 4.38Å; C354-R368 WeakPolarHBondContact CB-O 3.33Å; C354-C370 HydrophobicContact CB-CB 3.97Å; C354-C370 WeakPolarHBondContact CB-SG 3.37Å; C354-C370 VanDerWaalsContact SG-CA 3.52Å; C354-C370 WeakPolarHBondContact SG-CB 3.08Å; C354-C370 CovalentContact SG-SG 2.03Å; C354-C370 PolarHBondContact SG-SG 3.5Å
355	K	86.6	Confident	78.2	Confident	80 Å²	80	72.8 Å²	72.8	35%	0.348	39%	0.389	S	S	.	.	B	Isolated β-bridge	trans	-118.4	132.7	175.6	-72.5	-63.5	178.5	-173.8	0	113	E349 R367 R368 C370	E349-K355 HydrophobicContact CG-CD 4.39Å; E349-K355 WeakPolarHBondContact OE2-CD 3.19Å; E349-K355 IonicContact OE2-NZ 2.96Å; E349-K355 PolarHBondContact OE2-NZ 3.43Å; K355-R367 HydrophobicContact CG-CB 4.42Å; K355-R368 PolarHBondContact N-O 2.88Å; K355-C370 VanDerWaalsContact C-SG 3.5Å; K355-C370 PolarHBondContact N-SG 3.4Å; K355-C370 VanDerWaalsContact N-SG 3.4Å; K355-C370 PolarHBondContact O-N 3.11Å
356	L	84.6	Confident	77.2	Confident	42 Å²	42	78.5 Å²	78.5	22%	0.22	42%	0.415	C	S	.	.			trans	-80	137.1	176.9	-70.1	167.2	0	0	0	110.1	L335 A345 E349 R358 C370	L335-L356 HydrophobicContact CD1-CD1 4.12Å; L335-L356 HydrophobicContact CD1-CD2 3.44Å; L335-L356 VanDerWaalsContact CD1-CD2 3.44Å; L335-L356 HydrophobicContact CD1-CG 4.4Å; L335-L356 HydrophobicContact CD2-CD1 4.24Å; A345-L356 HydrophobicContact CB-CD1 3.91Å; E349-L356 HydrophobicContact CG-CB 4.4Å; E349-L356 HydrophobicContact CG-CD1 4.03Å; E349-L356 HydrophobicContact CG-CG 3.95Å; E349-L356 WeakPolarHBondContact OE1-CB 3.41Å; E349-L356 PolarHBondContact OE1-N 2.77Å; L356-R358 PolarHBondContact O-N 3.17Å; L356-C370 HydrophobicContact CD2-CB 3.64Å; L356-C370 HydrophobicContact CG-CB 4.25Å
357	T	74.5	Confident	76.4	Confident	90 Å²	90	81.7 Å²	81.7	55%	0.552	42%	0.423	S	S	*	.			trans	-78.5	112	179	-49.2	0	0	0	0	109.7	K369	T357-K369 WeakPolarHBondContact OG1-CE 3.39Å; T357-K369 PolarHBondContact OG1-NZ 2.99Å
358	R	71.4	Confident	76.1	Confident	124 Å²	124	88.9 Å²	88.9	47%	0.468	45%	0.45	S	S	.	.			trans	-104.8	143	175.2	-59	-175.8	-171	-179	1.5	110.6	L356 G360 I361	L356-R358 PolarHBondContact O-N 3.17Å; R358-G360 PolarHBondContact O-N 3.49Å; R358-I361 HydrophobicContact CB-CD1 3.96Å; R358-I361 HydrophobicContact CB-CG1 4.26Å; R358-I361 HydrophobicContact CG-CD1 4.36Å; R358-I361 PolarHBondContact O-N 2.94Å
359	P	55.8	Low	75.8	Confident	138 Å²	138	94.1 Å²	94.1	90%	0.896	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	121	174	-18.1	29.5	0	0	0	110.3
360	G	59.1	Low	75.6	Confident	86 Å²	86	93.5 Å²	93.5	89%	0.887	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.1	-3.3	174.9	0	0	0	0	0	117.1	R358	R358-G360 PolarHBondContact O-N 3.49Å
361	I	64.2	Low	75.3	Confident	116 Å²	116	96.1 Å²	96.1	60%	0.595	49%	0.489	S	S	*	.	P	Polyproline II helix	trans	-97.9	123.3	174.3	-58.7	-176.3	0	0	0	109.6	R358 Y363	R358-I361 HydrophobicContact CB-CD1 3.96Å; R358-I361 HydrophobicContact CB-CG1 4.26Å; R358-I361 HydrophobicContact CG-CD1 4.36Å; R358-I361 PolarHBondContact O-N 2.94Å; I361-Y363 PolarHBondContact O-N 2.73Å
362	K	57.6	Low	74.9	Confident	204 Å²	204	96.8 Å²	96.8	89%	0.887	50%	0.5	S	S	*	.	P	Polyproline II helix	trans	-66.7	125.1	173.4	-78.6	-175	177.3	-179.6	0	109.5
363	Y	60.1	Low	74.7	Confident	122 Å²	122	103.5 Å²	103.5	48%	0.478	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-68.5	132.2	177.9	-178.4	-100.2	0	0	0	110.8	I361 R367 K369	I361-Y363 PolarHBondContact O-N 2.73Å; Y363-R367 PolarHBondContact OH-O 2.79Å; Y363-K369 HydrophobicContact CE2-CB 3.95Å
364	D	66	Low	74.6	Confident	86 Å²	86	97.6 Å²	97.6	46%	0.46	51%	0.506	S	S	.	.			trans	-86	115.6	170.7	-172.1	-2.9	0	0	0	108.6	D366 R367	D364-D366 PolarHBondContact O-N 3.05Å; D364-D366 VanDerWaalsContact O-N 3.13Å; D364-R367 PolarHBondContact O-N 3.37Å
365	P	63.4	Low	74.7	Confident	105 Å²	105	102.4 Å²	102.4	68%	0.682	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-20.7	-174.4	22	-31.7	0	0	0	114.6
366	D	69.2	Low	74.9	Confident	151 Å²	151	98.9 Å²	98.9	81%	0.807	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-7	-178	-76.5	-23.4	0	0	0	114.5	D364	D364-D366 PolarHBondContact O-N 3.05Å; D364-D366 VanDerWaalsContact O-N 3.13Å
367	R	72.9	Confident	75	Confident	146 Å²	146	100.4 Å²	100.4	55%	0.551	52%	0.523	S	S	*	.	S	Bend	trans	-109.5	130.6	-178.8	-76.2	-173.7	164.5	-176	-6.4	112.5	K355 Y363 D364 K369	K355-R367 HydrophobicContact CG-CB 4.42Å; Y363-R367 PolarHBondContact OH-O 2.79Å; D364-R367 PolarHBondContact O-N 3.37Å; R367-K369 PolarHBondContact O-N 3.47Å
368	R	85.6	Confident	75.6	Confident	153 Å²	153	104 Å²	104	58%	0.577	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-55.1	130	176.5	-178.5	-177.7	176	-166	0.3	111.1	C354 K355	C354-R368 CarbonylContact C-O 3.59Å; C354-R368 WeakPolarHBondContact CA-O 3.44Å; C354-R368 HydrophobicContact CB-CG 4.38Å; C354-R368 WeakPolarHBondContact CB-O 3.33Å; K355-R368 PolarHBondContact N-O 2.88Å
369	K	85	Confident	76.2	Confident	109 Å²	109	101.8 Å²	101.8	47%	0.474	52%	0.524	S	S	.	.	B	Isolated β-bridge	trans	-76.5	136.2	171.6	-179	170.5	165.6	165.3	0	110.8	T357 Y363 R367	T357-K369 WeakPolarHBondContact OG1-CE 3.39Å; T357-K369 PolarHBondContact OG1-NZ 2.99Å; Y363-K369 HydrophobicContact CE2-CB 3.95Å; R367-K369 PolarHBondContact O-N 3.47Å
370	C	86.2	Confident	77.6	Confident	8 Å²	8	95.9 Å²	95.9	5%	0.054	49%	0.486	C	S	.	.	P	Polyproline II helix	trans	-72.1	131.6	170.1	-51.4	0	0	0	0	109.7	C354 K355 L356	C354-C370 HydrophobicContact CB-CB 3.97Å; C354-C370 WeakPolarHBondContact CB-SG 3.37Å; C354-C370 VanDerWaalsContact SG-CA 3.52Å; C354-C370 WeakPolarHBondContact SG-CB 3.08Å; C354-C370 CovalentContact SG-SG 2.03Å; C354-C370 PolarHBondContact SG-SG 3.5Å; K355-C370 VanDerWaalsContact C-SG 3.5Å; K355-C370 PolarHBondContact N-SG 3.4Å; K355-C370 VanDerWaalsContact N-SG 3.4Å; K355-C370 PolarHBondContact O-N 3.11Å; L356-C370 HydrophobicContact CD2-CB 3.64Å; L356-C370 HydrophobicContact CG-CB 4.25Å
371	T	83.2	Confident	78.8	Confident	96 Å²	96	100.9 Å²	100.9	59%	0.589	49%	0.486	S	S	*	.			trans	-87	-26.5	-178.5	59.5	0	0	0	0	112.6	E373 E374	T371-E373 VanDerWaalsContact C-N 3.27Å; T371-E373 PolarHBondContact OG1-N 3.33Å; T371-E374 PolarHBondContact N-OE1 3.02Å; T371-E374 PolarHBondContact N-OE2 2.88Å; T371-E374 PolarHBondContact OG1-OE1 3Å; T371-E374 PolarHBondContact OG1-OE2 3.25Å
372	G	80.4	Confident	79.9	Confident	34 Å²	34	97.5 Å²	97.5	35%	0.351	47%	0.466	S	S	.	.	S	Bend	trans	87.6	-9	-172	0	0	0	0	0	113.3	E374	G372-E374 WeakPolarHBondContact CA-OE2 3.38Å; G372-E374 PolarHBondContact N-OE2 2.87Å
373	E	84.6	Confident	81.2	Confident	152 Å²	152	94.5 Å²	94.5	71%	0.71	46%	0.455	S	S	*	.			trans	-90	-6.2	176.2	-63.2	-171.2	168.1	0	0	113.2	T371 R378	T371-E373 VanDerWaalsContact C-N 3.27Å; T371-E373 PolarHBondContact OG1-N 3.33Å; E373-R378 PolarHBondContact O-NH2 2.84Å
374	E	88.9	Confident	82.5	Confident	4 Å²	4	89.8 Å²	89.8	2%	0.019	44%	0.438	C	S	.	.			trans	-60.2	145.8	177.8	-57.9	84.6	-173.2	0	0	110.9	W348 F352 T371 G372 D379	W348-E374 WeakPolarHBondContact CH2-O 3.49Å; W348-E374 HydrophobicContact CZ2-CB 3.75Å; W348-E374 WeakPolarHBondContact CZ2-O 3.45Å; W348-E374 PolarHBondContact NE1-OE2 3.07Å; F352-E374 HydrophobicContact CB-CG 4.46Å; F352-E374 HydrophobicContact CD1-CB 3.8Å; F352-E374 HydrophobicContact CD1-CG 4.11Å; F352-E374 HydrophobicContact CD2-CB 4Å; F352-E374 HydrophobicContact CE1-CB 3.78Å; F352-E374 HydrophobicContact CE2-CB 3.98Å; F352-E374 HydrophobicContact CG-CB 3.92Å; F352-E374 HydrophobicContact CG-CG 4.09Å; F352-E374 HydrophobicContact CZ-CB 3.87Å; T371-E374 PolarHBondContact N-OE1 3.02Å; T371-E374 PolarHBondContact N-OE2 2.88Å; T371-E374 PolarHBondContact OG1-OE1 3Å; T371-E374 PolarHBondContact OG1-OE2 3.25Å; G372-E374 WeakPolarHBondContact CA-OE2 3.38Å; G372-E374 PolarHBondContact N-OE2 2.87Å; E374-D379 WeakPolarHBondContact CA-OD2 3.27Å
375	R	89.9	Confident	83.6	Confident	105 Å²	105	86.2 Å²	86.2	40%	0.396	42%	0.418	S	S	.	.			trans	-131.5	132.8	178.9	-65.4	-65.4	179.4	155.9	-0.9	110.8	R378 D379	R375-R378 HydrophobicContact CB-CB 4.09Å; R375-R378 PolarHBondContact O-N 3.05Å; R375-D379 PolarHBondContact N-OD2 3Å; R375-D379 PolarHBondContact O-N 3.27Å
376	I	90.1	Very high	84.6	Confident	6 Å²	6	81.7 Å²	81.7	3%	0.031	39%	0.391	C	S	.	.	B	Isolated β-bridge	trans	-61.2	143.8	175.2	-58.4	170.4	0	0	0	108.4	F330 T331 F344 F347 W348 F352 R378 Y382	F330-I376 HydrophobicContact CD1-CD1 4.26Å; F330-I376 HydrophobicContact CD1-CG2 4.12Å; F330-I376 HydrophobicContact CE1-CD1 3.93Å; F330-I376 HydrophobicContact CE1-CG2 4.03Å; F330-I376 HydrophobicContact CZ-CD1 4.44Å; T331-I376 HydrophobicContact CG2-CG2 4.38Å; F344-I376 HydrophobicContact CZ-CD1 4.2Å; F347-I376 HydrophobicContact CE1-CD1 4.08Å; W348-I376 HydrophobicContact CZ3-CD1 4.06Å; W348-I376 HydrophobicContact CZ3-CG1 4Å; F352-I376 HydrophobicContact CE2-CG1 4.44Å; F352-I376 HydrophobicContact CZ-CG1 4.12Å; I376-R378 PolarHBondContact O-N 3.1Å; I376-Y382 HydrophobicContact CG2-CD2 4.01Å; I376-Y382 HydrophobicContact CG2-CG 4.12Å
377	S	87.7	Confident	85.5	Confident	74 Å²	74	75.9 Å²	75.9	52%	0.517	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	-33.4	-172.2	-174.7	0	0	0	0	115.5	S380	S377-S380 CarbonylContact C-O 3.29Å; S377-S380 VanDerWaalsContact C-O 3.31Å; S377-S380 WeakPolarHBondContact CA-O 3.38Å; S377-S380 PolarHBondContact N-O 3.33Å; S377-S380 VanDerWaalsContact N-O 3.14Å
378	R	86.6	Confident	86.4	Confident	164 Å²	164	68.9 Å²	68.9	62%	0.619	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	-52.3	175.7	-171.1	-172.5	71.8	-161.9	-5.4	112.3	E373 R375 I376	E373-R378 PolarHBondContact O-NH2 2.84Å; R375-R378 HydrophobicContact CB-CB 4.09Å; R375-R378 PolarHBondContact O-N 3.05Å; I376-R378 PolarHBondContact O-N 3.1Å
379	D	84.4	Confident	86.7	Confident	79 Å²	79	62 Å²	62	42%	0.422	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.7	-5.8	-174.1	-49.4	-47.7	0	0	0	112.2	F352 E374 R375	F352-D379 HydrophobicContact CD1-CB 4.12Å; F352-D379 HydrophobicContact CE1-CB 3.73Å; E374-D379 WeakPolarHBondContact CA-OD2 3.27Å; R375-D379 PolarHBondContact N-OD2 3Å; R375-D379 PolarHBondContact O-N 3.27Å
380	S	85	Confident	87	Confident	13 Å²	13	57.5 Å²	57.5	9%	0.091	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-136.7	150	171.6	67.1	0	0	0	0	111.2	D351 S377 Y382	D351-S380 WeakPolarHBondContact OD2-CB 3.43Å; D351-S380 PolarHBondContact OD2-OG 3.07Å; S377-S380 CarbonylContact C-O 3.29Å; S377-S380 VanDerWaalsContact C-O 3.31Å; S377-S380 WeakPolarHBondContact CA-O 3.38Å; S377-S380 PolarHBondContact N-O 3.33Å; S377-S380 VanDerWaalsContact N-O 3.14Å; S380-Y382 PolarHBondContact O-N 3.49Å
381	Q	82.9	Confident	87.5	Confident	192 Å²	192	57.1 Å²	57.1	90%	0.897	28%	0.284	S	S	*	.			trans	-72.6	122.2	175.8	-70.4	-175.6	-3.3	0	0	109.6
382	Y	87.3	Confident	88	Confident	44 Å²	44	52.6 Å²	52.6	17%	0.173	26%	0.256	C	S	.	.			trans	-117.6	120.7	178.2	175.3	-107.8	0	0	0	110.2	H59 D327 F330 T331 I376 S380	H59-Y382 AromaticContact CE1-CD2 3.94Å; H59-Y382 AromaticContact CE1-CE2 3.64Å; H59-Y382 AromaticContact NE2-CE2 3.89Å; D327-Y382 HydrophobicContact CB-CE1 4.09Å; D327-Y382 PolarHBondContact OD1-OH 3.34Å; F330-Y382 HydrophobicContact CB-CE2 4.47Å; F330-Y382 AromaticContact CD1-CD2 3.79Å; F330-Y382 HydrophobicContact CD1-CD2 3.79Å; F330-Y382 AromaticContact CD1-CE2 3.22Å; F330-Y382 HydrophobicContact CD1-CE2 3.22Å; F330-Y382 AromaticContact CD1-CZ 3.85Å; F330-Y382 AromaticContact CE1-CD2 3.93Å; F330-Y382 HydrophobicContact CE1-CD2 3.93Å; F330-Y382 AromaticContact CE1-CE2 3.65Å; F330-Y382 HydrophobicContact CE1-CE2 3.65Å; F330-Y382 HydrophobicContact CG-CE2 4.07Å; T331-Y382 HydrophobicContact CG2-CD1 3.77Å; T331-Y382 HydrophobicContact CG2-CE1 3.95Å; T331-Y382 HydrophobicContact CG2-CG 4.28Å; I376-Y382 HydrophobicContact CG2-CD2 4.01Å; I376-Y382 HydrophobicContact CG2-CG 4.12Å; S380-Y382 PolarHBondContact O-N 3.49Å
383	E	86.1	Confident	88.6	Confident	141 Å²	141	51.4 Å²	51.4	66%	0.659	24%	0.242	S	C	*	.			trans	-128.8	132.6	166.6	-171	-179	165.8	0	0	108.1	H59 E385	H59-E383 PolarHBondContact CE1-O 3.09Å; E383-E385 PolarHBondContact O-N 3.33Å
384	Q	87.6	Confident	89.1	Confident	24 Å²	24	44.1 Å²	44.1	11%	0.112	21%	0.208	C	C	.	.			trans	-65.6	130	-178.9	-167.8	-177.5	67.2	0	0	110.5	I323 F326 D327 G386 V388	I323-Q384 PolarHBondContact O-NE2 3.17Å; F326-Q384 HydrophobicContact CD1-CG 4.18Å; D327-Q384 WeakPolarHBondContact OD1-CB 3.32Å; D327-Q384 WeakPolarHBondContact OD1-CG 3.49Å; D327-Q384 PolarHBondContact OD1-NE2 3.37Å; Q384-G386 PolarHBondContact O-N 3.39Å; Q384-V388 HydrophobicContact CG-CB 4.3Å; Q384-V388 HydrophobicContact CG-CG1 4.46Å; Q384-V388 HydrophobicContact CG-CG2 4.26Å
385	E	87.9	Confident	89.4	Confident	11 Å²	11	44 Å²	44	5%	0.051	21%	0.207	C	C	.	.			trans	-73.6	119.9	176.9	-163.3	-83.2	157.6	0	0	108.7	E55 H59 R60 E383 K387 V388	E55-E385 HydrophobicContact CB-CB 4.14Å; E55-E385 HydrophobicContact CB-CG 4.01Å; H59-E385 HydrophobicContact CB-CB 4.22Å; R60-E385 IonicContact CZ-OE1 3.71Å; R60-E385 IonicContact CZ-OE2 2.7Å; R60-E385 IonicContact NE-OE1 3.99Å; R60-E385 IonicContact NE-OE2 3.47Å; R60-E385 PolarHBondContact NE-OE2 3.49Å; R60-E385 IonicContact NH2-OE1 2.79Å; R60-E385 PolarHBondContact NH2-OE1 3.24Å; R60-E385 IonicContact NH2-OE2 3.28Å; E383-E385 PolarHBondContact O-N 3.33Å; E385-K387 VanDerWaalsContact CD-N 3.34Å; E385-K387 PolarHBondContact O-N 3.31Å; E385-K387 VanDerWaalsContact OE2-CA 3.31Å; E385-K387 WeakPolarHBondContact OE2-CA 3.31Å; E385-K387 VanDerWaalsContact OE2-CB 3.25Å; E385-K387 WeakPolarHBondContact OE2-CB 3.46Å; E385-K387 PolarHBondContact OE2-N 2.82Å; E385-V388 HydrophobicContact CB-CG2 4.37Å; E385-V388 VanDerWaalsContact O-CB 3.22Å; E385-V388 WeakPolarHBondContact O-CB 3.39Å; E385-V388 WeakPolarHBondContact O-CG2 3.33Å; E385-V388 PolarHBondContact O-N 2.96Å
386	G	84.6	Confident	89.6	Confident	10 Å²	10	39.8 Å²	39.8	10%	0.103	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	20.7	-170	0	0	0	0	0	116.4	R320 Q384	R320-G386 WeakPolarHBondContact CD-O 3.27Å; R320-G386 VanDerWaalsContact CZ-CA 3.46Å; R320-G386 PolarHBondContact NH1-O 3.45Å; R320-G386 VanDerWaalsContact NH1-O 3.11Å; Q384-G386 PolarHBondContact O-N 3.39Å
387	K	88.8	Confident	89.9	Confident	28 Å²	28	39.5 Å²	39.5	12%	0.122	19%	0.19	C	C	.	.	T	Hydrogen-bonded Turn	trans	-100.3	1.9	156.9	-56	-162.4	-178.8	-167.9	0	112.2	A162 D294 E385 Q389 F390 V391	A162-K387 HydrophobicContact CB-CD 3.55Å; D294-K387 IonicContact OD2-NZ 3.8Å; E385-K387 VanDerWaalsContact CD-N 3.34Å; E385-K387 PolarHBondContact O-N 3.31Å; E385-K387 VanDerWaalsContact OE2-CA 3.31Å; E385-K387 WeakPolarHBondContact OE2-CA 3.31Å; E385-K387 VanDerWaalsContact OE2-CB 3.25Å; E385-K387 WeakPolarHBondContact OE2-CB 3.46Å; E385-K387 PolarHBondContact OE2-N 2.82Å; K387-Q389 VanDerWaalsContact C-N 3.31Å; K387-Q389 PolarHBondContact O-N 2.97Å; K387-F390 HydrophobicContact CB-CD2 4.17Å; K387-F390 HydrophobicContact CG-CD2 4.25Å; K387-F390 PolarHBondContact O-N 3.44Å; K387-F390 VanDerWaalsContact O-N 3.15Å; K387-V391 PolarHBondContact O-N 3.31Å; K387-V391 VanDerWaalsContact O-N 3.08Å
388	V	92.3	Very high	90.3	Very high	0 Å²	0	36 Å²	36	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-53.3	-46.9	172.5	162.2	0	0	0	0	111.3	H59 A63 F326 Q384 E385 F390 V391 I392	H59-V388 HydrophobicContact CB-CG2 4.06Å; A63-V388 HydrophobicContact CB-CB 4.41Å; A63-V388 HydrophobicContact CB-CG1 3.9Å; A63-V388 HydrophobicContact CB-CG2 4.3Å; F326-V388 HydrophobicContact CB-CG1 4.3Å; F326-V388 HydrophobicContact CD1-CG1 3.7Å; F326-V388 HydrophobicContact CD1-CG2 4.37Å; F326-V388 HydrophobicContact CD2-CG1 4.29Å; F326-V388 HydrophobicContact CE1-CG1 4.03Å; F326-V388 HydrophobicContact CE1-CG2 3.94Å; F326-V388 HydrophobicContact CG-CG1 3.8Å; F326-V388 HydrophobicContact CZ-CG1 4.48Å; F326-V388 HydrophobicContact CZ-CG2 4.38Å; Q384-V388 HydrophobicContact CG-CB 4.3Å; Q384-V388 HydrophobicContact CG-CG1 4.46Å; Q384-V388 HydrophobicContact CG-CG2 4.26Å; E385-V388 HydrophobicContact CB-CG2 4.37Å; E385-V388 VanDerWaalsContact O-CB 3.22Å; E385-V388 WeakPolarHBondContact O-CB 3.39Å; E385-V388 WeakPolarHBondContact O-CG2 3.33Å; E385-V388 PolarHBondContact O-N 2.96Å; V388-F390 VanDerWaalsContact C-N 3.34Å; V388-F390 PolarHBondContact O-N 3.02Å; V388-V391 PolarHBondContact O-N 3.01Å; V388-V391 VanDerWaalsContact O-N 3.13Å; V388-I392 HydrophobicContact CG1-CD1 3.88Å; V388-I392 WeakPolarHBondContact O-CG1 3.4Å; V388-I392 PolarHBondContact O-N 3.04Å; V388-I392 VanDerWaalsContact O-N 3.08Å
389	Q	90.5	Very high	90.7	Very high	9 Å²	9	28.1 Å²	28.1	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-54.6	-49.6	176	-174.1	-163.6	-34.8	0	0	111.4	A321 I323 K387 V391 I392 D393	A321-Q389 PolarHBondContact O-OE1 2.95Å; I323-Q389 HydrophobicContact CD1-CG 4.27Å; I323-Q389 HydrophobicContact CG1-CB 4.34Å; K387-Q389 VanDerWaalsContact C-N 3.31Å; K387-Q389 PolarHBondContact O-N 2.97Å; Q389-V391 VanDerWaalsContact C-N 3.28Å; Q389-V391 PolarHBondContact O-N 2.92Å; Q389-I392 WeakPolarHBondContact O-CB 3.34Å; Q389-I392 PolarHBondContact O-N 3.29Å; Q389-I392 VanDerWaalsContact O-N 3.1Å; Q389-D393 PolarHBondContact NE2-OD2 3.36Å; Q389-D393 VanDerWaalsContact NE2-OD2 3.14Å; Q389-D393 WeakPolarHBondContact O-CB 3.34Å; Q389-D393 PolarHBondContact O-N 2.93Å
390	F	92.6	Very high	91.2	Very high	13 Å²	13	26.8 Å²	26.8	6%	0.057	13%	0.127	C	C	.	.	H	α-helix	trans	-64.3	-30	-179.4	-60.1	-55.1	0	0	0	113.2	Y161 V180 V181 P318 R320 K387 V388 A394	Y161-F390 WeakPolarHBondContact O-CB 3.5Å; V180-F390 HydrophobicContact CG2-CB 3.93Å; V180-F390 HydrophobicContact CG2-CD1 4.4Å; V180-F390 VanDerWaalsContact CG2-O 3.26Å; V180-F390 WeakPolarHBondContact CG2-O 3.27Å; V181-F390 HydrophobicContact CG1-CB 4.1Å; V181-F390 HydrophobicContact CG1-CD1 3.86Å; V181-F390 HydrophobicContact CG1-CD2 3.77Å; V181-F390 HydrophobicContact CG1-CE1 4.24Å; V181-F390 HydrophobicContact CG1-CE2 4.17Å; V181-F390 HydrophobicContact CG1-CG 3.62Å; V181-F390 HydrophobicContact CG1-CZ 4.4Å; P318-F390 HydrophobicContact CB-CE2 4.2Å; P318-F390 HydrophobicContact CB-CZ 3.85Å; R320-F390 HydrophobicContact CB-CE2 4.38Å; R320-F390 HydrophobicContact CB-CZ 4.26Å; K387-F390 HydrophobicContact CB-CD2 4.17Å; K387-F390 HydrophobicContact CG-CD2 4.25Å; K387-F390 PolarHBondContact O-N 3.44Å; K387-F390 VanDerWaalsContact O-N 3.15Å; V388-F390 VanDerWaalsContact C-N 3.34Å; V388-F390 PolarHBondContact O-N 3.02Å; F390-A394 WeakPolarHBondContact O-CB 3.38Å; F390-A394 PolarHBondContact O-N 3.41Å
391	V	95.4	Very high	91.8	Very high	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-66.6	-47.4	172.5	177.6	0	0	0	0	110.1	F37 R60 A63 M64 Y161 K387 V388 Q389 A394 V395	F37-V391 HydrophobicContact CE1-CG1 3.96Å; F37-V391 HydrophobicContact CE1-CG2 4.23Å; F37-V391 HydrophobicContact CZ-CG1 4.11Å; R60-V391 HydrophobicContact CB-CG2 4.02Å; R60-V391 HydrophobicContact CG-CG2 4.26Å; A63-V391 HydrophobicContact CB-CB 4.16Å; A63-V391 HydrophobicContact CB-CG1 4.1Å; M64-V391 HydrophobicContact CB-CG1 4.06Å; Y161-V391 HydrophobicContact CD1-CG2 3.96Å; Y161-V391 HydrophobicContact CD2-CG2 3.61Å; Y161-V391 HydrophobicContact CE1-CG2 4.34Å; Y161-V391 HydrophobicContact CE2-CG2 4.05Å; Y161-V391 HydrophobicContact CG-CG2 3.58Å; K387-V391 PolarHBondContact O-N 3.31Å; K387-V391 VanDerWaalsContact O-N 3.08Å; V388-V391 PolarHBondContact O-N 3.01Å; V388-V391 VanDerWaalsContact O-N 3.13Å; Q389-V391 VanDerWaalsContact C-N 3.28Å; Q389-V391 PolarHBondContact O-N 2.92Å; V391-A394 PolarHBondContact O-N 3.49Å; V391-V395 WeakPolarHBondContact O-CG2 3.5Å; V391-V395 PolarHBondContact O-N 2.94Å; V391-V395 VanDerWaalsContact O-N 3.11Å
392	I	93.9	Very high	92.4	Very high	1 Å²	1	17 Å²	17	1%	0.005	8%	0.08	C	C	.	.	H	α-helix	trans	-60.1	-49.6	178.3	-64.7	169.7	0	0	0	109.6	A63 Y66 A67 I323 V388 Q389 A394 V395 Y396	A63-I392 HydrophobicContact CB-CG1 4.21Å; Y66-I392 HydrophobicContact CD1-CD1 3.94Å; Y66-I392 HydrophobicContact CD1-CG1 4.48Å; Y66-I392 HydrophobicContact CE1-CD1 4.13Å; A67-I392 HydrophobicContact CB-CG1 4.38Å; A67-I392 HydrophobicContact CB-CG2 4.28Å; I323-I392 HydrophobicContact CG1-CD1 4.27Å; I323-I392 HydrophobicContact CG2-CD1 4.33Å; V388-I392 HydrophobicContact CG1-CD1 3.88Å; V388-I392 WeakPolarHBondContact O-CG1 3.4Å; V388-I392 PolarHBondContact O-N 3.04Å; V388-I392 VanDerWaalsContact O-N 3.08Å; Q389-I392 WeakPolarHBondContact O-CB 3.34Å; Q389-I392 PolarHBondContact O-N 3.29Å; Q389-I392 VanDerWaalsContact O-N 3.1Å; I392-A394 VanDerWaalsContact C-N 3.27Å; I392-A394 PolarHBondContact O-N 3.4Å; I392-V395 PolarHBondContact O-N 3.15Å; I392-V395 VanDerWaalsContact O-N 3.09Å; I392-Y396 HydrophobicContact CG2-CD2 3.55Å; I392-Y396 HydrophobicContact CG2-CE2 3.62Å; I392-Y396 WeakPolarHBondContact O-CD2 3.49Å; I392-Y396 PolarHBondContact O-N 3.2Å
393	D	92.6	Very high	92.7	Very high	9 Å²	9	16.8 Å²	16.8	5%	0.048	8%	0.08	C	C	.	.	H	α-helix	trans	-56.6	-39.7	178.3	-66.8	-11.6	0	0	0	111.9	Q389 A397 V451	Q389-D393 PolarHBondContact NE2-OD2 3.36Å; Q389-D393 VanDerWaalsContact NE2-OD2 3.14Å; Q389-D393 WeakPolarHBondContact O-CB 3.34Å; Q389-D393 PolarHBondContact O-N 2.93Å; D393-A397 VanDerWaalsContact O-CB 3.27Å; D393-A397 WeakPolarHBondContact O-CB 3.31Å; D393-A397 PolarHBondContact O-N 3.45Å; D393-V451 HydrophobicContact CB-CG2 3.98Å
394	A	95.6	Very high	93.1	Very high	0 Å²	0	12.4 Å²	12.4	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-67.2	-39.3	177.3	0	0	0	0	0	112.9	I136 I159 V180 F390 V391 I392 M398	I136-A394 HydrophobicContact CD1-CB 4.28Å; I136-A394 HydrophobicContact CG2-CB 4.09Å; I159-A394 HydrophobicContact CB-CB 4.45Å; I159-A394 HydrophobicContact CG2-CB 3.75Å; V180-A394 HydrophobicContact CG1-CB 4.25Å; V180-A394 HydrophobicContact CG2-CB 4.12Å; F390-A394 WeakPolarHBondContact O-CB 3.38Å; F390-A394 PolarHBondContact O-N 3.41Å; V391-A394 PolarHBondContact O-N 3.49Å; I392-A394 VanDerWaalsContact C-N 3.27Å; I392-A394 PolarHBondContact O-N 3.4Å; A394-M398 PolarHBondContact O-N 3.03Å
395	V	96.3	Very high	93.5	Very high	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-69	-44.7	176.6	179.5	0	0	0	0	110.4	M64 A67 L68 I71 I136 V391 I392 A397 M398 A399	M64-V395 HydrophobicContact CB-CG2 4.3Å; M64-V395 HydrophobicContact CG-CG2 3.86Å; A67-V395 HydrophobicContact CB-CB 3.92Å; A67-V395 HydrophobicContact CB-CG1 3.87Å; A67-V395 HydrophobicContact CB-CG2 4.32Å; L68-V395 HydrophobicContact CD2-CG1 4.18Å; L68-V395 HydrophobicContact CG-CG1 4.41Å; I71-V395 HydrophobicContact CD1-CG1 3.73Å; I136-V395 HydrophobicContact CG1-CG2 4.2Å; I136-V395 HydrophobicContact CG2-CG2 4.37Å; V391-V395 WeakPolarHBondContact O-CG2 3.5Å; V391-V395 PolarHBondContact O-N 2.94Å; V391-V395 VanDerWaalsContact O-N 3.11Å; I392-V395 PolarHBondContact O-N 3.15Å; I392-V395 VanDerWaalsContact O-N 3.09Å; V395-A397 VanDerWaalsContact C-N 3.34Å; V395-A397 PolarHBondContact O-N 3.23Å; V395-M398 WeakPolarHBondContact O-CB 3.25Å; V395-M398 PolarHBondContact O-N 3.42Å; V395-A399 PolarHBondContact O-N 3.02Å
396	Y	94.6	Very high	93.8	Very high	17 Å²	17	11 Å²	11	7%	0.067	6%	0.059	C	C	.	.	H	α-helix	trans	-63.6	-38.3	175.6	-89	-88.3	0	0	0	112.1	A67 Q70 I71 L77 I392 M398 A399 H400 F437	A67-Y396 HydrophobicContact CB-CD2 4.49Å; A67-Y396 HydrophobicContact CB-CE2 4.3Å; Q70-Y396 WeakPolarHBondContact CB-OH 3.2Å; I71-Y396 HydrophobicContact CD1-CD1 4.31Å; I71-Y396 HydrophobicContact CD1-CD2 4.27Å; I71-Y396 HydrophobicContact CD1-CE1 4.37Å; I71-Y396 HydrophobicContact CD1-CE2 4.34Å; I71-Y396 HydrophobicContact CD1-CG 4.27Å; I71-Y396 HydrophobicContact CG1-CD1 4.11Å; I71-Y396 HydrophobicContact CG1-CE1 3.76Å; I71-Y396 HydrophobicContact CG1-CE2 4.26Å; L77-Y396 HydrophobicContact CD2-CD1 4.04Å; L77-Y396 HydrophobicContact CD2-CE1 4.14Å; I392-Y396 HydrophobicContact CG2-CD2 3.55Å; I392-Y396 HydrophobicContact CG2-CE2 3.62Å; I392-Y396 WeakPolarHBondContact O-CD2 3.49Å; I392-Y396 PolarHBondContact O-N 3.2Å; Y396-M398 VanDerWaalsContact C-N 3.28Å; Y396-M398 PolarHBondContact O-N 3.39Å; Y396-A399 PolarHBondContact O-N 3.48Å; Y396-A399 VanDerWaalsContact O-N 3.16Å; Y396-H400 WeakPolarHBondContact O-CB 3.11Å; Y396-H400 PolarHBondContact O-CD2 3.16Å; Y396-H400 VanDerWaalsContact O-CD2 3.22Å; Y396-H400 PolarHBondContact O-N 3.48Å; Y396-F437 HydrophobicContact CG-CE2 4.46Å
397	A	95.2	Very high	94.2	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-59.6	-41.1	174.8	0	0	0	0	0	111.6	I159 D393 V395 A401 V435 F437 V451 F453	I159-A397 HydrophobicContact CD1-CB 4.22Å; D393-A397 VanDerWaalsContact O-CB 3.27Å; D393-A397 WeakPolarHBondContact O-CB 3.31Å; D393-A397 PolarHBondContact O-N 3.45Å; V395-A397 VanDerWaalsContact C-N 3.34Å; V395-A397 PolarHBondContact O-N 3.23Å; A397-A401 WeakPolarHBondContact O-CB 3.46Å; A397-A401 PolarHBondContact O-N 3.21Å; A397-V435 HydrophobicContact CB-CG1 4.49Å; A397-F437 HydrophobicContact CB-CE1 4.19Å; A397-F437 HydrophobicContact CB-CZ 4.4Å; A397-V451 HydrophobicContact CB-CG1 4.48Å; A397-F453 HydrophobicContact CB-CE2 4.26Å; A397-F453 HydrophobicContact CB-CZ 4.21Å
398	M	96.4	Very high	94.4	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-64.9	-43	173.9	-168.9	66.7	71	0	0	111.9	L33 I136 I159 A394 V395 Y396 A401 L402 L428 I432	L33-M398 HydrophobicContact CD1-CB 4.4Å; L33-M398 HydrophobicContact CD1-CG 4Å; L33-M398 HydrophobicContact CD2-CG 3.69Å; I136-M398 HydrophobicContact CD1-CB 4.35Å; I136-M398 HydrophobicContact CD1-CE 4.22Å; I159-M398 HydrophobicContact CD1-CB 4.44Å; I159-M398 HydrophobicContact CD1-CE 3.8Å; I159-M398 HydrophobicContact CG1-CE 3.99Å; A394-M398 PolarHBondContact O-N 3.03Å; V395-M398 WeakPolarHBondContact O-CB 3.25Å; V395-M398 PolarHBondContact O-N 3.42Å; Y396-M398 VanDerWaalsContact C-N 3.28Å; Y396-M398 PolarHBondContact O-N 3.39Å; M398-A401 PolarHBondContact O-N 3.35Å; M398-L402 HydrophobicContact CG-CD1 4.26Å; M398-L402 WeakPolarHBondContact O-CG 3.5Å; M398-L402 PolarHBondContact O-N 2.81Å; M398-L428 HydrophobicContact SD-CD1 4.49Å; M398-L428 HydrophobicContact SD-CD2 4Å; M398-L428 HydrophobicContact SD-CG 4.45Å; M398-I432 HydrophobicContact CE-CD1 3.93Å; M398-I432 HydrophobicContact SD-CD1 3.81Å; M398-I432 HydrophobicContact SD-CG1 4.34Å
399	A	95.8	Very high	94.5	Very high	0 Å²	0	20.2 Å²	20.2	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-65.3	-44.7	179.2	0	0	0	0	0	112.7	I71 L77 L78 L83 V395 Y396 A401 L402 H403	I71-A399 HydrophobicContact CD1-CB 3.8Å; I71-A399 HydrophobicContact CG1-CB 4.35Å; I71-A399 HydrophobicContact CG2-CB 4.07Å; L77-A399 HydrophobicContact CD2-CB 3.97Å; L77-A399 HydrophobicContact CG-CB 4.45Å; L78-A399 HydrophobicContact CD1-CB 4.17Å; L83-A399 HydrophobicContact CD1-CB 3.95Å; V395-A399 PolarHBondContact O-N 3.02Å; Y396-A399 PolarHBondContact O-N 3.48Å; Y396-A399 VanDerWaalsContact O-N 3.16Å; A399-A401 VanDerWaalsContact C-N 3.33Å; A399-A401 PolarHBondContact O-N 2.93Å; A399-L402 PolarHBondContact O-N 2.82Å; A399-H403 WeakPolarHBondContact O-CB 3.46Å; A399-H403 PolarHBondContact O-N 2.83Å
400	H	94.8	Very high	94.6	Very high	51 Å²	51	19.9 Å²	19.9	24%	0.236	10%	0.103	C	C	.	.	H	α-helix	trans	-64.5	-36.1	174.9	-80.5	-72.2	0	0	0	112.4	Y396 H403 S404 V435 F437	Y396-H400 WeakPolarHBondContact O-CB 3.11Å; Y396-H400 PolarHBondContact O-CD2 3.16Å; Y396-H400 VanDerWaalsContact O-CD2 3.22Å; Y396-H400 PolarHBondContact O-N 3.48Å; H400-H403 PolarHBondContact O-N 3.44Å; H400-S404 WeakPolarHBondContact O-CB 3.32Å; H400-S404 PolarHBondContact O-N 2.97Å; H400-S404 PolarHBondContact O-OG 3.28Å; H400-V435 HydrophobicContact CB-CG1 4.38Å; H400-V435 HydrophobicContact CB-CG2 4.33Å; H400-F437 AromaticContact CD2-CD1 3.99Å; H400-F437 AromaticContact CD2-CD2 3.32Å; H400-F437 WeakPolarHBondContact CD2-CD2 3.46Å; H400-F437 AromaticContact CD2-CE2 3.32Å; H400-F437 WeakPolarHBondContact CD2-CE2 3.19Å; H400-F437 AromaticContact CD2-CG 3.65Å; H400-F437 AromaticContact CD2-CZ 3.71Å; H400-F437 AromaticContact NE2-CD2 3.26Å; H400-F437 VanDerWaalsContact NE2-CD2 3.26Å; H400-F437 WeakPolarHBondContact NE2-CD2 3.29Å; H400-F437 AromaticContact NE2-CE2 3.57Å; H400-F437 AromaticContact NE2-CG 3.84Å
401	A	96.2	Very high	94.3	Very high	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.2	-47.1	173.4	0	0	0	0	0	111.6	A397 M398 A399 H403 S404 M405 L428 I432 V435	A397-A401 WeakPolarHBondContact O-CB 3.46Å; A397-A401 PolarHBondContact O-N 3.21Å; M398-A401 PolarHBondContact O-N 3.35Å; A399-A401 VanDerWaalsContact C-N 3.33Å; A399-A401 PolarHBondContact O-N 2.93Å; A401-H403 VanDerWaalsContact C-N 3.31Å; A401-H403 PolarHBondContact O-N 2.98Å; A401-S404 PolarHBondContact O-N 3.31Å; A401-M405 WeakPolarHBondContact O-CB 3.32Å; A401-M405 PolarHBondContact O-N 2.84Å; A401-L428 HydrophobicContact CB-CD1 4.15Å; A401-I432 HydrophobicContact CB-CB 4.37Å; A401-I432 HydrophobicContact CB-CG1 3.64Å; A401-V435 HydrophobicContact CB-CG2 3.9Å
402	L	95.8	Very high	93.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-62.9	-38.2	175.8	-73.2	168.9	0	0	0	112	I31 L78 L83 M398 A399 M405 H406 M420 V423 L428	I31-L402 HydrophobicContact CD1-CD2 4.34Å; I31-L402 HydrophobicContact CG2-CD1 4.14Å; L78-L402 HydrophobicContact CD1-CB 4.31Å; L78-L402 HydrophobicContact CD2-CB 4.12Å; L83-L402 HydrophobicContact CD2-CD1 3.9Å; M398-L402 HydrophobicContact CG-CD1 4.26Å; M398-L402 WeakPolarHBondContact O-CG 3.5Å; M398-L402 PolarHBondContact O-N 2.81Å; A399-L402 PolarHBondContact O-N 2.82Å; L402-M405 PolarHBondContact O-N 2.82Å; L402-H406 WeakPolarHBondContact O-CB 3.37Å; L402-H406 PolarHBondContact O-N 2.6Å; L402-M420 HydrophobicContact CD2-CE 4.47Å; L402-V423 HydrophobicContact CD2-CG1 4.23Å; L402-L428 HydrophobicContact CD2-CD1 3.73Å; L402-L428 HydrophobicContact CD2-CD2 4.32Å; L402-L428 HydrophobicContact CG-CD1 4.07Å
403	H	94.3	Very high	93.3	Very high	39 Å²	39	30.7 Å²	30.7	18%	0.181	19%	0.192	C	C	.	.	H	α-helix	trans	-65.7	-46.7	177.3	-177.7	77.3	0	0	0	111.7	D76 L77 L78 A399 H400 A401 M405 H406 M407	D76-H403 PolarHBondContact O-CE1 2.82Å; D76-H403 VanDerWaalsContact O-CE1 3.25Å; L77-H403 HydrophobicContact CD1-CB 3.67Å; L78-H403 HydrophobicContact CD2-CB 3.94Å; L78-H403 HydrophobicContact CG-CB 4.11Å; L78-H403 PolarHBondContact N-ND1 3.19Å; A399-H403 WeakPolarHBondContact O-CB 3.46Å; A399-H403 PolarHBondContact O-N 2.83Å; H400-H403 PolarHBondContact O-N 3.44Å; A401-H403 VanDerWaalsContact C-N 3.31Å; A401-H403 PolarHBondContact O-N 2.98Å; H403-M405 VanDerWaalsContact C-N 3.31Å; H403-M405 PolarHBondContact O-N 2.93Å; H403-H406 PolarHBondContact O-N 3.03Å; H403-H406 VanDerWaalsContact O-N 3.17Å; H403-M407 WeakPolarHBondContact O-CG 3.47Å; H403-M407 PolarHBondContact O-N 2.87Å
404	S	94.9	Very high	92.9	Very high	48 Å²	48	38.2 Å²	38.2	34%	0.336	23%	0.229	S	C	.	.	H	α-helix	trans	-61.7	-42.3	176.2	-53.3	0	0	0	0	110.9	H400 A401 H406 M407 D408	H400-S404 WeakPolarHBondContact O-CB 3.32Å; H400-S404 PolarHBondContact O-N 2.97Å; H400-S404 PolarHBondContact O-OG 3.28Å; A401-S404 PolarHBondContact O-N 3.31Å; S404-H406 VanDerWaalsContact C-N 3.34Å; S404-H406 PolarHBondContact O-N 3.35Å; S404-M407 PolarHBondContact O-N 3.2Å; S404-D408 PolarHBondContact O-N 3.09Å; S404-D408 VanDerWaalsContact O-N 3.08Å
405	M	95.1	Very high	92.4	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	24%	0.235	C	C	.	.	H	α-helix	trans	-61.3	-40	174.2	-175.9	173.8	-179.1	0	0	112.5	A401 L402 H403 L409 M420 V423 M427 L428 Y431	A401-M405 WeakPolarHBondContact O-CB 3.32Å; A401-M405 PolarHBondContact O-N 2.84Å; L402-M405 PolarHBondContact O-N 2.82Å; H403-M405 VanDerWaalsContact C-N 3.31Å; H403-M405 PolarHBondContact O-N 2.93Å; M405-L409 HydrophobicContact CE-CD1 3.52Å; M405-L409 HydrophobicContact CG-CD1 3.61Å; M405-L409 HydrophobicContact CG-CG 4.3Å; M405-L409 VanDerWaalsContact O-CB 3.28Å; M405-L409 WeakPolarHBondContact O-CB 3.17Å; M405-L409 VanDerWaalsContact O-CG 3.29Å; M405-L409 WeakPolarHBondContact O-CG 3.27Å; M405-L409 PolarHBondContact O-N 3.24Å; M405-L409 HydrophobicContact SD-CD1 4.44Å; M405-M420 HydrophobicContact CB-CE 4.44Å; M405-M420 HydrophobicContact CE-CG 4.43Å; M405-M420 HydrophobicContact CG-CE 4.14Å; M405-M420 HydrophobicContact CG-SD 4.45Å; M405-M420 HydrophobicContact SD-CE 4.34Å; M405-V423 HydrophobicContact CE-CG1 4.09Å; M405-V423 HydrophobicContact SD-CG1 4.07Å; M405-M427 HydrophobicContact CE-CB 4.29Å; M405-M427 HydrophobicContact CE-CG 4.21Å; M405-M427 HydrophobicContact CE-SD 4.05Å; M405-L428 HydrophobicContact SD-CB 4.36Å; M405-L428 HydrophobicContact SD-CD1 4.29Å; M405-Y431 HydrophobicContact CB-CD1 4.35Å; M405-Y431 HydrophobicContact CB-CD2 3.61Å; M405-Y431 HydrophobicContact CB-CE1 4.44Å; M405-Y431 HydrophobicContact CB-CE2 3.72Å; M405-Y431 HydrophobicContact CB-CG 3.95Å; M405-Y431 HydrophobicContact CG-CD2 3.81Å; M405-Y431 HydrophobicContact CG-CE2 3.62Å; M405-Y431 HydrophobicContact SD-CD2 4.15Å; M405-Y431 HydrophobicContact SD-CE2 4.35Å
406	H	94.3	Very high	92.1	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.028	25%	0.25	C	C	.	.	H	α-helix	trans	-67.9	-44	177	-178.5	-90.6	0	0	0	112.4	I81 L402 H403 S404 D408 L409 C410 S413 G415 M420	I81-H406 VanDerWaalsContact CD1-CD2 3.49Å; I81-H406 WeakPolarHBondContact CD1-CD2 3.23Å; L402-H406 WeakPolarHBondContact O-CB 3.37Å; L402-H406 PolarHBondContact O-N 2.6Å; H403-H406 PolarHBondContact O-N 3.03Å; H403-H406 VanDerWaalsContact O-N 3.17Å; S404-H406 VanDerWaalsContact C-N 3.34Å; S404-H406 PolarHBondContact O-N 3.35Å; H406-D408 VanDerWaalsContact C-N 3.26Å; H406-D408 PolarHBondContact O-N 2.85Å; H406-L409 PolarHBondContact O-N 3.47Å; H406-C410 CarbonylContact O-C 3.51Å; H406-C410 VanDerWaalsContact O-CA 3.32Å; H406-C410 WeakPolarHBondContact O-CA 3.3Å; H406-C410 WeakPolarHBondContact O-CB 3.44Å; H406-C410 PolarHBondContact O-N 2.93Å; H406-S413 PolarHBondContact CE1-O 2.96Å; H406-G415 PolarHBondContact NE2-O 3.33Å; H406-M420 WeakPolarHBondContact CA-SD 3.2Å; H406-M420 HydrophobicContact CB-CE 4.18Å; H406-M420 HydrophobicContact CB-SD 3.75Å
407	M	92.9	Very high	91.9	Very high	89 Å²	89	41.5 Å²	41.5	44%	0.438	25%	0.254	S	S	.	.	H	α-helix	trans	-58.6	-39.9	176.1	-70.6	-65.2	116.8	0	0	111.8	H403 S404	H403-M407 WeakPolarHBondContact O-CG 3.47Å; H403-M407 PolarHBondContact O-N 2.87Å; S404-M407 PolarHBondContact O-N 3.2Å
408	D	94.1	Very high	91.6	Very high	108 Å²	108	50.4 Å²	50.4	58%	0.578	30%	0.295	S	S	*	.	H	α-helix	trans	-79.2	-39.5	-178.2	-74.1	-3.3	0	0	0	113.1	S404 H406 Y431	S404-D408 PolarHBondContact O-N 3.09Å; S404-D408 VanDerWaalsContact O-N 3.08Å; H406-D408 VanDerWaalsContact C-N 3.26Å; H406-D408 PolarHBondContact O-N 2.85Å; D408-Y431 HydrophobicContact CB-CE1 4.44Å; D408-Y431 WeakPolarHBondContact CB-OH 3.39Å; D408-Y431 WeakPolarHBondContact OD2-CE1 3.39Å; D408-Y431 PolarHBondContact OD2-OH 2.94Å
409	L	93.1	Very high	91.3	Very high	33 Å²	33	57.5 Å²	57.5	17%	0.173	33%	0.326	C	S	.	.	H	α-helix	trans	-93.1	-32	-174.1	-62.7	-179.7	0	0	0	114.1	M405 H406 P411 K419 M420 M427	M405-L409 HydrophobicContact CE-CD1 3.52Å; M405-L409 HydrophobicContact CG-CD1 3.61Å; M405-L409 HydrophobicContact CG-CG 4.3Å; M405-L409 VanDerWaalsContact O-CB 3.28Å; M405-L409 WeakPolarHBondContact O-CB 3.17Å; M405-L409 VanDerWaalsContact O-CG 3.29Å; M405-L409 WeakPolarHBondContact O-CG 3.27Å; M405-L409 PolarHBondContact O-N 3.24Å; M405-L409 HydrophobicContact SD-CD1 4.44Å; H406-L409 PolarHBondContact O-N 3.47Å; L409-P411 WeakPolarHBondContact O-CD 3.47Å; L409-K419 HydrophobicContact CB-CB 4.36Å; L409-M420 HydrophobicContact CB-CG 4.42Å; L409-M420 HydrophobicContact CD1-CG 4.05Å; L409-M427 HydrophobicContact CD1-SD 3.78Å; L409-M427 HydrophobicContact CD2-SD 4.2Å
410	C	92.3	Very high	91	Very high	2 Å²	2	57.6 Å²	57.6	1%	0.014	33%	0.327	C	S	.	.	S	Bend	trans	-121.6	47.5	-170.9	-53.1	0	0	0	0	112.9	H406 G412 S413 C417	H406-C410 CarbonylContact O-C 3.51Å; H406-C410 VanDerWaalsContact O-CA 3.32Å; H406-C410 WeakPolarHBondContact O-CA 3.3Å; H406-C410 WeakPolarHBondContact O-CB 3.44Å; H406-C410 PolarHBondContact O-N 2.93Å; C410-G412 PolarHBondContact O-N 3.26Å; C410-S413 WeakPolarHBondContact O-CB 3.4Å; C410-S413 PolarHBondContact O-N 3.31Å; C410-S413 VanDerWaalsContact O-N 3.07Å; C410-S413 PolarHBondContact O-OG 3.11Å; C410-C417 HydrophobicContact CB-CB 3.68Å; C410-C417 WeakPolarHBondContact CB-SG 3.35Å; C410-C417 WeakPolarHBondContact SG-CB 3.4Å; C410-C417 CovalentContact SG-SG 2.02Å; C410-C417 PolarHBondContact SG-SG 2.9Å
411	P	87.8	Confident	90.7	Very high	99 Å²	99	60.9 Å²	60.9	64%	0.643	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	124.5	-175.8	26.1	-34.8	0	0	0	111.1	L409 S413	L409-P411 WeakPolarHBondContact O-CD 3.47Å; P411-S413 VanDerWaalsContact C-N 3.26Å; P411-S413 PolarHBondContact O-N 3.25Å
412	G	82.1	Confident	90.2	Very high	89 Å²	89	64.7 Å²	64.7	92%	0.918	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	5.5	179.2	0	0	0	0	0	115.8	C410	C410-G412 PolarHBondContact O-N 3.26Å
413	S	85.5	Confident	89.9	Confident	53 Å²	53	65.7 Å²	65.7	37%	0.371	38%	0.377	S	S	.	.			trans	-84.2	138.5	174.6	-55.3	0	0	0	0	110.8	H406 C410 P411	H406-S413 PolarHBondContact CE1-O 2.96Å; C410-S413 WeakPolarHBondContact O-CB 3.4Å; C410-S413 PolarHBondContact O-N 3.31Å; C410-S413 VanDerWaalsContact O-N 3.07Å; C410-S413 PolarHBondContact O-OG 3.11Å; P411-S413 VanDerWaalsContact C-N 3.26Å; P411-S413 PolarHBondContact O-N 3.25Å
414	M	83.1	Confident	89.8	Confident	168 Å²	168	69.1 Å²	69.1	83%	0.828	39%	0.393	S	S	*	.	S	Bend	trans	-88.6	124.3	169.2	-66.3	-168.2	-73.3	0	0	109.2
415	G	86.9	Confident	89.6	Confident	12 Å²	12	67.3 Å²	67.3	12%	0.124	38%	0.382	C	S	.	.	S	Bend	trans	80.2	-168.9	-177.8	0	0	0	0	0	114.3	H406 C417	H406-G415 PolarHBondContact NE2-O 3.33Å; G415-C417 PolarHBondContact O-N 3.15Å
416	V	89.5	Confident	89.6	Confident	51 Å²	51	74.3 Å²	74.3	31%	0.309	41%	0.409	S	S	.	.	S	Bend	trans	-72.6	121	179.4	-174.4	0	0	0	0	110.1	D30 I31 I81 M420 D421	D30-V416 HydrophobicContact CB-CG2 4.15Å; I31-V416 HydrophobicContact CD1-CG2 4Å; I31-V416 HydrophobicContact CG1-CG2 3.96Å; I81-V416 HydrophobicContact CD1-CG2 4.19Å; I81-V416 HydrophobicContact CG1-CG2 4.16Å; I81-V416 HydrophobicContact CG2-CG2 4.01Å; V416-M420 HydrophobicContact CG1-CB 3.78Å; V416-D421 HydrophobicContact CG1-CB 4.47Å
417	C	90.7	Very high	89.6	Confident	23 Å²	23	77 Å²	77	16%	0.155	42%	0.422	C	S	.	.			trans	-89.3	167.9	179.4	82.9	0	0	0	0	112.8	C410 G415 K419 M420 D421	C410-C417 HydrophobicContact CB-CB 3.68Å; C410-C417 WeakPolarHBondContact CB-SG 3.35Å; C410-C417 WeakPolarHBondContact SG-CB 3.4Å; C410-C417 CovalentContact SG-SG 2.02Å; C410-C417 PolarHBondContact SG-SG 2.9Å; G415-C417 PolarHBondContact O-N 3.15Å; C417-K419 PolarHBondContact O-N 3.07Å; C417-K419 VanDerWaalsContact O-N 3.11Å; C417-M420 CarbonylContact O-C 3.31Å; C417-M420 WeakPolarHBondContact O-CA 3.46Å; C417-M420 PolarHBondContact O-N 2.89Å; C417-D421 PolarHBondContact O-N 3.46Å
418	E	89.1	Confident	89.8	Confident	186 Å²	186	72.7 Å²	72.7	87%	0.869	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-57	-29.5	-178.4	-66.4	-173.1	165.3	0	0	113.9	M420 D421	E418-M420 PolarHBondContact O-N 3.41Å; E418-D421 PolarHBondContact O-N 3.22Å
419	K	88.9	Confident	89.8	Confident	149 Å²	149	68.1 Å²	68.1	65%	0.648	38%	0.376	S	S	*	.	G	3₁₀ helix	trans	-72.3	-14.5	176	-65	-174.7	-172.6	168	0	113.8	L409 C417	L409-K419 HydrophobicContact CB-CB 4.36Å; C417-K419 PolarHBondContact O-N 3.07Å; C417-K419 VanDerWaalsContact O-N 3.11Å
420	M	90.7	Very high	89.9	Confident	2 Å²	2	73.2 Å²	73.2	1%	0.01	40%	0.399	C	S	.	.	G	3₁₀ helix	trans	-110.4	3.5	176.4	-71.7	-176.6	72.9	0	0	112.5	L402 M405 H406 L409 V416 C417 E418 P422 V423	L402-M420 HydrophobicContact CD2-CE 4.47Å; M405-M420 HydrophobicContact CB-CE 4.44Å; M405-M420 HydrophobicContact CE-CG 4.43Å; M405-M420 HydrophobicContact CG-CE 4.14Å; M405-M420 HydrophobicContact CG-SD 4.45Å; M405-M420 HydrophobicContact SD-CE 4.34Å; H406-M420 WeakPolarHBondContact CA-SD 3.2Å; H406-M420 HydrophobicContact CB-CE 4.18Å; H406-M420 HydrophobicContact CB-SD 3.75Å; L409-M420 HydrophobicContact CB-CG 4.42Å; L409-M420 HydrophobicContact CD1-CG 4.05Å; V416-M420 HydrophobicContact CG1-CB 3.78Å; C417-M420 CarbonylContact O-C 3.31Å; C417-M420 WeakPolarHBondContact O-CA 3.46Å; C417-M420 PolarHBondContact O-N 2.89Å; E418-M420 PolarHBondContact O-N 3.41Å; M420-P422 VanDerWaalsContact C-C 3.5Å; M420-P422 CarbonylContact O-C 3.55Å; M420-V423 WeakPolarHBondContact O-CA 3.29Å; M420-V423 WeakPolarHBondContact O-CG2 3.2Å; M420-V423 PolarHBondContact O-N 3.23Å
421	D	87.1	Confident	90.1	Very high	121 Å²	121	74.8 Å²	74.8	65%	0.647	41%	0.405	S	S	*	.	S	Bend	trans	-116.9	97.2	175	-173.3	17.2	0	0	0	111.4	V416 C417 E418	V416-D421 HydrophobicContact CG1-CB 4.47Å; C417-D421 PolarHBondContact O-N 3.46Å; E418-D421 PolarHBondContact O-N 3.22Å
422	P	85.6	Confident	90.5	Very high	79 Å²	79	70.1 Å²	70.1	51%	0.513	37%	0.374	S	S	.	.	S	Bend	cis	-85.9	154.4	3.5	34.1	-34.2	0	0	0	113.6	M420 E424	M420-P422 VanDerWaalsContact C-C 3.5Å; M420-P422 CarbonylContact O-C 3.55Å; P422-E424 PolarHBondContact O-N 3.35Å
423	V	89.9	Confident	91	Very high	22 Å²	22	69 Å²	69	13%	0.133	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-64.7	117.8	173.5	-179.3	0	0	0	0	109.6	I31 V133 L402 M405 M420 G425 L428	I31-V423 HydrophobicContact CD1-CG2 4.44Å; V133-V423 HydrophobicContact CB-CB 4.19Å; V133-V423 HydrophobicContact CB-CG1 4.38Å; V133-V423 HydrophobicContact CG1-CB 3.81Å; V133-V423 HydrophobicContact CG1-CG2 3.98Å; L402-V423 HydrophobicContact CD2-CG1 4.23Å; M405-V423 HydrophobicContact CE-CG1 4.09Å; M405-V423 HydrophobicContact SD-CG1 4.07Å; M420-V423 WeakPolarHBondContact O-CA 3.29Å; M420-V423 WeakPolarHBondContact O-CG2 3.2Å; M420-V423 PolarHBondContact O-N 3.23Å; V423-G425 PolarHBondContact O-N 3.44Å; V423-L428 HydrophobicContact CG1-CB 4.29Å; V423-L428 HydrophobicContact CG1-CD2 4.06Å
424	E	91.4	Very high	91.4	Very high	110 Å²	110	70.5 Å²	70.5	51%	0.514	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-78.7	116.2	178.5	-170.5	-177.8	175.1	0	0	111.2	P422 R426 M427 L428	P422-E424 PolarHBondContact O-N 3.35Å; E424-R426 PolarHBondContact O-N 2.95Å; E424-M427 HydrophobicContact CB-CB 4.3Å; E424-M427 PolarHBondContact O-N 2.99Å; E424-L428 PolarHBondContact O-N 3.26Å
425	G	92.3	Very high	91.8	Very high	11 Å²	11	63 Å²	63	11%	0.113	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-26.6	-171.7	0	0	0	0	0	115.7	A155 V423 L429	A155-G425 CarbonylContact O-C 3.57Å; A155-G425 VanDerWaalsContact O-CA 3.23Å; A155-G425 WeakPolarHBondContact O-CA 3.48Å; V423-G425 PolarHBondContact O-N 3.44Å; G425-L429 WeakPolarHBondContact O-CB 3.3Å; G425-L429 PolarHBondContact O-N 2.78Å
426	R	94.3	Very high	91.9	Very high	148 Å²	148	67.8 Å²	67.8	56%	0.558	34%	0.339	S	S	*	.	H	α-helix	trans	-64.8	-42.7	171.4	-81	-178.9	-177.3	-147.7	-2.8	112.2	A155 F176 E424 L429 Q430	A155-R426 HydrophobicContact CB-CG 4.26Å; F176-R426 HydrophobicContact CE1-CG 3.82Å; F176-R426 HydrophobicContact CZ-CG 3.52Å; E424-R426 PolarHBondContact O-N 2.95Å; R426-L429 PolarHBondContact O-N 2.96Å; R426-Q430 PolarHBondContact O-N 2.91Å
427	M	94.9	Very high	91.6	Very high	61 Å²	61	66.3 Å²	66.3	30%	0.3	33%	0.329	S	S	.	.	H	α-helix	trans	-69.7	-44.3	178.2	-167.5	174.5	-61.3	0	0	110	M405 L409 E424 L429 Q430 Y431	M405-M427 HydrophobicContact CE-CB 4.29Å; M405-M427 HydrophobicContact CE-CG 4.21Å; M405-M427 HydrophobicContact CE-SD 4.05Å; L409-M427 HydrophobicContact CD1-SD 3.78Å; L409-M427 HydrophobicContact CD2-SD 4.2Å; E424-M427 HydrophobicContact CB-CB 4.3Å; E424-M427 PolarHBondContact O-N 2.99Å; M427-L429 VanDerWaalsContact C-N 3.27Å; M427-L429 PolarHBondContact O-N 3.25Å; M427-Q430 WeakPolarHBondContact O-CB 3.38Å; M427-Q430 PolarHBondContact O-N 3.49Å; M427-Y431 HydrophobicContact CG-CD2 4.33Å; M427-Y431 HydrophobicContact CG-CE2 3.82Å; M427-Y431 VanDerWaalsContact O-CD2 3.23Å; M427-Y431 WeakPolarHBondContact O-CD2 3.19Å; M427-Y431 PolarHBondContact O-N 3.14Å; M427-Y431 HydrophobicContact SD-CE2 4.49Å
428	L	95.9	Very high	90.6	Very high	0 Å²	0	70 Å²	70	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-56.2	-39.9	174.1	-178.6	58.3	0	0	0	112.4	P157 M398 A401 L402 M405 V423 E424 Q430 Y431 I432	P157-L428 HydrophobicContact CG-CB 4.43Å; P157-L428 HydrophobicContact CG-CD2 3.8Å; P157-L428 HydrophobicContact CG-CG 4.09Å; M398-L428 HydrophobicContact SD-CD1 4.49Å; M398-L428 HydrophobicContact SD-CD2 4Å; M398-L428 HydrophobicContact SD-CG 4.45Å; A401-L428 HydrophobicContact CB-CD1 4.15Å; L402-L428 HydrophobicContact CD2-CD1 3.73Å; L402-L428 HydrophobicContact CD2-CD2 4.32Å; L402-L428 HydrophobicContact CG-CD1 4.07Å; M405-L428 HydrophobicContact SD-CB 4.36Å; M405-L428 HydrophobicContact SD-CD1 4.29Å; V423-L428 HydrophobicContact CG1-CB 4.29Å; V423-L428 HydrophobicContact CG1-CD2 4.06Å; E424-L428 PolarHBondContact O-N 3.26Å; L428-Q430 VanDerWaalsContact C-N 3.3Å; L428-Q430 PolarHBondContact O-N 2.59Å; L428-Y431 PolarHBondContact O-N 2.89Å; L428-I432 HydrophobicContact CD1-CD1 4.48Å; L428-I432 HydrophobicContact CD1-CG1 4.42Å; L428-I432 HydrophobicContact CG-CD1 3.95Å; L428-I432 HydrophobicContact CG-CG1 4.37Å; L428-I432 WeakPolarHBondContact O-CG1 3.36Å; L428-I432 PolarHBondContact O-N 3.32Å
429	L	95.6	Very high	89.1	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.063	31%	0.31	C	S	.	.	H	α-helix	trans	-59.5	-37.4	176.5	-178.9	67.2	0	0	0	112.9	P157 E175 F176 G425 R426 M427 I432 R433	P157-L429 HydrophobicContact CB-CD1 4.29Å; E175-L429 HydrophobicContact CG-CD2 4.45Å; E175-L429 WeakPolarHBondContact O-CD2 3.42Å; F176-L429 HydrophobicContact CD1-CD2 3.97Å; F176-L429 HydrophobicContact CE1-CD2 4.23Å; F176-L429 HydrophobicContact CG-CD2 4.38Å; G425-L429 WeakPolarHBondContact O-CB 3.3Å; G425-L429 PolarHBondContact O-N 2.78Å; R426-L429 PolarHBondContact O-N 2.96Å; M427-L429 VanDerWaalsContact C-N 3.27Å; M427-L429 PolarHBondContact O-N 3.25Å; L429-I432 PolarHBondContact O-N 3.06Å; L429-R433 HydrophobicContact CD1-CG 4.45Å; L429-R433 WeakPolarHBondContact O-CG 3.36Å; L429-R433 PolarHBondContact O-N 3.44Å
430	Q	95.1	Very high	87.2	Confident	139 Å²	139	63.1 Å²	63.1	65%	0.65	32%	0.316	S	S	*	.	H	α-helix	trans	-65.8	-41	176.9	-65	177.5	-4.5	0	0	111.3	R426 M427 L428 R433 S434	R426-Q430 PolarHBondContact O-N 2.91Å; M427-Q430 WeakPolarHBondContact O-CB 3.38Å; M427-Q430 PolarHBondContact O-N 3.49Å; L428-Q430 VanDerWaalsContact C-N 3.3Å; L428-Q430 PolarHBondContact O-N 2.59Å; Q430-R433 PolarHBondContact O-N 3.45Å; Q430-S434 PolarHBondContact O-N 3.47Å; Q430-S434 PolarHBondContact O-OG 3.17Å
431	Y	96.2	Very high	85.2	Confident	36 Å²	36	64.2 Å²	64.2	14%	0.141	32%	0.322	C	S	.	.	H	α-helix	trans	-64.7	-45.7	172.9	-69.8	-73.9	0	0	0	111.1	M405 D408 M427 L428 R433 S434 V435	M405-Y431 HydrophobicContact CB-CD1 4.35Å; M405-Y431 HydrophobicContact CB-CD2 3.61Å; M405-Y431 HydrophobicContact CB-CE1 4.44Å; M405-Y431 HydrophobicContact CB-CE2 3.72Å; M405-Y431 HydrophobicContact CB-CG 3.95Å; M405-Y431 HydrophobicContact CG-CD2 3.81Å; M405-Y431 HydrophobicContact CG-CE2 3.62Å; M405-Y431 HydrophobicContact SD-CD2 4.15Å; M405-Y431 HydrophobicContact SD-CE2 4.35Å; D408-Y431 HydrophobicContact CB-CE1 4.44Å; D408-Y431 WeakPolarHBondContact CB-OH 3.39Å; D408-Y431 WeakPolarHBondContact OD2-CE1 3.39Å; D408-Y431 PolarHBondContact OD2-OH 2.94Å; M427-Y431 HydrophobicContact CG-CD2 4.33Å; M427-Y431 HydrophobicContact CG-CE2 3.82Å; M427-Y431 VanDerWaalsContact O-CD2 3.23Å; M427-Y431 WeakPolarHBondContact O-CD2 3.19Å; M427-Y431 PolarHBondContact O-N 3.14Å; M427-Y431 HydrophobicContact SD-CE2 4.49Å; L428-Y431 PolarHBondContact O-N 2.89Å; Y431-R433 VanDerWaalsContact C-N 3.31Å; Y431-R433 PolarHBondContact O-N 2.98Å; Y431-S434 WeakPolarHBondContact CA-OG 3.3Å; Y431-S434 PolarHBondContact O-N 3.03Å; Y431-S434 VanDerWaalsContact O-N 3.07Å; Y431-S434 PolarHBondContact O-OG 2.93Å; Y431-V435 WeakPolarHBondContact O-CG2 3.4Å; Y431-V435 PolarHBondContact O-N 2.79Å
432	I	95.4	Very high	82.8	Confident	0 Å²	0	67.3 Å²	67.3	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-54.3	-46.7	176.3	-69.4	166.5	0	0	0	111.3	P157 I159 M398 A401 L428 L429 S434 V435 F453	P157-I432 HydrophobicContact CB-CD1 3.67Å; P157-I432 HydrophobicContact CG-CD1 3.86Å; I159-I432 HydrophobicContact CD1-CD1 4.21Å; I159-I432 HydrophobicContact CD1-CG1 4.29Å; I159-I432 HydrophobicContact CD1-CG2 3.73Å; I159-I432 HydrophobicContact CG1-CG2 4.19Å; M398-I432 HydrophobicContact CE-CD1 3.93Å; M398-I432 HydrophobicContact SD-CD1 3.81Å; M398-I432 HydrophobicContact SD-CG1 4.34Å; A401-I432 HydrophobicContact CB-CB 4.37Å; A401-I432 HydrophobicContact CB-CG1 3.64Å; L428-I432 HydrophobicContact CD1-CD1 4.48Å; L428-I432 HydrophobicContact CD1-CG1 4.42Å; L428-I432 HydrophobicContact CG-CD1 3.95Å; L428-I432 HydrophobicContact CG-CG1 4.37Å; L428-I432 WeakPolarHBondContact O-CG1 3.36Å; L428-I432 PolarHBondContact O-N 3.32Å; L429-I432 PolarHBondContact O-N 3.06Å; I432-S434 VanDerWaalsContact C-N 3.26Å; I432-S434 PolarHBondContact O-N 3.34Å; I432-V435 WeakPolarHBondContact O-CB 3.2Å; I432-V435 PolarHBondContact O-N 2.92Å; I432-F453 HydrophobicContact CG2-CE2 4.07Å; I432-F453 HydrophobicContact CG2-CZ 4.49Å; I432-F453 WeakPolarHBondContact O-CD2 3.27Å; I432-F453 WeakPolarHBondContact O-CE2 3.38Å
433	R	93.5	Very high	80.4	Confident	67 Å²	67	65.8 Å²	65.8	25%	0.253	32%	0.321	S	S	.	.	H	α-helix	trans	-72.1	-14.3	-178.1	-71.7	-179.2	174.1	-165.8	-7.5	114.4	N171 E175 L429 Q430 Y431	N171-R433 PolarHBondContact OD1-NH2 3.23Å; E175-R433 PolarHBondContact O-NH2 3.42Å; L429-R433 HydrophobicContact CD1-CG 4.45Å; L429-R433 WeakPolarHBondContact O-CG 3.36Å; L429-R433 PolarHBondContact O-N 3.44Å; Q430-R433 PolarHBondContact O-N 3.45Å; Y431-R433 VanDerWaalsContact C-N 3.31Å; Y431-R433 PolarHBondContact O-N 2.98Å
434	S	93.7	Very high	77.7	Confident	83 Å²	83	71.5 Å²	71.5	58%	0.58	36%	0.357	S	S	*	.	H	α-helix	trans	-101.6	-1.8	177.7	55	0	0	0	0	113.8	Q430 Y431 I432 N436	Q430-S434 PolarHBondContact O-N 3.47Å; Q430-S434 PolarHBondContact O-OG 3.17Å; Y431-S434 WeakPolarHBondContact CA-OG 3.3Å; Y431-S434 PolarHBondContact O-N 3.03Å; Y431-S434 VanDerWaalsContact O-N 3.07Å; Y431-S434 PolarHBondContact O-OG 2.93Å; I432-S434 VanDerWaalsContact C-N 3.26Å; I432-S434 PolarHBondContact O-N 3.34Å; S434-N436 PolarHBondContact O-N 3.32Å
435	V	90.9	Very high	75.2	Confident	10 Å²	10	67.8 Å²	67.8	6%	0.061	35%	0.348	C	S	.	.			trans	-60.5	126.9	176.1	167.2	0	0	0	0	110.6	A397 H400 A401 Y431 I432 F437	A397-V435 HydrophobicContact CB-CG1 4.49Å; H400-V435 HydrophobicContact CB-CG1 4.38Å; H400-V435 HydrophobicContact CB-CG2 4.33Å; A401-V435 HydrophobicContact CB-CG2 3.9Å; Y431-V435 WeakPolarHBondContact O-CG2 3.4Å; Y431-V435 PolarHBondContact O-N 2.79Å; I432-V435 WeakPolarHBondContact O-CB 3.2Å; I432-V435 PolarHBondContact O-N 2.92Å; V435-F437 HydrophobicContact CG1-CD1 3.15Å; V435-F437 HydrophobicContact CG1-CE1 3.22Å; V435-F437 HydrophobicContact CG1-CG 4.41Å
436	N	89.5	Confident	72.8	Confident	114 Å²	114	68.7 Å²	68.7	61%	0.61	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-144.5	103.6	171	-179.1	5.6	0	0	0	108.7	S434	S434-N436 PolarHBondContact O-N 3.32Å
437	F	83.1	Confident	70.8	Confident	20 Å²	20	63.3 Å²	63.3	9%	0.088	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.1	151.2	-178.1	69.5	-69.4	0	0	0	110	Y396 A397 H400 V435 V439 A450 V451	Y396-F437 HydrophobicContact CG-CE2 4.46Å; A397-F437 HydrophobicContact CB-CE1 4.19Å; A397-F437 HydrophobicContact CB-CZ 4.4Å; H400-F437 AromaticContact CD2-CD1 3.99Å; H400-F437 AromaticContact CD2-CD2 3.32Å; H400-F437 WeakPolarHBondContact CD2-CD2 3.46Å; H400-F437 AromaticContact CD2-CE2 3.32Å; H400-F437 WeakPolarHBondContact CD2-CE2 3.19Å; H400-F437 AromaticContact CD2-CG 3.65Å; H400-F437 AromaticContact CD2-CZ 3.71Å; H400-F437 AromaticContact NE2-CD2 3.26Å; H400-F437 VanDerWaalsContact NE2-CD2 3.26Å; H400-F437 WeakPolarHBondContact NE2-CD2 3.29Å; H400-F437 AromaticContact NE2-CE2 3.57Å; H400-F437 AromaticContact NE2-CG 3.84Å; V435-F437 HydrophobicContact CG1-CD1 3.15Å; V435-F437 HydrophobicContact CG1-CE1 3.22Å; V435-F437 HydrophobicContact CG1-CG 4.41Å; F437-V439 HydrophobicContact CD2-CG2 3.96Å; F437-V439 HydrophobicContact CE2-CB 4.35Å; F437-V439 HydrophobicContact CE2-CG2 3.27Å; F437-V439 HydrophobicContact CZ-CG2 3.96Å; F437-A450 CarbonylContact O-C 3.55Å; F437-A450 WeakPolarHBondContact O-CA 3.23Å; F437-V451 HydrophobicContact CD1-CB 4.17Å; F437-V451 HydrophobicContact CE1-CB 3.64Å; F437-V451 HydrophobicContact CE1-CG1 3.86Å; F437-V451 HydrophobicContact CE1-CG2 4.38Å; F437-V451 HydrophobicContact CZ-CB 3.95Å; F437-V451 HydrophobicContact CZ-CG1 4.24Å; F437-V451 HydrophobicContact CZ-CG2 4.2Å; F437-V451 PolarHBondContact N-O 2.91Å; F437-V451 PolarHBondContact O-N 2.87Å
438	N	69.8	Low	68.9	Low	99 Å²	99	63.6 Å²	63.6	53%	0.529	36%	0.358	S	S	.	.			trans	-91.3	124.6	163.8	-65	-32.5	0	0	0	106.3	F440 A450	N438-F440 PolarHBondContact O-N 3.47Å; N438-A450 WeakPolarHBondContact OD1-CA 3.45Å; N438-A450 WeakPolarHBondContact OD1-CB 3.49Å; N438-A450 PolarHBondContact OD1-N 2.8Å
439	V	57.8	Low	67.5	Low	16 Å²	16	65.3 Å²	65.3	10%	0.097	37%	0.369	C	S	.	.			trans	-67.9	86.8	167.8	-178.6	0	0	0	0	106.8	F437 L441 S446 V451	F437-V439 HydrophobicContact CD2-CG2 3.96Å; F437-V439 HydrophobicContact CE2-CB 4.35Å; F437-V439 HydrophobicContact CE2-CG2 3.27Å; F437-V439 HydrophobicContact CZ-CG2 3.96Å; V439-L441 HydrophobicContact CG1-CD1 4.06Å; V439-L441 HydrophobicContact CG1-CG 4Å; V439-L441 PolarHBondContact O-N 3.13Å; V439-S446 WeakPolarHBondContact O-CB 3.37Å; V439-S446 PolarHBondContact O-OG 3.36Å; V439-V451 HydrophobicContact CG2-CG2 4.12Å
440	F	48.8	Very low	66.7	Low	176 Å²	176	66 Å²	66	77%	0.772	38%	0.376	S	S	*	.			trans	-81.9	64.3	173.2	-150.3	-86.1	0	0	0	108	N438 Q442	N438-F440 PolarHBondContact O-N 3.47Å; F440-Q442 PolarHBondContact O-N 3.44Å
441	L	48.6	Very low	66.3	Low	25 Å²	25	60 Å²	60	13%	0.131	35%	0.349	C	S	.	.			trans	-62.3	121.3	158	-84.3	165.5	0	0	0	105.6	I323 V439 T443	I323-L441 HydrophobicContact CG2-CD1 4.25Å; V439-L441 HydrophobicContact CG1-CD1 4.06Å; V439-L441 HydrophobicContact CG1-CG 4Å; V439-L441 PolarHBondContact O-N 3.13Å; L441-T443 PolarHBondContact O-N 3.01Å
442	Q	36.9	Very low	66.1	Low	185 Å²	185	62.1 Å²	62.1	86%	0.864	36%	0.361	S	S	*	.	S	Bend	trans	-68.1	30.8	-177.5	-150	165.7	10.5	0	0	112.9	F440	F440-Q442 PolarHBondContact O-N 3.44Å
443	T	35.7	Very low	65.9	Low	47 Å²	47	62.9 Å²	62.9	29%	0.288	36%	0.364	S	S	.	.	S	Bend	trans	-115.6	119	171.3	50.9	0	0	0	0	107.1	L441 G445	L441-T443 PolarHBondContact O-N 3.01Å; T443-G445 VanDerWaalsContact C-N 3.32Å; T443-G445 PolarHBondContact O-N 2.81Å
444	T	33.3	Very low	65.8	Low	143 Å²	143	62.2 Å²	62.2	88%	0.877	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-43.8	86.6	169.4	26.7	0	0	0	0	111.7
445	G	38.8	Very low	65.7	Low	32 Å²	32	66.7 Å²	66.7	33%	0.33	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	173.5	-31.3	-174.6	0	0	0	0	0	117.1	A321 T443 A447	A321-G445 WeakPolarHBondContact CB-O 3.39Å; T443-G445 VanDerWaalsContact C-N 3.32Å; T443-G445 PolarHBondContact O-N 2.81Å; G445-A447 PolarHBondContact O-N 2.73Å
446	S	41.9	Very low	65.7	Low	29 Å²	29	69.2 Å²	69.2	20%	0.203	39%	0.391	C	S	.	.	S	Bend	trans	-59.8	128.3	171.7	-88.6	0	0	0	0	109.1	V439 G448	V439-S446 WeakPolarHBondContact O-CB 3.37Å; V439-S446 PolarHBondContact O-OG 3.36Å; S446-G448 PolarHBondContact O-N 3.06Å
447	A	51.7	Low	65.8	Low	36 Å²	36	63.8 Å²	63.8	30%	0.298	36%	0.362	S	S	.	.			trans	-61.3	13.8	-167.3	0	0	0	0	0	116.5	A321 G445 T449	A321-A447 HydrophobicContact CB-CB 4.01Å; G445-A447 PolarHBondContact O-N 2.73Å; A447-T449 HydrophobicContact CB-CG2 4.39Å; A447-T449 WeakPolarHBondContact O-CG2 3.39Å; A447-T449 PolarHBondContact O-N 3.15Å
448	G	54.7	Low	66.4	Low	67 Å²	67	63 Å²	63	69%	0.691	36%	0.359	S	S	*	.	S	Bend	trans	62.7	14.3	-179.6	0	0	0	0	0	113.2	S446	S446-G448 PolarHBondContact O-N 3.06Å
449	T	67.5	Low	67.4	Low	36 Å²	36	58.8 Å²	58.8	22%	0.221	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-98.5	119.3	-175.3	48.5	0	0	0	0	110.7	A447 V451	A447-T449 HydrophobicContact CB-CG2 4.39Å; A447-T449 WeakPolarHBondContact O-CG2 3.39Å; A447-T449 PolarHBondContact O-N 3.15Å; T449-V451 PolarHBondContact O-N 3.2Å
450	A	77.9	Confident	68.9	Low	26 Å²	26	60.4 Å²	60.4	22%	0.215	35%	0.348	C	S	.	.	P	Polyproline II helix	trans	-58.2	133.6	172.1	0	0	0	0	0	111.3	F437 N438	F437-A450 CarbonylContact O-C 3.55Å; F437-A450 WeakPolarHBondContact O-CA 3.23Å; N438-A450 WeakPolarHBondContact OD1-CA 3.45Å; N438-A450 WeakPolarHBondContact OD1-CB 3.49Å; N438-A450 PolarHBondContact OD1-N 2.8Å
451	V	86.9	Confident	70.7	Confident	14 Å²	14	52.2 Å²	52.2	9%	0.085	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	120.2	169.3	179.2	0	0	0	0	107.4	V180 D393 A397 F437 V439 T449	V180-V451 HydrophobicContact CG1-CG1 4.17Å; D393-V451 HydrophobicContact CB-CG2 3.98Å; A397-V451 HydrophobicContact CB-CG1 4.48Å; F437-V451 HydrophobicContact CD1-CB 4.17Å; F437-V451 HydrophobicContact CE1-CB 3.64Å; F437-V451 HydrophobicContact CE1-CG1 3.86Å; F437-V451 HydrophobicContact CE1-CG2 4.38Å; F437-V451 HydrophobicContact CZ-CB 3.95Å; F437-V451 HydrophobicContact CZ-CG1 4.24Å; F437-V451 HydrophobicContact CZ-CG2 4.2Å; F437-V451 PolarHBondContact N-O 2.91Å; F437-V451 PolarHBondContact O-N 2.87Å; V439-V451 HydrophobicContact CG2-CG2 4.12Å; T449-V451 PolarHBondContact O-N 3.2Å
452	M	90.8	Very high	72.7	Confident	79 Å²	79	55.1 Å²	55.1	39%	0.389	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.7	155.7	-177.9	63.1	-178	-64.1	0	0	110.5	P460	M452-P460 HydrophobicContact CG-CG 4.33Å
453	F	92.9	Very high	75.4	Confident	16 Å²	16	46.5 Å²	46.5	7%	0.07	28%	0.282	C	S	.	.			trans	-115.8	146.8	177.2	-56.6	-78.2	0	0	0	111	I159 R179 V180 A397 I432 G457 D458	I159-F453 HydrophobicContact CG2-CZ 4.38Å; R179-F453 WeakPolarHBondContact O-CE1 3.43Å; V180-F453 HydrophobicContact CG1-CE1 4.01Å; V180-F453 HydrophobicContact CG1-CZ 3.9Å; A397-F453 HydrophobicContact CB-CE2 4.26Å; A397-F453 HydrophobicContact CB-CZ 4.21Å; I432-F453 HydrophobicContact CG2-CE2 4.07Å; I432-F453 HydrophobicContact CG2-CZ 4.49Å; I432-F453 WeakPolarHBondContact O-CD2 3.27Å; I432-F453 WeakPolarHBondContact O-CE2 3.38Å; F453-G457 WeakPolarHBondContact CD1-O 3.34Å; F453-D458 WeakPolarHBondContact CA-O 3.47Å
454	N	91.4	Very high	78.1	Confident	54 Å²	54	45.3 Å²	45.3	29%	0.289	27%	0.274	S	S	.	.			trans	-83.3	-176.9	167.6	72	6.2	0	0	0	111.3	N456 G457 D458	N454-N456 PolarHBondContact O-N 3.04Å; N454-N456 VanDerWaalsContact O-N 3.11Å; N454-N456 WeakPolarHBondContact OD1-CA 3.35Å; N454-N456 WeakPolarHBondContact OD1-CB 3.39Å; N454-N456 PolarHBondContact OD1-N 2.91Å; N454-G457 PolarHBondContact O-N 3.12Å; N454-G457 PolarHBondContact OD1-N 2.61Å; N454-G457 VanDerWaalsContact OD1-N 3.16Å; N454-D458 PolarHBondContact N-O 3.1Å; N454-D458 WeakPolarHBondContact OD1-CB 3.43Å; N454-D458 PolarHBondContact OD1-N 2.8Å; N454-D458 PolarHBondContact OD1-O 2.98Å
455	E	90.1	Very high	81.1	Confident	176 Å²	176	38.5 Å²	38.5	82%	0.822	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-25.4	178.8	-61.2	-178.2	171.1	0	0	113.9	N171	N171-E455 PolarHBondContact ND2-O 3.04Å
456	N	91.8	Very high	83.8	Confident	64 Å²	64	38.5 Å²	38.5	34%	0.342	22%	0.223	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.7	0.2	178	-61.8	-22.7	0	0	0	113.5	N171 N454	N171-N456 PolarHBondContact ND2-OD1 2.99Å; N454-N456 PolarHBondContact O-N 3.04Å; N454-N456 VanDerWaalsContact O-N 3.11Å; N454-N456 WeakPolarHBondContact OD1-CA 3.35Å; N454-N456 WeakPolarHBondContact OD1-CB 3.39Å; N454-N456 PolarHBondContact OD1-N 2.91Å
457	G	92	Very high	86.3	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.213	C	C	.	.	S	Bend	trans	77.6	19.1	-175.1	0	0	0	0	0	114	S178 R179 F453 N454	S178-G457 CarbonylContact C-O 3.47Å; S178-G457 WeakPolarHBondContact CA-O 3.2Å; S178-G457 WeakPolarHBondContact CB-O 3.1Å; R179-G457 PolarHBondContact N-O 2.87Å; F453-G457 WeakPolarHBondContact CD1-O 3.34Å; N454-G457 PolarHBondContact O-N 3.12Å; N454-G457 PolarHBondContact OD1-N 2.61Å; N454-G457 VanDerWaalsContact OD1-N 3.16Å
458	D	94.1	Very high	88.2	Confident	3 Å²	3	36 Å²	36	2%	0.016	20%	0.202	C	C	.	.	B	Isolated β-bridge	trans	-101	145.4	180	-61.2	-51	0	0	0	112.8	S169 R179 P183 F453 N454	S169-D458 WeakPolarHBondContact CB-OD2 3.36Å; S169-D458 VanDerWaalsContact OG-CG 3.3Å; S169-D458 PolarHBondContact OG-OD1 2.88Å; S169-D458 PolarHBondContact OG-OD2 2.86Å; R179-D458 IonicContact CZ-OD1 2.67Å; R179-D458 IonicContact NE-OD1 2.69Å; R179-D458 PolarHBondContact NE-OD1 2.94Å; R179-D458 IonicContact NH2-OD1 3.3Å; R179-D458 PolarHBondContact NH2-OD1 2.96Å; R179-D458 IonicContact NH2-OD2 3.83Å; P183-D458 HydrophobicContact CG-CB 4.3Å; F453-D458 WeakPolarHBondContact CA-O 3.47Å; N454-D458 PolarHBondContact N-O 3.1Å; N454-D458 WeakPolarHBondContact OD1-CB 3.43Å; N454-D458 PolarHBondContact OD1-N 2.8Å; N454-D458 PolarHBondContact OD1-O 2.98Å
459	A	91.1	Very high	90	Very high	10 Å²	10	33 Å²	33	8%	0.083	17%	0.17	C	C	.	.	P	Polyproline II helix	trans	-73.2	150.2	167.2	0	0	0	0	0	112.2	R179 V180	R179-A459 PolarHBondContact O-N 3.28Å; R179-A459 VanDerWaalsContact O-N 3.14Å; V180-A459 WeakPolarHBondContact O-CB 3.33Å
460	P	89.5	Confident	90.7	Very high	51 Å²	51	34.2 Å²	34.2	33%	0.331	17%	0.173	S	C	.	.	P	Polyproline II helix	trans	-66.9	144.7	178.1	27.2	-34.5	0	0	0	112.7	M452 R462	M452-P460 HydrophobicContact CG-CG 4.33Å; P460-R462 PolarHBondContact O-N 2.76Å
461	G	87.8	Confident	90.2	Very high	3 Å²	3	34.2 Å²	34.2	3%	0.031	17%	0.172	C	C	.	.			trans	-71.1	113	179.6	0	0	0	0	0	113.5	W484	G461-W484 WeakPolarHBondContact O-CZ3 3.31Å
462	R	90.1	Very high	89	Confident	86 Å²	86	42 Å²	42	33%	0.325	21%	0.213	S	C	.	.			trans	-138	120.8	173.3	-58.1	-179.9	-174.7	174.6	3.5	109	P318 K319 P460 W484 T485	P318-R462 WeakPolarHBondContact CA-O 3.16Å; K319-R462 HydrophobicContact CB-CB 4.12Å; K319-R462 PolarHBondContact N-O 3.11Å; P460-R462 PolarHBondContact O-N 2.76Å; R462-W484 WeakPolarHBondContact CA-O 3.47Å; R462-T485 HydrophobicContact CB-CG2 4.48Å; R462-T485 HydrophobicContact CG-CG2 4.29Å
463	Y	93.1	Very high	87.5	Confident	5 Å²	5	45 Å²	45	2%	0.02	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	142.9	-176.7	-57.3	-88.4	0	0	0	111.9	P182 P183 Q187 A190 L317 P318 Q483 W484	P182-Y463 HydrophobicContact CG-CE1 4.05Å; P182-Y463 HydrophobicContact CG-CE2 4.4Å; P182-Y463 VanDerWaalsContact CG-OH 3.29Å; P182-Y463 WeakPolarHBondContact CG-OH 3.44Å; P183-Y463 PolarHBondContact O-OH 3.34Å; Q187-Y463 HydrophobicContact CB-CE1 4.39Å; Q187-Y463 HydrophobicContact CG-CE1 4.38Å; Q187-Y463 PolarHBondContact N-OH 3.04Å; A190-Y463 HydrophobicContact CB-CD2 4.35Å; L317-Y463 CarbonylContact O-C 3.56Å; L317-Y463 WeakPolarHBondContact O-CA 3.25Å; L317-Y463 WeakPolarHBondContact O-CB 3.37Å; P318-Y463 HydrophobicContact CB-CE1 4.5Å; P318-Y463 HydrophobicContact CG-CD1 4.26Å; P318-Y463 HydrophobicContact CG-CE1 4.01Å; Y463-Q483 CarbonylContact O-C 3.58Å; Y463-Q483 WeakPolarHBondContact O-CA 2.72Å; Y463-W484 HydrophobicContact CD2-CD2 4.48Å; Y463-W484 AromaticContact CD2-CE3 3.72Å; Y463-W484 HydrophobicContact CD2-CE3 3.72Å; Y463-W484 HydrophobicContact CD2-CZ3 4.25Å; Y463-W484 HydrophobicContact CE2-CE3 4.17Å; Y463-W484 HydrophobicContact CE2-CZ3 4.24Å; Y463-W484 PolarHBondContact N-O 2.99Å; Y463-W484 PolarHBondContact O-N 3.48Å
464	D	93.3	Very high	86	Confident	22 Å²	22	45.9 Å²	45.9	12%	0.118	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	139.8	162.8	-65.9	-47.7	0	0	0	108.5	L317 F466 Q483	L317-D464 PolarHBondContact N-O 3.17Å; L317-D464 PolarHBondContact O-N 2.84Å; D464-F466 HydrophobicContact CB-CD2 4.48Å; D464-F466 HydrophobicContact CB-CE2 3.62Å; D464-F466 HydrophobicContact CB-CZ 4.06Å; D464-Q483 WeakPolarHBondContact OD1-CG 3.36Å; D464-Q483 PolarHBondContact OD1-NE2 3.15Å
465	I	95.9	Very high	84.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	126	-175	-52.9	168.5	0	0	0	107.8	I194 V314 I316 V480 I481 G482 W484 L488 L490	I194-I465 HydrophobicContact CD1-CD1 3.79Å; I194-I465 HydrophobicContact CD1-CG1 4.06Å; I194-I465 HydrophobicContact CD1-CG2 3.97Å; I194-I465 HydrophobicContact CG1-CD1 3.96Å; V314-I465 HydrophobicContact CG1-CG2 3.71Å; I316-I465 HydrophobicContact CG2-CG1 4.13Å; I316-I465 HydrophobicContact CG2-CG2 4.34Å; I465-V480 WeakPolarHBondContact O-CA 3.19Å; I465-I481 HydrophobicContact CB-CG1 4.4Å; I465-I481 HydrophobicContact CG2-CD1 4.11Å; I465-I481 HydrophobicContact CG2-CG1 3.91Å; I465-I481 PolarHBondContact O-N 2.79Å; I465-G482 PolarHBondContact N-O 3.01Å; I465-G482 PolarHBondContact O-N 2.01Å; I465-W484 HydrophobicContact CD1-CB 4.46Å; I465-L488 HydrophobicContact CD1-CD1 3.16Å; I465-L490 HydrophobicContact CD1-CD1 4.14Å; I465-L490 HydrophobicContact CG2-CD1 4.09Å
466	F	94.6	Very high	84.3	Confident	31 Å²	31	45.9 Å²	45.9	14%	0.136	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	152.4	-177.6	-63.9	-95.6	0	0	0	110.6	A298 V314 T315 L317 D464 Y478 R479 V480	A298-F466 HydrophobicContact CB-CD1 4.03Å; A298-F466 HydrophobicContact CB-CD2 4.33Å; A298-F466 HydrophobicContact CB-CE1 4.16Å; A298-F466 HydrophobicContact CB-CE2 4.49Å; A298-F466 HydrophobicContact CB-CG 4.11Å; A298-F466 HydrophobicContact CB-CZ 4.4Å; V314-F466 CarbonylContact C-O 3.13Å; V314-F466 VanDerWaalsContact CA-O 3.31Å; V314-F466 WeakPolarHBondContact CA-O 3.19Å; T315-F466 PolarHBondContact N-O 3.41Å; T315-F466 PolarHBondContact O-N 3.49Å; L317-F466 HydrophobicContact CB-CD2 4.47Å; L317-F466 HydrophobicContact CB-CE2 4.02Å; L317-F466 HydrophobicContact CD1-CD2 4.36Å; L317-F466 HydrophobicContact CD1-CE2 3.95Å; L317-F466 HydrophobicContact CG-CE2 4.38Å; D464-F466 HydrophobicContact CB-CD2 4.48Å; D464-F466 HydrophobicContact CB-CE2 3.62Å; D464-F466 HydrophobicContact CB-CZ 4.06Å; F466-Y478 HydrophobicContact CB-CD1 4.24Å; F466-R479 CarbonylContact C-O 3.59Å; F466-R479 WeakPolarHBondContact CA-O 2.91Å; F466-V480 HydrophobicContact CD1-CG2 3.83Å; F466-V480 HydrophobicContact CE1-CB 4.43Å; F466-V480 HydrophobicContact CE1-CG2 3.29Å; F466-V480 HydrophobicContact CZ-CG2 3.8Å
467	Q	94.7	Very high	84	Confident	0 Å²	0	44 Å²	44	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	136.3	164	-167.5	-177.7	38.5	0	0	109.7	G312 A313 V314 Q469 Y478 R479 I481 Q496	G312-Q467 PolarHBondContact O-NE2 3.19Å; A313-Q467 VanDerWaalsContact O-CA 3.3Å; A313-Q467 WeakPolarHBondContact O-CA 3.33Å; V314-Q467 HydrophobicContact CG2-CG 4.26Å; Q467-Q469 HydrophobicContact CB-CG 4.4Å; Q467-Q469 HydrophobicContact CG-CG 4.25Å; Q467-Y478 WeakPolarHBondContact O-CA 3.49Å; Q467-R479 PolarHBondContact N-O 3.29Å; Q467-R479 PolarHBondContact O-N 2.69Å; Q467-I481 HydrophobicContact CB-CD1 3.89Å; Q467-I481 HydrophobicContact CB-CG1 4.28Å; Q467-I481 HydrophobicContact CB-CG2 3.94Å; Q467-Q496 PolarHBondContact NE2-O 3.29Å; Q467-Q496 PolarHBondContact OE1-O 3.26Å
468	Y	93.2	Very high	83.9	Confident	13 Å²	13	46.2 Å²	46.2	5%	0.051	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	117.1	171.7	-171.2	-104.4	0	0	0	110	I303 E307 A310 G312 A313 M470 Y478	I303-Y468 HydrophobicContact CD1-CD2 3.62Å; I303-Y468 HydrophobicContact CD1-CE1 4.25Å; I303-Y468 HydrophobicContact CD1-CE2 3.25Å; I303-Y468 HydrophobicContact CD1-CG 4.25Å; E307-Y468 HydrophobicContact CB-CE1 4.04Å; E307-Y468 WeakPolarHBondContact CB-OH 3.36Å; E307-Y468 VanDerWaalsContact CG-OH 3.28Å; E307-Y468 WeakPolarHBondContact CG-OH 3.5Å; A310-Y468 HydrophobicContact CB-CD1 4.03Å; A310-Y468 HydrophobicContact CB-CE1 4.44Å; G312-Y468 PolarHBondContact N-O 3.05Å; A313-Y468 PolarHBondContact O-N 3.36Å; Y468-M470 HydrophobicContact CD1-CG 4.46Å; Y468-M470 HydrophobicContact CE1-CG 3.71Å; Y468-M470 HydrophobicContact CE1-SD 4.07Å; Y468-Y478 HydrophobicContact CD2-CD1 4.11Å; Y468-Y478 HydrophobicContact CD2-CD2 4.22Å; Y468-Y478 AromaticContact CD2-CE1 3.98Å; Y468-Y478 HydrophobicContact CD2-CE1 3.98Å; Y468-Y478 HydrophobicContact CD2-CE2 4.08Å; Y468-Y478 HydrophobicContact CD2-CG 4.23Å; Y468-Y478 AromaticContact CD2-CZ 3.97Å; Y468-Y478 HydrophobicContact CG-CE1 4.34Å
469	Q	90.9	Very high	83.8	Confident	5 Å²	5	51.8 Å²	51.8	2%	0.023	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	128.1	-175.6	-61.9	-179.1	-1.9	0	0	110.4	Q467 P476 G477 E494 Q496	Q467-Q469 HydrophobicContact CB-CG 4.4Å; Q467-Q469 HydrophobicContact CG-CG 4.25Å; Q469-P476 WeakPolarHBondContact O-CA 3.47Å; Q469-G477 PolarHBondContact N-O 3.42Å; Q469-G477 VanDerWaalsContact N-O 3.07Å; Q469-G477 PolarHBondContact O-N 3.22Å; Q469-E494 PolarHBondContact NE2-O 3.35Å; Q469-Q496 HydrophobicContact CG-CB 4.2Å
470	M	82.6	Confident	83.8	Confident	60 Å²	60	54.8 Å²	54.8	30%	0.296	30%	0.296	S	S	.	.			trans	-103.6	94	170.9	-68.1	177.8	72.7	0	0	108.1	E307 E308 E311 Y468 P476	E307-M470 VanDerWaalsContact C-SD 3.6Å; E307-M470 HydrophobicContact CB-CE 4.38Å; E307-M470 HydrophobicContact CB-SD 4.09Å; E308-M470 HydrophobicContact CG-CE 4.29Å; E311-M470 HydrophobicContact CB-SD 4.23Å; E311-M470 HydrophobicContact CG-CB 4.16Å; E311-M470 HydrophobicContact CG-CG 4.33Å; E311-M470 HydrophobicContact CG-SD 4.47Å; Y468-M470 HydrophobicContact CD1-CG 4.46Å; Y468-M470 HydrophobicContact CE1-CG 3.71Å; Y468-M470 HydrophobicContact CE1-SD 4.07Å; M470-P476 HydrophobicContact CG-CB 4.16Å
471	S	68.3	Low	84	Confident	27 Å²	27	52.5 Å²	52.5	19%	0.189	28%	0.281	C	S	.	.			trans	-98.8	145.5	176.4	-174.4	0	0	0	0	110.5	V473 S474	S471-V473 PolarHBondContact O-N 3.45Å; S471-V473 PolarHBondContact OG-N 3.04Å; S471-S474 WeakPolarHBondContact CB-OG 3.46Å
472	N	60.6	Low	84.3	Confident	177 Å²	177	52.9 Å²	52.9	95%	0.947	29%	0.285	S	S	*	.	S	Bend	trans	-72.4	-14.3	168.9	-73.3	-20.9	0	0	0	112.8
473	V	60.1	Low	84.5	Confident	142 Å²	142	52.4 Å²	52.4	86%	0.861	29%	0.286	S	S	*	.	S	Bend	trans	-103.7	-26.1	-172.9	-173	0	0	0	0	112.5	S471	S471-V473 PolarHBondContact O-N 3.45Å; S471-V473 PolarHBondContact OG-N 3.04Å
474	S	60.1	Low	84.6	Confident	34 Å²	34	52.4 Å²	52.4	24%	0.238	29%	0.286	C	S	.	.	S	Bend	trans	-127.6	150.2	177.3	65.4	0	0	0	0	110.5	S471 R479	S471-S474 WeakPolarHBondContact CB-OG 3.46Å; S474-R479 PolarHBondContact OG-NH2 3.21Å
475	N	67.3	Low	84.5	Confident	152 Å²	152	54.3 Å²	54.3	81%	0.813	30%	0.298	S	S	*	.			trans	-50	135.7	174.5	-71.6	-14.4	0	0	0	111.3
476	P	78.3	Confident	84	Confident	78 Å²	78	59.4 Å²	59.4	51%	0.506	33%	0.326	S	S	.	.	S	Bend	trans	-60.4	138.5	176.7	25.8	-33.8	0	0	0	109.9	Q469 M470	Q469-P476 WeakPolarHBondContact O-CA 3.47Å; M470-P476 HydrophobicContact CG-CB 4.16Å
477	G	86.6	Confident	83.8	Confident	24 Å²	24	64.8 Å²	64.8	25%	0.247	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	172.5	175.9	-177.6	0	0	0	0	0	113.9	Q469	Q469-G477 PolarHBondContact N-O 3.42Å; Q469-G477 VanDerWaalsContact N-O 3.07Å; Q469-G477 PolarHBondContact O-N 3.22Å
478	Y	90.1	Very high	83.8	Confident	47 Å²	47	66.8 Å²	66.8	18%	0.184	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	129.2	174	-66.3	-80.6	0	0	0	110.6	W296 G297 A298 K299 I303 F466 Q467 Y468	W296-Y478 VanDerWaalsContact CD1-OH 3.31Å; W296-Y478 AromaticContact NE1-CZ 3.86Å; W296-Y478 PolarHBondContact NE1-OH 2.87Å; G297-Y478 WeakPolarHBondContact O-CE1 3.35Å; A298-Y478 VanDerWaalsContact C-CD2 3.49Å; A298-Y478 HydrophobicContact CB-CD1 4.36Å; A298-Y478 HydrophobicContact CB-CD2 3.97Å; A298-Y478 HydrophobicContact CB-CG 3.83Å; A298-Y478 WeakPolarHBondContact O-CD2 3.42Å; A298-Y478 WeakPolarHBondContact O-CE2 3.27Å; K299-Y478 VanDerWaalsContact O-CE2 3.25Å; K299-Y478 WeakPolarHBondContact O-CE2 3.1Å; K299-Y478 PolarHBondContact O-OH 3.22Å; I303-Y478 HydrophobicContact CD1-CE2 4Å; I303-Y478 WeakPolarHBondContact CD1-OH 3.31Å; F466-Y478 HydrophobicContact CB-CD1 4.24Å; Q467-Y478 WeakPolarHBondContact O-CA 3.49Å; Y468-Y478 HydrophobicContact CD2-CD1 4.11Å; Y468-Y478 HydrophobicContact CD2-CD2 4.22Å; Y468-Y478 AromaticContact CD2-CE1 3.98Å; Y468-Y478 HydrophobicContact CD2-CE1 3.98Å; Y468-Y478 HydrophobicContact CD2-CE2 4.08Å; Y468-Y478 HydrophobicContact CD2-CG 4.23Å; Y468-Y478 AromaticContact CD2-CZ 3.97Å; Y468-Y478 HydrophobicContact CG-CE1 4.34Å
479	R	91.1	Very high	83.9	Confident	121 Å²	121	74.8 Å²	74.8	46%	0.457	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	138.5	171.2	-66.9	-159.6	-177.6	-176.8	-3.9	110.6	F466 Q467 S474 I481	F466-R479 CarbonylContact C-O 3.59Å; F466-R479 WeakPolarHBondContact CA-O 2.91Å; Q467-R479 PolarHBondContact N-O 3.29Å; Q467-R479 PolarHBondContact O-N 2.69Å; S474-R479 PolarHBondContact OG-NH2 3.21Å; R479-I481 PolarHBondContact O-N 3.36Å
480	V	91.9	Very high	84	Confident	72 Å²	72	76.1 Å²	76.1	44%	0.436	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	120.6	171.9	-178.5	0	0	0	0	107.8	I465 F466	I465-V480 WeakPolarHBondContact O-CA 3.19Å; F466-V480 HydrophobicContact CD1-CG2 3.83Å; F466-V480 HydrophobicContact CE1-CB 4.43Å; F466-V480 HydrophobicContact CE1-CG2 3.29Å; F466-V480 HydrophobicContact CZ-CG2 3.8Å
481	I	94.1	Very high	84.5	Confident	4 Å²	4	76.3 Å²	76.3	2%	0.021	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-4.8	178.6	58.2	160.5	0	0	0	112.3	V314 I465 Q467 R479 L490 N491 M495	V314-I481 HydrophobicContact CG1-CD1 4.33Å; V314-I481 HydrophobicContact CG2-CD1 4.45Å; I465-I481 HydrophobicContact CB-CG1 4.4Å; I465-I481 HydrophobicContact CG2-CD1 4.11Å; I465-I481 HydrophobicContact CG2-CG1 3.91Å; I465-I481 PolarHBondContact O-N 2.79Å; Q467-I481 HydrophobicContact CB-CD1 3.89Å; Q467-I481 HydrophobicContact CB-CG1 4.28Å; Q467-I481 HydrophobicContact CB-CG2 3.94Å; R479-I481 PolarHBondContact O-N 3.36Å; I481-L490 HydrophobicContact CD1-CD1 3.74Å; I481-L490 HydrophobicContact CG1-CD1 3.95Å; I481-N491 PolarHBondContact O-N 2.83Å; I481-M495 HydrophobicContact CD1-CE 3.86Å; I481-M495 HydrophobicContact CD1-CG 3.96Å; I481-M495 HydrophobicContact CD1-SD 4.14Å
482	G	94.1	Very high	85.4	Confident	11 Å²	11	78.6 Å²	78.6	11%	0.113	41%	0.411	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.1	178.4	-178.1	0	0	0	0	0	114.4	I465 R489	I465-G482 PolarHBondContact N-O 3.01Å; I465-G482 PolarHBondContact O-N 2.01Å; G482-R489 CarbonylContact C-O 3.55Å; G482-R489 WeakPolarHBondContact CA-O 3.03Å
483	Q	94.6	Very high	86.7	Confident	75 Å²	75	77.8 Å²	77.8	35%	0.35	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	151	177.4	-61.9	-172.9	-37.3	0	0	110.1	Y463 D464 R489	Y463-Q483 CarbonylContact O-C 3.58Å; Y463-Q483 WeakPolarHBondContact O-CA 2.72Å; D464-Q483 WeakPolarHBondContact OD1-CG 3.36Å; D464-Q483 PolarHBondContact OD1-NE2 3.15Å; Q483-R489 PolarHBondContact N-O 2.99Å; Q483-R489 PolarHBondContact O-N 2.71Å
484	W	95	Very high	87.9	Confident	5 Å²	5	76 Å²	76	2%	0.019	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	120.5	174.9	-170.2	97.2	0	0	0	110.2	Y186 Q189 A190 D193 G461 R462 Y463 I465 H487	Y186-W484 AromaticContact CD1-CH2 3.96Å; Y186-W484 HydrophobicContact CD1-CH2 3.96Å; Y186-W484 HydrophobicContact CD1-CZ3 4.42Å; Q189-W484 HydrophobicContact CB-CZ2 4.25Å; Q189-W484 HydrophobicContact CG-CZ2 3.82Å; A190-W484 HydrophobicContact CB-CB 4.23Å; A190-W484 HydrophobicContact CB-CD2 3.77Å; A190-W484 HydrophobicContact CB-CE3 4.38Å; A190-W484 HydrophobicContact CB-CG 3.69Å; D193-W484 PolarHBondContact OD2-NE1 2.01Å; G461-W484 WeakPolarHBondContact O-CZ3 3.31Å; R462-W484 WeakPolarHBondContact CA-O 3.47Å; Y463-W484 HydrophobicContact CD2-CD2 4.48Å; Y463-W484 AromaticContact CD2-CE3 3.72Å; Y463-W484 HydrophobicContact CD2-CE3 3.72Å; Y463-W484 HydrophobicContact CD2-CZ3 4.25Å; Y463-W484 HydrophobicContact CE2-CE3 4.17Å; Y463-W484 HydrophobicContact CE2-CZ3 4.24Å; Y463-W484 PolarHBondContact N-O 2.99Å; Y463-W484 PolarHBondContact O-N 3.48Å; I465-W484 HydrophobicContact CD1-CB 4.46Å; W484-H487 WeakPolarHBondContact CA-O 3.28Å
485	T	90.8	Very high	89.4	Confident	62 Å²	62	74.4 Å²	74.4	38%	0.38	37%	0.372	S	S	.	.	S	Bend	trans	-139.2	84.9	174.8	55.3	0	0	0	0	108.2	R462 H487	R462-T485 HydrophobicContact CB-CG2 4.48Å; R462-T485 HydrophobicContact CG-CG2 4.29Å; T485-H487 PolarHBondContact N-O 2.81Å; T485-H487 VanDerWaalsContact N-O 3.12Å; T485-H487 PolarHBondContact O-N 2.96Å
486	N	85.1	Confident	90.4	Very high	107 Å²	107	69 Å²	69	57%	0.572	34%	0.342	S	S	*	.	S	Bend	trans	60.8	-27.1	-166.2	-59.4	-25.2	0	0	0	115.4
487	H	91	Very high	91	Very high	145 Å²	145	65.5 Å²	65.5	67%	0.671	32%	0.319	S	S	*	.	S	Bend	trans	-130.5	148.6	174.8	-56.4	-59.6	0	0	0	109.8	W484 T485	W484-H487 WeakPolarHBondContact CA-O 3.28Å; T485-H487 PolarHBondContact N-O 2.81Å; T485-H487 VanDerWaalsContact N-O 3.12Å; T485-H487 PolarHBondContact O-N 2.96Å
488	L	94.7	Very high	90.8	Very high	41 Å²	41	66 Å²	66	22%	0.215	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	131.8	178.1	179.3	63.6	0	0	0	111.9	D193 I194 A197 I465 L490	D193-L488 VanDerWaalsContact C-CD2 3.47Å; D193-L488 HydrophobicContact CB-CB 3.97Å; D193-L488 HydrophobicContact CB-CD2 4Å; D193-L488 WeakPolarHBondContact O-CD2 3.23Å; I194-L488 HydrophobicContact CG1-CD1 3.85Å; I194-L488 HydrophobicContact CG1-CD2 4.14Å; A197-L488 HydrophobicContact CB-CD2 3.66Å; I465-L488 HydrophobicContact CD1-CD1 3.16Å; L488-L490 HydrophobicContact CD1-CB 4.18Å; L488-L490 HydrophobicContact CD2-CB 4.25Å; L488-L490 HydrophobicContact CD2-CD2 4.48Å; L488-L490 HydrophobicContact CG-CB 4.1Å
489	R	94.6	Very high	90.2	Very high	182 Å²	182	67.6 Å²	67.6	69%	0.687	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.6	105.4	164.4	-63.8	-179.9	-177.6	175.9	0.7	108.2	G482 Q483	G482-R489 CarbonylContact C-O 3.55Å; G482-R489 WeakPolarHBondContact CA-O 3.03Å; Q483-R489 PolarHBondContact N-O 2.99Å; Q483-R489 PolarHBondContact O-N 2.71Å
490	L	93.2	Very high	89.6	Confident	33 Å²	33	63.2 Å²	63.2	17%	0.173	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	132.1	-176	-164.3	67.5	0	0	0	109.9	A197 I465 I481 L488 L492 M495	A197-L490 HydrophobicContact CB-CD2 4.24Å; I465-L490 HydrophobicContact CD1-CD1 4.14Å; I465-L490 HydrophobicContact CG2-CD1 4.09Å; I481-L490 HydrophobicContact CD1-CD1 3.74Å; I481-L490 HydrophobicContact CG1-CD1 3.95Å; L488-L490 HydrophobicContact CD1-CB 4.18Å; L488-L490 HydrophobicContact CD2-CB 4.25Å; L488-L490 HydrophobicContact CD2-CD2 4.48Å; L488-L490 HydrophobicContact CG-CB 4.1Å; L490-L492 HydrophobicContact CD2-CD2 3.67Å; L490-L492 HydrophobicContact CG-CD2 4.16Å; L490-M495 HydrophobicContact CD2-SD 4.24Å
491	N	92.4	Very high	89.2	Confident	63 Å²	63	65 Å²	65	34%	0.337	35%	0.348	S	S	.	.			trans	-94.4	94.6	174.1	-167.1	-8.4	0	0	0	109.9	I481 E493 E494	I481-N491 PolarHBondContact O-N 2.83Å; N491-E493 VanDerWaalsContact C-N 3.26Å; N491-E493 PolarHBondContact O-N 2.81Å; N491-E493 PolarHBondContact OD1-N 3.25Å; N491-E494 HydrophobicContact CB-CB 4.43Å; N491-E494 HydrophobicContact CB-CG 4.46Å; N491-E494 WeakPolarHBondContact ND2-CG 3.02Å; N491-E494 PolarHBondContact ND2-OE1 3.28Å; N491-E494 PolarHBondContact O-N 3.31Å
492	L	88.6	Confident	88.9	Confident	76 Å²	76	73.7 Å²	73.7	40%	0.398	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-66.9	-26	-176.8	-61.1	177	0	0	0	112.9	L490 E494 M495 I504	L490-L492 HydrophobicContact CD2-CD2 3.67Å; L490-L492 HydrophobicContact CG-CD2 4.16Å; L492-E494 VanDerWaalsContact C-N 3.31Å; L492-E494 PolarHBondContact O-N 3.4Å; L492-M495 HydrophobicContact CD2-SD 3.87Å; L492-M495 PolarHBondContact O-N 2.99Å; L492-I504 HydrophobicContact CD2-CD1 4.07Å
493	E	86.6	Confident	88.7	Confident	159 Å²	159	80.2 Å²	80.2	74%	0.743	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-74.6	-23.8	-177.6	-62	-172.5	175.5	0	0	113.2	N491 M495	N491-E493 VanDerWaalsContact C-N 3.26Å; N491-E493 PolarHBondContact O-N 2.81Å; N491-E493 PolarHBondContact OD1-N 3.25Å; E493-M495 VanDerWaalsContact C-N 3.33Å
494	E	86.4	Confident	88.5	Confident	105 Å²	105	78.3 Å²	78.3	49%	0.491	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-84.2	-9.5	176.3	-73.6	179.3	-172.4	0	0	112.8	Q469 N491 L492	Q469-E494 PolarHBondContact NE2-O 3.35Å; N491-E494 HydrophobicContact CB-CB 4.43Å; N491-E494 HydrophobicContact CB-CG 4.46Å; N491-E494 WeakPolarHBondContact ND2-CG 3.02Å; N491-E494 PolarHBondContact ND2-OE1 3.28Å; N491-E494 PolarHBondContact O-N 3.31Å; L492-E494 VanDerWaalsContact C-N 3.31Å; L492-E494 PolarHBondContact O-N 3.4Å
495	M	90	Very high	88.3	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.005	41%	0.405	C	S	.	.			trans	-73.8	138	179.8	-62.5	-173.7	76.5	0	0	111.7	M198 V314 I481 L490 L492 E493 W497	M198-M495 HydrophobicContact SD-CE 4.03Å; V314-M495 HydrophobicContact CG2-CE 3.72Å; I481-M495 HydrophobicContact CD1-CE 3.86Å; I481-M495 HydrophobicContact CD1-CG 3.96Å; I481-M495 HydrophobicContact CD1-SD 4.14Å; L490-M495 HydrophobicContact CD2-SD 4.24Å; L492-M495 HydrophobicContact CD2-SD 3.87Å; L492-M495 PolarHBondContact O-N 2.99Å; E493-M495 VanDerWaalsContact C-N 3.33Å; M495-W497 HydrophobicContact CE-CH2 3.67Å; M495-W497 HydrophobicContact CE-CZ2 3.41Å; M495-W497 VanDerWaalsContact CE-CZ2 3.41Å; M495-W497 HydrophobicContact SD-CZ2 4.43Å
496	Q	90	Very high	88.4	Confident	39 Å²	39	80.8 Å²	80.8	18%	0.182	41%	0.408	C	S	.	.			trans	-133.6	138	178.5	-169	173.7	19.3	0	0	110.3	Q467 Q469 G500	Q467-Q496 PolarHBondContact NE2-O 3.29Å; Q467-Q496 PolarHBondContact OE1-O 3.26Å; Q469-Q496 HydrophobicContact CG-CB 4.2Å; Q496-G500 VanDerWaalsContact NE2-CA 3.3Å
497	W	89.7	Confident	88.8	Confident	4 Å²	4	75.7 Å²	75.7	2%	0.015	38%	0.381	C	S	.	.			trans	-118	175.6	-178.6	-52.3	98.6	0	0	0	110.7	M198 W200 L289 G312 V314 M495 G499 G500 D501 K503 I504 P505	M198-W497 HydrophobicContact SD-CH2 3.82Å; M198-W497 HydrophobicContact SD-CZ2 4.24Å; W200-W497 HydrophobicContact CZ2-CH2 4.44Å; L289-W497 HydrophobicContact CD2-CE3 3.82Å; L289-W497 HydrophobicContact CD2-CZ3 4.02Å; G312-W497 WeakPolarHBondContact O-CZ3 3.17Å; V314-W497 HydrophobicContact CG2-CH2 4.33Å; M495-W497 HydrophobicContact CE-CH2 3.67Å; M495-W497 HydrophobicContact CE-CZ2 3.41Å; M495-W497 VanDerWaalsContact CE-CZ2 3.41Å; M495-W497 HydrophobicContact SD-CZ2 4.43Å; W497-G499 PolarHBondContact O-N 3.26Å; W497-G500 WeakPolarHBondContact O-CA 3.34Å; W497-G500 PolarHBondContact O-N 3.03Å; W497-D501 PolarHBondContact N-O 2.92Å; W497-K503 VanDerWaalsContact CD1-O 3.24Å; W497-I504 HydrophobicContact CZ2-CB 4.29Å; W497-I504 HydrophobicContact CZ2-CG1 4.08Å; W497-I504 HydrophobicContact CZ2-CG2 3.86Å; W497-P505 HydrophobicContact CB-CG 4.33Å; W497-P505 VanDerWaalsContact CD2-CD 3.49Å; W497-P505 HydrophobicContact CD2-CG 4.14Å; W497-P505 HydrophobicContact CE3-CG 4.4Å; W497-P505 HydrophobicContact CG-CG 4.1Å
498	S	83.4	Confident	88.9	Confident	35 Å²	35	69.8 Å²	69.8	25%	0.245	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-50.6	133.4	-177.1	-56.6	0	0	0	0	113.3	E311 G500	E311-S498 WeakPolarHBondContact OE2-CA 3.41Å; S498-G500 PolarHBondContact O-N 3.24Å
499	G	77.9	Confident	88.7	Confident	79 Å²	79	68.6 Å²	68.6	81%	0.814	35%	0.35	S	S	*	.	G	3₁₀ helix	trans	78.3	6	-177.1	0	0	0	0	0	114.4	W497	W497-G499 PolarHBondContact O-N 3.26Å
500	G	77.9	Confident	88.4	Confident	30 Å²	30	60.9 Å²	60.9	31%	0.309	32%	0.324	S	S	.	.	G	3₁₀ helix	trans	85.1	10.5	176.6	0	0	0	0	0	115.2	Q496 W497 S498	Q496-G500 VanDerWaalsContact NE2-CA 3.3Å; W497-G500 WeakPolarHBondContact O-CA 3.34Å; W497-G500 PolarHBondContact O-N 3.03Å; S498-G500 PolarHBondContact O-N 3.24Å
501	D	84.1	Confident	88.2	Confident	108 Å²	108	65 Å²	65	58%	0.578	34%	0.34	S	S	*	.			trans	-65.5	139.1	175.2	-83.6	-26.3	0	0	0	111.4	W497	W497-D501 PolarHBondContact N-O 2.92Å
502	R	86.3	Confident	88	Confident	187 Å²	187	66.7 Å²	66.7	71%	0.706	36%	0.355	S	S	*	.			trans	-96.8	-12.4	172.9	-63.6	-172.8	-177.3	-170.5	-0.7	113	I504	R502-I504 PolarHBondContact O-N 3.44Å
503	K	89.9	Confident	88.1	Confident	149 Å²	149	64.5 Å²	64.5	65%	0.648	35%	0.345	S	S	*	.	S	Bend	trans	-73.2	123.9	176.3	-172	-175.8	175.2	-167.4	0	108.8	W497 P505 E506	W497-K503 VanDerWaalsContact CD1-O 3.24Å; K503-P505 WeakPolarHBondContact O-CD 3.49Å; K503-E506 IonicContact NZ-OE1 3.31Å; K503-E506 PolarHBondContact NZ-OE1 3.21Å
504	I	90.9	Very high	88.3	Confident	35 Å²	35	63.2 Å²	63.2	18%	0.179	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-61	122	175	-55.6	175	0	0	0	108.7	M198 L492 W497 R502	M198-I504 HydrophobicContact CB-CD1 4.44Å; M198-I504 HydrophobicContact CB-CG2 4.03Å; M198-I504 HydrophobicContact CG-CD1 4.41Å; M198-I504 HydrophobicContact CG-CG2 4.43Å; L492-I504 HydrophobicContact CD2-CD1 4.07Å; W497-I504 HydrophobicContact CZ2-CB 4.29Å; W497-I504 HydrophobicContact CZ2-CG1 4.08Å; W497-I504 HydrophobicContact CZ2-CG2 3.86Å; R502-I504 PolarHBondContact O-N 3.44Å
505	P	91.8	Very high	88.3	Confident	23 Å²	23	62.1 Å²	62.1	15%	0.149	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-69.1	140.2	178.2	-10	22.6	0	0	0	110.3	W200 L289 W497 K503	W200-P505 PolarHBondContact NE1-O 3.34Å; L289-P505 HydrophobicContact CD1-CB 3.64Å; L289-P505 HydrophobicContact CD1-CG 3.62Å; L289-P505 HydrophobicContact CD2-CG 4.22Å; W497-P505 HydrophobicContact CB-CG 4.33Å; W497-P505 VanDerWaalsContact CD2-CD 3.49Å; W497-P505 HydrophobicContact CD2-CG 4.14Å; W497-P505 HydrophobicContact CE3-CG 4.4Å; W497-P505 HydrophobicContact CG-CG 4.1Å; K503-P505 WeakPolarHBondContact O-CD 3.49Å
506	E	91.8	Very high	88.2	Confident	96 Å²	96	62 Å²	62	45%	0.449	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-76.5	134.5	-174.4	-66.5	167.5	-160.3	0	0	111	K503	K503-E506 IonicContact NZ-OE1 3.31Å; K503-E506 PolarHBondContact NZ-OE1 3.21Å
507	S	94.4	Very high	88.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.345	C	S	.	.			trans	-123.5	86.7	170.9	-165.2	0	0	0	0	108.6	N201 Y202 R261 G262	N201-S507 PolarHBondContact N-O 3.08Å; N201-S507 VanDerWaalsContact N-O 3.15Å; Y202-S507 PolarHBondContact N-O 2.9Å; Y202-S507 VanDerWaalsContact N-O 3.12Å; Y202-S507 PolarHBondContact O-OG 3.45Å; R261-S507 PolarHBondContact N-OG 3.12Å; G262-S507 PolarHBondContact N-OG 3.25Å
508	V	92.2	Very high	88.4	Confident	21 Å²	21	66.2 Å²	66.2	13%	0.127	36%	0.358	C	S	.	.			trans	-129.6	145.3	-173.9	-60.9	0	0	0	0	111.4	N201 N259 F511	N201-V508 WeakPolarHBondContact OD1-CA 3.34Å; N259-V508 WeakPolarHBondContact CB-O 3.43Å; V508-F511 HydrophobicContact CG2-CD1 4.2Å; V508-F511 HydrophobicContact CG2-CE1 4.12Å
509	C	90.4	Very high	88.9	Confident	16 Å²	16	66.4 Å²	66.4	11%	0.108	35%	0.354	C	S	.	.	S	Bend	trans	-69	-50.4	-178.6	-173.2	0	0	0	0	111.9	Y202 N259 C528	Y202-C509 VanDerWaalsContact CB-N 3.29Å; Y202-C509 HydrophobicContact CD1-CB 3.84Å; Y202-C509 HydrophobicContact CD2-CB 3.67Å; Y202-C509 HydrophobicContact CE1-CB 4.15Å; Y202-C509 HydrophobicContact CE2-CB 4.01Å; Y202-C509 HydrophobicContact CG-CB 3.59Å; N259-C509 PolarHBondContact ND2-O 3.01Å; C509-C528 HydrophobicContact CB-CB 3.99Å; C509-C528 WeakPolarHBondContact CB-SG 3.31Å; C509-C528 WeakPolarHBondContact SG-CB 3.47Å; C509-C528 CovalentContact SG-SG 2.01Å; C509-C528 PolarHBondContact SG-SG 3.06Å
510	S	89.4	Confident	89.5	Confident	20 Å²	20	67.1 Å²	67.1	14%	0.14	33%	0.334	C	S	.	.	S	Bend	trans	-128.2	134.7	-177.4	-61.9	0	0	0	0	109.6	W529	S510-W529 VanDerWaalsContact CB-O 3.23Å; S510-W529 WeakPolarHBondContact CB-O 3.31Å; S510-W529 VanDerWaalsContact O-CZ2 3.31Å; S510-W529 WeakPolarHBondContact O-CZ2 3.35Å; S510-W529 PolarHBondContact OG-N 2.89Å; S510-W529 PolarHBondContact OG-O 3.48Å
511	F	88	Confident	90	Very high	118 Å²	118	69.7 Å²	69.7	52%	0.518	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-69.3	158.6	172.3	-68.4	-75.8	0	0	0	111.1	V508 C513 W529	V508-F511 HydrophobicContact CG2-CD1 4.2Å; V508-F511 HydrophobicContact CG2-CE1 4.12Å; F511-C513 PolarHBondContact O-N 3.38Å; F511-W529 PolarHBondContact O-NE1 3.46Å
512	P	89	Confident	90.2	Very high	100 Å²	100	66.8 Å²	66.8	65%	0.649	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-53.1	138.4	169	-24	34.5	0	0	0	110.8
513	C	90.9	Very high	90.1	Very high	29 Å²	29	67.7 Å²	67.7	20%	0.196	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-74.8	152.3	179.2	-60.9	0	0	0	0	111.6	F511 E517 C531	F511-C513 PolarHBondContact O-N 3.38Å; C513-E517 HydrophobicContact CB-CB 4.02Å; C513-C531 WeakPolarHBondContact CA-SG 3.48Å; C513-C531 HydrophobicContact CB-CB 3.64Å; C513-C531 WeakPolarHBondContact CB-SG 3.15Å; C513-C531 WeakPolarHBondContact SG-CA 3.4Å; C513-C531 WeakPolarHBondContact SG-CB 2.99Å; C513-C531 CovalentContact SG-SG 2.04Å; C513-C531 PolarHBondContact SG-SG 3.05Å
514	E	90.2	Very high	89.6	Confident	132 Å²	132	64.5 Å²	64.5	62%	0.617	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-72.3	158.7	177.8	-69.3	-65.3	151.7	0	0	111.2	G516 E517	E514-G516 PolarHBondContact O-N 3.4Å; E514-E517 HydrophobicContact CB-CG 4.4Å; E514-E517 PolarHBondContact N-OE2 2.81Å; E514-E517 VanDerWaalsContact N-OE2 3.15Å; E514-E517 WeakPolarHBondContact O-CB 3.39Å; E514-E517 PolarHBondContact O-N 3.32Å
515	P	86.9	Confident	89.2	Confident	82 Å²	82	65.2 Å²	65.2	53%	0.532	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.8	126.9	177.6	-24.2	34	0	0	0	112.3	N558 T560	P515-N558 CarbonylContact C-O 3.59Å; P515-T560 HydrophobicContact CB-CG2 4.37Å
516	G	86.8	Confident	88.7	Confident	0 Å²	0	69 Å²	69	0%	0	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.2	-1.6	-177.8	0	0	0	0	0	114.5	E514 C534 N558	E514-G516 PolarHBondContact O-N 3.4Å; G516-C534 PolarHBondContact O-N 2.99Å; G516-N558 WeakPolarHBondContact CA-O 3.33Å; G516-N558 PolarHBondContact N-O 3.21Å
517	E	92.7	Very high	88.4	Confident	55 Å²	55	65 Å²	65	26%	0.257	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	137.9	170.6	-58.1	-178.6	153.6	0	0	110.6	C513 E514 C531 E532 L533	C513-E517 HydrophobicContact CB-CB 4.02Å; E514-E517 HydrophobicContact CB-CG 4.4Å; E514-E517 PolarHBondContact N-OE2 2.81Å; E514-E517 VanDerWaalsContact N-OE2 3.15Å; E514-E517 WeakPolarHBondContact O-CB 3.39Å; E514-E517 PolarHBondContact O-N 3.32Å; E517-C531 HydrophobicContact CB-CB 4.13Å; E517-C531 WeakPolarHBondContact OE2-CB 3.02Å; E517-E532 CarbonylContact C-O 3.52Å; E517-E532 WeakPolarHBondContact CA-O 3.49Å; E517-L533 HydrophobicContact CG-CB 4.38Å; E517-L533 HydrophobicContact CG-CD1 3.91Å
518	R	91.9	Very high	88.2	Confident	76 Å²	76	65.4 Å²	65.4	29%	0.287	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	150.1	172.4	63.9	162.5	-170.8	157.7	-2	111.3	C531 E532 L540 E543 F544 C546	R518-C531 WeakPolarHBondContact O-CA 3.37Å; R518-E532 HydrophobicContact CG-CB 4.24Å; R518-E532 WeakPolarHBondContact CG-O 3.3Å; R518-E532 IonicContact CZ-OE2 3.59Å; R518-E532 VanDerWaalsContact CZ-OE2 3.3Å; R518-E532 PolarHBondContact N-O 3.11Å; R518-E532 IonicContact NE-OE2 3.58Å; R518-E532 PolarHBondContact NE-OE2 3.31Å; R518-E532 VanDerWaalsContact NE-OE2 3.16Å; R518-E532 IonicContact NH2-OE2 2.76Å; R518-E532 PolarHBondContact NH2-OE2 3.44Å; R518-E532 PolarHBondContact O-N 3.25Å; R518-L540 HydrophobicContact CB-CD1 3.77Å; R518-E543 CarbonylContact C-O 3.47Å; R518-F544 WeakPolarHBondContact CD-O 3.39Å; R518-C546 VanDerWaalsContact CD-SG 3.53Å
519	K	92.4	Very high	88.2	Confident	38 Å²	38	66.3 Å²	66.3	17%	0.165	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	121.4	171.2	-63.9	176.6	-174.7	168.6	0	109.9	W529 E543 F544	K519-W529 HydrophobicContact CB-CB 4.17Å; K519-W529 HydrophobicContact CB-CG 4.12Å; K519-W529 HydrophobicContact CD-CD2 4.33Å; K519-W529 HydrophobicContact CD-CG 4.41Å; K519-W529 HydrophobicContact CG-CG 4.1Å; K519-E543 WeakPolarHBondContact CB-O 3.4Å; K519-E543 HydrophobicContact CD-CB 4.33Å; K519-E543 PolarHBondContact N-O 3.27Å; K519-E543 IonicContact NZ-OE1 3.78Å; K519-E543 PolarHBondContact NZ-OE1 3.03Å; K519-E543 IonicContact NZ-OE2 2.96Å; K519-E543 PolarHBondContact NZ-OE2 3.45Å; K519-F544 HydrophobicContact CB-CD1 3.85Å; K519-F544 HydrophobicContact CB-CE1 3.83Å; K519-F544 HydrophobicContact CD-CE1 4.24Å; K519-F544 HydrophobicContact CD-CZ 4.35Å; K519-F544 WeakPolarHBondContact O-CD1 3.26Å
520	K	91.2	Very high	88.2	Confident	94 Å²	94	71.3 Å²	71.3	41%	0.409	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	105.3	172.9	-172.3	-178.5	-163.4	161.9	0	109.6	V522 W529 H530 E532	K520-V522 PolarHBondContact O-N 3.48Å; K520-W529 CarbonylContact O-C 3.52Å; K520-W529 VanDerWaalsContact O-CA 3.27Å; K520-W529 WeakPolarHBondContact O-CA 3.12Å; K520-H530 WeakPolarHBondContact CB-O 3.35Å; K520-H530 PolarHBondContact N-O 3.45Å; K520-H530 PolarHBondContact O-N 3.09Å; K520-E532 IonicContact NZ-OE1 2.72Å; K520-E532 PolarHBondContact NZ-OE1 2.04Å; K520-E532 IonicContact NZ-OE2 3.94Å; K520-E532 PolarHBondContact NZ-OE2 2.61Å
521	M	88.9	Confident	88.4	Confident	85 Å²	85	72.8 Å²	72.8	42%	0.419	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.2	136.2	-176.3	-56.2	-58.9	-78.7	0	0	112	P526 W529 F544	M521-P526 WeakPolarHBondContact CE-O 3.49Å; M521-W529 HydrophobicContact SD-CB 4.05Å; M521-W529 HydrophobicContact SD-CE3 4.48Å; M521-F544 HydrophobicContact CG-CE1 4.34Å; M521-F544 HydrophobicContact SD-CE1 3.85Å
522	V	88.3	Confident	88.5	Confident	46 Å²	46	70.5 Å²	70.5	28%	0.279	38%	0.383	S	S	.	.	P	Polyproline II helix	trans	-74.9	129.9	173.7	-178.9	0	0	0	0	108.9	K520 G524 V525 C528	K520-V522 PolarHBondContact O-N 3.48Å; V522-G524 PolarHBondContact O-N 2.84Å; V522-V525 PolarHBondContact O-N 3.42Å; V522-C528 HydrophobicContact CB-CB 3.96Å; V522-C528 HydrophobicContact CG2-CB 3.8Å; V522-C528 PolarHBondContact N-O 2.95Å
523	K	83.1	Confident	88.6	Confident	206 Å²	206	69.6 Å²	69.6	90%	0.896	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.8	126	179.7	-67.9	-174.8	178.9	-178	0	110.2
524	G	79.4	Confident	88.5	Confident	82 Å²	82	68.3 Å²	68.3	85%	0.845	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.7	-8.7	176.9	0	0	0	0	0	115.5	V522	V522-G524 PolarHBondContact O-N 2.84Å
525	V	83.1	Confident	88.2	Confident	50 Å²	50	67.4 Å²	67.4	30%	0.303	36%	0.363	S	S	.	.			trans	-133.4	97.9	178.9	-167.3	0	0	0	0	110.5	V522 C527 C528	V522-V525 PolarHBondContact O-N 3.42Å; V525-C527 VanDerWaalsContact C-N 3.3Å; V525-C527 PolarHBondContact O-N 2.87Å; V525-C528 HydrophobicContact CB-CB 4.26Å; V525-C528 HydrophobicContact CG1-CB 4.15Å; V525-C528 WeakPolarHBondContact CG1-SG 3.4Å; V525-C528 PolarHBondContact O-N 3.33Å
526	P	81.3	Confident	88.2	Confident	102 Å²	102	64.3 Å²	64.3	66%	0.662	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-12	-165.7	27.8	-35.5	0	0	0	115.7	M521	M521-P526 WeakPolarHBondContact CE-O 3.49Å
527	C	86.8	Confident	88.3	Confident	14 Å²	14	66 Å²	66	10%	0.095	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-6.8	175.5	53	0	0	0	0	113.5	C231 V525 W529	C231-C527 HydrophobicContact CB-CB 3.83Å; C231-C527 WeakPolarHBondContact CB-SG 3.42Å; C231-C527 WeakPolarHBondContact SG-CB 2.88Å; C231-C527 PolarHBondContact SG-N 2.74Å; C231-C527 VanDerWaalsContact SG-N 3.36Å; C231-C527 CovalentContact SG-SG 2.01Å; C231-C527 PolarHBondContact SG-SG 3.19Å; V525-C527 VanDerWaalsContact C-N 3.3Å; V525-C527 PolarHBondContact O-N 2.87Å; C527-W529 VanDerWaalsContact O-CE3 3.28Å; C527-W529 WeakPolarHBondContact O-CZ3 3.36Å
528	C	90	Very high	88.2	Confident	7 Å²	7	66.2 Å²	66.2	5%	0.047	35%	0.354	C	S	.	.			trans	-105.6	132.6	-174.7	-60.5	0	0	0	0	109.5	C509 V522 V525	C509-C528 HydrophobicContact CB-CB 3.99Å; C509-C528 WeakPolarHBondContact CB-SG 3.31Å; C509-C528 WeakPolarHBondContact SG-CB 3.47Å; C509-C528 CovalentContact SG-SG 2.01Å; C509-C528 PolarHBondContact SG-SG 3.06Å; V522-C528 HydrophobicContact CB-CB 3.96Å; V522-C528 HydrophobicContact CG2-CB 3.8Å; V522-C528 PolarHBondContact N-O 2.95Å; V525-C528 HydrophobicContact CB-CB 4.26Å; V525-C528 HydrophobicContact CG1-CB 4.15Å; V525-C528 WeakPolarHBondContact CG1-SG 3.4Å; V525-C528 PolarHBondContact O-N 3.33Å
529	W	91.3	Very high	88.1	Confident	41 Å²	41	64.2 Å²	64.2	16%	0.155	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	153.6	173.3	55.4	82.3	0	0	0	111.1	S510 F511 K519 K520 M521 C527	S510-W529 VanDerWaalsContact CB-O 3.23Å; S510-W529 WeakPolarHBondContact CB-O 3.31Å; S510-W529 VanDerWaalsContact O-CZ2 3.31Å; S510-W529 WeakPolarHBondContact O-CZ2 3.35Å; S510-W529 PolarHBondContact OG-N 2.89Å; S510-W529 PolarHBondContact OG-O 3.48Å; F511-W529 PolarHBondContact O-NE1 3.46Å; K519-W529 HydrophobicContact CB-CB 4.17Å; K519-W529 HydrophobicContact CB-CG 4.12Å; K519-W529 HydrophobicContact CD-CD2 4.33Å; K519-W529 HydrophobicContact CD-CG 4.41Å; K519-W529 HydrophobicContact CG-CG 4.1Å; K520-W529 CarbonylContact O-C 3.52Å; K520-W529 VanDerWaalsContact O-CA 3.27Å; K520-W529 WeakPolarHBondContact O-CA 3.12Å; M521-W529 HydrophobicContact SD-CB 4.05Å; M521-W529 HydrophobicContact SD-CE3 4.48Å; C527-W529 VanDerWaalsContact O-CE3 3.28Å; C527-W529 WeakPolarHBondContact O-CZ3 3.36Å
530	H	91.3	Very high	88.2	Confident	121 Å²	121	64 Å²	64	56%	0.56	35%	0.348	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	140.3	165.1	-63.5	-55.9	0	0	0	109.3	K520	K520-H530 WeakPolarHBondContact CB-O 3.35Å; K520-H530 PolarHBondContact N-O 3.45Å; K520-H530 PolarHBondContact O-N 3.09Å
531	C	92.6	Very high	88	Confident	51 Å²	51	63.9 Å²	63.9	35%	0.345	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	123.8	173	-54.9	0	0	0	0	108.7	C513 E517 R518	C513-C531 WeakPolarHBondContact CA-SG 3.48Å; C513-C531 HydrophobicContact CB-CB 3.64Å; C513-C531 WeakPolarHBondContact CB-SG 3.15Å; C513-C531 WeakPolarHBondContact SG-CA 3.4Å; C513-C531 WeakPolarHBondContact SG-CB 2.99Å; C513-C531 CovalentContact SG-SG 2.04Å; C513-C531 PolarHBondContact SG-SG 3.05Å; E517-C531 HydrophobicContact CB-CB 4.13Å; E517-C531 WeakPolarHBondContact OE2-CB 3.02Å; R518-C531 WeakPolarHBondContact O-CA 3.37Å
532	E	91.3	Very high	87.9	Confident	69 Å²	69	64.5 Å²	64.5	32%	0.322	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	120.5	-179.1	-173	173.9	-136	0	0	108.5	E517 R518 K520 C534	E517-E532 CarbonylContact C-O 3.52Å; E517-E532 WeakPolarHBondContact CA-O 3.49Å; R518-E532 HydrophobicContact CG-CB 4.24Å; R518-E532 WeakPolarHBondContact CG-O 3.3Å; R518-E532 IonicContact CZ-OE2 3.59Å; R518-E532 VanDerWaalsContact CZ-OE2 3.3Å; R518-E532 PolarHBondContact N-O 3.11Å; R518-E532 IonicContact NE-OE2 3.58Å; R518-E532 PolarHBondContact NE-OE2 3.31Å; R518-E532 VanDerWaalsContact NE-OE2 3.16Å; R518-E532 IonicContact NH2-OE2 2.76Å; R518-E532 PolarHBondContact NH2-OE2 3.44Å; R518-E532 PolarHBondContact O-N 3.25Å; K520-E532 IonicContact NZ-OE1 2.72Å; K520-E532 PolarHBondContact NZ-OE1 2.04Å; K520-E532 IonicContact NZ-OE2 3.94Å; K520-E532 PolarHBondContact NZ-OE2 2.61Å; E532-C534 PolarHBondContact O-N 3.35Å
533	L	90.1	Very high	87.9	Confident	82 Å²	82	67.6 Å²	67.6	43%	0.429	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.7	130.9	179.8	-170.8	71.9	0	0	0	110.8	E517 D535	E517-L533 HydrophobicContact CG-CB 4.38Å; E517-L533 HydrophobicContact CG-CD1 3.91Å; L533-D535 PolarHBondContact O-N 2.81Å; L533-D535 VanDerWaalsContact O-N 3.11Å
534	C	89.4	Confident	88.2	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.007	35%	0.346	C	S	.	.			trans	-66	108.5	172.8	-65	0	0	0	0	109.6	G516 E532 Q538 C546 R559	G516-C534 PolarHBondContact O-N 2.99Å; E532-C534 PolarHBondContact O-N 3.35Å; C534-Q538 HydrophobicContact CB-CB 4.1Å; C534-C546 WeakPolarHBondContact CA-SG 3.27Å; C534-C546 HydrophobicContact CB-CB 3.69Å; C534-C546 WeakPolarHBondContact CB-SG 3.3Å; C534-C546 WeakPolarHBondContact SG-CB 3.48Å; C534-C546 CovalentContact SG-SG 2.03Å; C534-C546 PolarHBondContact SG-SG 2.83Å; C534-R559 WeakPolarHBondContact O-CD 3.42Å; C534-R559 PolarHBondContact O-NH1 3.03Å
535	D	84.5	Confident	88.8	Confident	113 Å²	113	61.7 Å²	61.7	60%	0.604	32%	0.324	S	S	*	.			trans	-93.6	156.7	-168.5	-156.6	25.4	0	0	0	116.1	L533 Y537 Q538 R559	L533-D535 PolarHBondContact O-N 2.81Å; L533-D535 VanDerWaalsContact O-N 3.11Å; D535-Y537 PolarHBondContact O-N 2.75Å; D535-Q538 VanDerWaalsContact O-CB 3.3Å; D535-Q538 WeakPolarHBondContact O-CB 3.47Å; D535-Q538 WeakPolarHBondContact O-CG 3.37Å; D535-Q538 PolarHBondContact O-N 2.87Å; D535-R559 IonicContact OD1-NH1 3.96Å; D535-R559 PolarHBondContact OD1-NH1 2.77Å; D535-R559 VanDerWaalsContact OD1-NH1 3.13Å
536	G	86.2	Confident	89.2	Confident	18 Å²	18	60.7 Å²	60.7	19%	0.186	32%	0.319	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.3	-123.7	177.7	0	0	0	0	0	112.8	Q538 P555 P726	G536-Q538 VanDerWaalsContact C-N 3.25Å; G536-Q538 PolarHBondContact O-N 2.78Å; G536-P555 WeakPolarHBondContact O-CG 3.27Å; G536-P726 WeakPolarHBondContact O-CG 3.48Å
537	Y	87.8	Confident	89.8	Confident	36 Å²	36	59.8 Å²	59.8	14%	0.141	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	18.2	179.4	-69.1	-97.1	0	0	0	112.5	D535 C549 R554 K722 P723 P726 A729	D535-Y537 PolarHBondContact O-N 2.75Å; Y537-C549 WeakPolarHBondContact O-CB 3.03Å; Y537-C549 PolarHBondContact O-N 2.93Å; Y537-R554 HydrophobicContact CE1-CB 4.42Å; Y537-K722 HydrophobicContact CE1-CD 4.44Å; Y537-K722 HydrophobicContact CE1-CG 4.1Å; Y537-K722 HydrophobicContact CE2-CG 4.02Å; Y537-K722 WeakPolarHBondContact OH-CG 3.44Å; Y537-P723 WeakPolarHBondContact CE2-O 3.46Å; Y537-P723 PolarHBondContact OH-O 2.04Å; Y537-P726 HydrophobicContact CD1-CB 4.12Å; Y537-P726 HydrophobicContact CE1-CB 3.85Å; Y537-A729 HydrophobicContact CE1-CB 4.11Å
538	Q	90.6	Very high	89.9	Confident	59 Å²	59	65.3 Å²	65.3	28%	0.276	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	151.8	178.8	-63.2	177.5	-17.1	0	0	112.1	C534 D535 G536 C546 D547 M548	C534-Q538 HydrophobicContact CB-CB 4.1Å; D535-Q538 VanDerWaalsContact O-CB 3.3Å; D535-Q538 WeakPolarHBondContact O-CB 3.47Å; D535-Q538 WeakPolarHBondContact O-CG 3.37Å; D535-Q538 PolarHBondContact O-N 2.87Å; G536-Q538 VanDerWaalsContact C-N 3.25Å; G536-Q538 PolarHBondContact O-N 2.78Å; Q538-C546 HydrophobicContact CB-CB 4.17Å; Q538-D547 CarbonylContact C-O 3.53Å; Q538-D547 WeakPolarHBondContact CA-O 3.38Å; Q538-D547 WeakPolarHBondContact CB-O 3.26Å; Q538-M548 HydrophobicContact CG-CG 4.04Å
539	F	91.6	Very high	89.9	Confident	33 Å²	33	65.6 Å²	65.6	15%	0.145	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	158.3	170.5	76.2	-78.2	0	0	0	109.7	L541 C546 D547 R559 C562	F539-L541 HydrophobicContact CE2-CB 4.4Å; F539-L541 HydrophobicContact CE2-CD1 4.1Å; F539-L541 HydrophobicContact CZ-CD1 4.1Å; F539-L541 PolarHBondContact O-N 3.16Å; F539-C546 CarbonylContact O-C 3.57Å; F539-C546 VanDerWaalsContact O-CA 3.3Å; F539-C546 WeakPolarHBondContact O-CA 3.09Å; F539-D547 VanDerWaalsContact CD1-O 3.27Å; F539-D547 WeakPolarHBondContact CD1-O 3.45Å; F539-D547 HydrophobicContact CE1-CB 4.03Å; F539-D547 HydrophobicContact CZ-CB 4.32Å; F539-D547 PolarHBondContact N-O 2.9Å; F539-D547 PolarHBondContact O-N 2.83Å; F539-R559 CarbonylContact C-O 3.46Å; F539-R559 VanDerWaalsContact CA-O 3.26Å; F539-R559 WeakPolarHBondContact CA-O 3.49Å; F539-R559 WeakPolarHBondContact CB-O 3.46Å; F539-C562 WeakPolarHBondContact CD1-SG 3.12Å
540	L	92.8	Very high	89.9	Confident	34 Å²	34	66.9 Å²	66.9	18%	0.178	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	112.2	177.3	-172.9	69.1	0	0	0	109.2	R518 D542 R559	R518-L540 HydrophobicContact CB-CD1 3.77Å; L540-D542 WeakPolarHBondContact CD1-O 3.03Å; L540-R559 PolarHBondContact N-O 2.03Å
541	L	88.4	Confident	89.5	Confident	91 Å²	91	66 Å²	66	48%	0.476	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	-57.6	177.1	-178.9	70	0	0	0	110	F539 T545 D547	F539-L541 HydrophobicContact CE2-CB 4.4Å; F539-L541 HydrophobicContact CE2-CD1 4.1Å; F539-L541 HydrophobicContact CZ-CD1 4.1Å; F539-L541 PolarHBondContact O-N 3.16Å; L541-T545 PolarHBondContact N-O 2.82Å; L541-D547 HydrophobicContact CB-CB 4.14Å; L541-D547 HydrophobicContact CD2-CB 4.3Å
542	D	87.1	Confident	89.1	Confident	99 Å²	99	67 Å²	67	53%	0.529	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	168.7	172.4	-55.9	-53.5	0	0	0	109.5	L540 F544 T545	L540-D542 WeakPolarHBondContact CD1-O 3.03Å; D542-F544 PolarHBondContact O-N 2.8Å; D542-T545 WeakPolarHBondContact CB-OG1 3.42Å; D542-T545 PolarHBondContact N-O 3.5Å; D542-T545 PolarHBondContact O-N 3.27Å; D542-T545 VanDerWaalsContact O-N 3.09Å; D542-T545 PolarHBondContact OD2-OG1 3.36Å
543	E	87	Confident	88.9	Confident	111 Å²	111	66.5 Å²	66.5	52%	0.519	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.8	-17	-178.8	-65.2	-165.8	148.5	0	0	114.6	R518 K519	R518-E543 CarbonylContact C-O 3.47Å; K519-E543 WeakPolarHBondContact CB-O 3.4Å; K519-E543 HydrophobicContact CD-CB 4.33Å; K519-E543 PolarHBondContact N-O 3.27Å; K519-E543 IonicContact NZ-OE1 3.78Å; K519-E543 PolarHBondContact NZ-OE1 3.03Å; K519-E543 IonicContact NZ-OE2 2.96Å; K519-E543 PolarHBondContact NZ-OE2 3.45Å
544	F	89.6	Confident	88.8	Confident	102 Å²	102	63.9 Å²	63.9	45%	0.447	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.7	-10.5	-177.2	-58.9	-81.7	0	0	0	114.1	R518 K519 M521 D542	R518-F544 WeakPolarHBondContact CD-O 3.39Å; K519-F544 HydrophobicContact CB-CD1 3.85Å; K519-F544 HydrophobicContact CB-CE1 3.83Å; K519-F544 HydrophobicContact CD-CE1 4.24Å; K519-F544 HydrophobicContact CD-CZ 4.35Å; K519-F544 WeakPolarHBondContact O-CD1 3.26Å; M521-F544 HydrophobicContact CG-CE1 4.34Å; M521-F544 HydrophobicContact SD-CE1 3.85Å; D542-F544 PolarHBondContact O-N 2.8Å
545	T	91.4	Very high	88.9	Confident	61 Å²	61	64 Å²	64	37%	0.374	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	128.5	-166.8	45.9	0	0	0	0	111.8	L541 D542	L541-T545 PolarHBondContact N-O 2.82Å; D542-T545 WeakPolarHBondContact CB-OG1 3.42Å; D542-T545 PolarHBondContact N-O 3.5Å; D542-T545 PolarHBondContact O-N 3.27Å; D542-T545 VanDerWaalsContact O-N 3.09Å; D542-T545 PolarHBondContact OD2-OG1 3.36Å
546	C	92.9	Very high	89.1	Confident	29 Å²	29	61.8 Å²	61.8	20%	0.196	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	134.7	168.3	-56.9	0	0	0	0	108.6	R518 C534 Q538 F539	R518-C546 VanDerWaalsContact CD-SG 3.53Å; C534-C546 WeakPolarHBondContact CA-SG 3.27Å; C534-C546 HydrophobicContact CB-CB 3.69Å; C534-C546 WeakPolarHBondContact CB-SG 3.3Å; C534-C546 WeakPolarHBondContact SG-CB 3.48Å; C534-C546 CovalentContact SG-SG 2.03Å; C534-C546 PolarHBondContact SG-SG 2.83Å; Q538-C546 HydrophobicContact CB-CB 4.17Å; F539-C546 CarbonylContact O-C 3.57Å; F539-C546 VanDerWaalsContact O-CA 3.3Å; F539-C546 WeakPolarHBondContact O-CA 3.09Å
547	D	92.6	Very high	89	Confident	83 Å²	83	68.7 Å²	68.7	44%	0.444	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	158.1	176.8	-164.1	15.1	0	0	0	111.2	Q538 F539 L541	Q538-D547 CarbonylContact C-O 3.53Å; Q538-D547 WeakPolarHBondContact CA-O 3.38Å; Q538-D547 WeakPolarHBondContact CB-O 3.26Å; F539-D547 VanDerWaalsContact CD1-O 3.27Å; F539-D547 WeakPolarHBondContact CD1-O 3.45Å; F539-D547 HydrophobicContact CE1-CB 4.03Å; F539-D547 HydrophobicContact CZ-CB 4.32Å; F539-D547 PolarHBondContact N-O 2.9Å; F539-D547 PolarHBondContact O-N 2.83Å; L541-D547 HydrophobicContact CB-CB 4.14Å; L541-D547 HydrophobicContact CD2-CB 4.3Å
548	M	90.6	Very high	89	Confident	131 Å²	131	71.9 Å²	71.9	65%	0.645	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.8	135.5	-178.9	-69.3	-165.1	177.8	0	0	111.8	Q538	Q538-M548 HydrophobicContact CG-CG 4.04Å
549	C	89.4	Confident	88.8	Confident	13 Å²	13	71.5 Å²	71.5	9%	0.088	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-62.8	148.3	170.5	-75.7	0	0	0	0	111.6	Y537 C562	Y537-C549 WeakPolarHBondContact O-CB 3.03Å; Y537-C549 PolarHBondContact O-N 2.93Å; C549-C562 WeakPolarHBondContact CA-SG 3.34Å; C549-C562 HydrophobicContact CB-CB 3.94Å; C549-C562 WeakPolarHBondContact CB-SG 3.3Å; C549-C562 WeakPolarHBondContact SG-CB 3.45Å; C549-C562 CovalentContact SG-SG 2.04Å; C549-C562 PolarHBondContact SG-SG 3.29Å
550	P	90	Very high	88.7	Confident	67 Å²	67	73.5 Å²	73.5	44%	0.435	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-52.5	154.4	169.8	-26.3	35	0	0	0	112.5	D552 M553	P550-D552 VanDerWaalsContact C-N 3.28Å; P550-D552 WeakPolarHBondContact CB-OD1 3.06Å; P550-D552 PolarHBondContact O-N 2.83Å; P550-M553 HydrophobicContact CB-CB 4.45Å; P550-M553 HydrophobicContact CB-CG 4.39Å; P550-M553 CarbonylContact O-C 3.48Å; P550-M553 PolarHBondContact O-N 3.07Å; P550-M553 VanDerWaalsContact O-O 3.06Å
551	F	83.5	Confident	88.6	Confident	104 Å²	104	72.6 Å²	72.6	46%	0.456	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-31.9	-169.3	-178.1	-98.2	0	0	0	114.5	M553 Y718 D719	F551-M553 VanDerWaalsContact C-N 3.3Å; F551-Y718 HydrophobicContact CD1-CD2 4.46Å; F551-Y718 HydrophobicContact CE1-CD2 4.18Å; F551-Y718 HydrophobicContact CE1-CG 4.34Å; F551-D719 WeakPolarHBondContact CE2-OD1 3.37Å; F551-D719 WeakPolarHBondContact CZ-OD1 3.32Å
552	D	83.9	Confident	88.8	Confident	71 Å²	71	70 Å²	70	38%	0.38	36%	0.361	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-5.3	176.9	63	-39.7	0	0	0	113.5	P550 T565 Y718	P550-D552 VanDerWaalsContact C-N 3.28Å; P550-D552 WeakPolarHBondContact CB-OD1 3.06Å; P550-D552 PolarHBondContact O-N 2.83Å; D552-T565 WeakPolarHBondContact O-CB 3.37Å; D552-T565 PolarHBondContact O-N 2.67Å; D552-T565 VanDerWaalsContact O-N 3.08Å; D552-T565 PolarHBondContact O-OG1 3.08Å; D552-T565 VanDerWaalsContact O-OG1 3.07Å; D552-Y718 HydrophobicContact CB-CE2 4.3Å
553	M	87.9	Confident	89	Confident	59 Å²	59	68.5 Å²	68.5	29%	0.291	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	161.2	-174.9	-59.1	-157.8	-178.6	0	0	112.9	P550 F551 C562 R563	P550-M553 HydrophobicContact CB-CB 4.45Å; P550-M553 HydrophobicContact CB-CG 4.39Å; P550-M553 CarbonylContact O-C 3.48Å; P550-M553 PolarHBondContact O-N 3.07Å; P550-M553 VanDerWaalsContact O-O 3.06Å; F551-M553 VanDerWaalsContact C-N 3.3Å; M553-C562 HydrophobicContact CB-CB 3.98Å; M553-C562 HydrophobicContact SD-CB 4.07Å; M553-R563 CarbonylContact C-O 3.53Å; M553-R563 WeakPolarHBondContact CA-O 3.49Å; M553-R563 WeakPolarHBondContact CB-O 3.36Å
554	R	87.9	Confident	89.1	Confident	27 Å²	27	67.9 Å²	67.9	10%	0.102	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	153.2	176.6	60.5	177.5	-176.3	161.2	1.6	110.1	Y537 C562 R563 P726 E727	Y537-R554 HydrophobicContact CE1-CB 4.42Å; R554-C562 CarbonylContact O-C 3.59Å; R554-C562 WeakPolarHBondContact O-CA 3.39Å; R554-R563 HydrophobicContact CG-CG 3.93Å; R554-R563 WeakPolarHBondContact CG-O 3.37Å; R554-R563 PolarHBondContact N-O 2.68Å; R554-R563 WeakPolarHBondContact O-CG 3.26Å; R554-R563 PolarHBondContact O-N 3.41Å; R554-R563 VanDerWaalsContact O-O 3.06Å; R554-P726 HydrophobicContact CB-CB 4.32Å; R554-P726 VanDerWaalsContact CD-O 3.26Å; R554-P726 WeakPolarHBondContact CD-O 3.36Å; R554-P726 PolarHBondContact NH1-O 3.45Å; R554-E727 VanDerWaalsContact NH1-C 3.29Å; R554-E727 PolarHBondContact NH1-O 3.08Å
555	P	91.4	Very high	89	Confident	2 Å²	2	63.6 Å²	63.6	1%	0.013	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	154.2	-178.8	22.7	-33	0	0	0	113.1	G536 G561 R563 P726	G536-P555 WeakPolarHBondContact O-CG 3.27Å; P555-G561 CarbonylContact C-O 3.53Å; P555-G561 WeakPolarHBondContact CA-O 3.11Å; P555-R563 PolarHBondContact O-NE 3.11Å; P555-P726 HydrophobicContact CG-CB 3.93Å; P555-P726 HydrophobicContact CG-CG 3.9Å
556	L	88.8	Confident	88.7	Confident	67 Å²	67	63.2 Å²	63.2	35%	0.351	34%	0.335	S	S	.	.			trans	-65.5	162.1	165.8	-88.1	82.6	0	0	0	110.4	N558 R559 G561 C562 R563	L556-N558 PolarHBondContact O-N 2.93Å; L556-R559 WeakPolarHBondContact O-CA 3.44Å; L556-R559 PolarHBondContact O-N 2.86Å; L556-G561 VanDerWaalsContact CD1-O 3.26Å; L556-G561 WeakPolarHBondContact CD1-O 3.43Å; L556-G561 PolarHBondContact N-O 3.49Å; L556-C562 VanDerWaalsContact CD1-C 3.47Å; L556-C562 WeakPolarHBondContact CD1-O 3.48Å; L556-R563 HydrophobicContact CD1-CB 4.1Å; L556-R563 HydrophobicContact CD1-CG 4.49Å
557	K	84.8	Confident	88.3	Confident	164 Å²	164	65.9 Å²	65.9	71%	0.713	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-39.2	174.2	-71.4	-173.3	176.2	-176.3	0	112.7	R559	K557-R559 VanDerWaalsContact C-N 3.26Å; K557-R559 PolarHBondContact O-N 2.69Å
558	N	87.5	Confident	87.8	Confident	103 Å²	103	63.9 Å²	63.9	55%	0.551	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	2.5	177.7	-60.2	9.9	0	0	0	112.6	P515 G516 L556 T560	P515-N558 CarbonylContact C-O 3.59Å; G516-N558 WeakPolarHBondContact CA-O 3.33Å; G516-N558 PolarHBondContact N-O 3.21Å; L556-N558 PolarHBondContact O-N 2.93Å; N558-T560 HydrophobicContact CB-CG2 4.43Å; N558-T560 PolarHBondContact O-N 2.91Å
559	R	86.4	Confident	87.4	Confident	50 Å²	50	61.7 Å²	61.7	19%	0.189	32%	0.322	C	S	.	.	S	Bend	trans	50.1	26.5	178.2	-49.5	-169.6	-176.7	-164.7	-3.2	115.1	C534 D535 F539 L540 L556 K557 G561	C534-R559 WeakPolarHBondContact O-CD 3.42Å; C534-R559 PolarHBondContact O-NH1 3.03Å; D535-R559 IonicContact OD1-NH1 3.96Å; D535-R559 PolarHBondContact OD1-NH1 2.77Å; D535-R559 VanDerWaalsContact OD1-NH1 3.13Å; F539-R559 CarbonylContact C-O 3.46Å; F539-R559 VanDerWaalsContact CA-O 3.26Å; F539-R559 WeakPolarHBondContact CA-O 3.49Å; F539-R559 WeakPolarHBondContact CB-O 3.46Å; L540-R559 PolarHBondContact N-O 2.03Å; L556-R559 WeakPolarHBondContact O-CA 3.44Å; L556-R559 PolarHBondContact O-N 2.86Å; K557-R559 VanDerWaalsContact C-N 3.26Å; K557-R559 PolarHBondContact O-N 2.69Å; R559-G561 VanDerWaalsContact C-N 3.35Å
560	T	89.5	Confident	86.8	Confident	75 Å²	75	61.9 Å²	61.9	46%	0.46	32%	0.322	S	S	.	.	S	Bend	trans	-88.6	-2.5	175.5	51.4	0	0	0	0	113.4	P515 N558	P515-T560 HydrophobicContact CB-CG2 4.37Å; N558-T560 HydrophobicContact CB-CG2 4.43Å; N558-T560 PolarHBondContact O-N 2.91Å
561	G	89.8	Confident	86.4	Confident	16 Å²	16	64.1 Å²	64.1	17%	0.165	33%	0.327	C	S	.	.	S	Bend	trans	-177.9	-171.3	-179.2	0	0	0	0	0	111.7	P555 L556 R559	P555-G561 CarbonylContact C-O 3.53Å; P555-G561 WeakPolarHBondContact CA-O 3.11Å; L556-G561 VanDerWaalsContact CD1-O 3.26Å; L556-G561 WeakPolarHBondContact CD1-O 3.43Å; L556-G561 PolarHBondContact N-O 3.49Å; R559-G561 VanDerWaalsContact C-N 3.35Å
562	C	92.1	Very high	86.4	Confident	36 Å²	36	65.4 Å²	65.4	24%	0.243	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	150.2	-177	-53.4	0	0	0	0	112.1	F539 C549 M553 R554 L556	F539-C562 WeakPolarHBondContact CD1-SG 3.12Å; C549-C562 WeakPolarHBondContact CA-SG 3.34Å; C549-C562 HydrophobicContact CB-CB 3.94Å; C549-C562 WeakPolarHBondContact CB-SG 3.3Å; C549-C562 WeakPolarHBondContact SG-CB 3.45Å; C549-C562 CovalentContact SG-SG 2.04Å; C549-C562 PolarHBondContact SG-SG 3.29Å; M553-C562 HydrophobicContact CB-CB 3.98Å; M553-C562 HydrophobicContact SD-CB 4.07Å; R554-C562 CarbonylContact O-C 3.59Å; R554-C562 WeakPolarHBondContact O-CA 3.39Å; L556-C562 VanDerWaalsContact CD1-C 3.47Å; L556-C562 WeakPolarHBondContact CD1-O 3.48Å
563	R	91.8	Very high	86.3	Confident	67 Å²	67	66 Å²	66	25%	0.253	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	151.4	176.7	62.6	176.4	177.5	156.3	3.5	110.2	M553 R554 P555 L556 E727	M553-R563 CarbonylContact C-O 3.53Å; M553-R563 WeakPolarHBondContact CA-O 3.49Å; M553-R563 WeakPolarHBondContact CB-O 3.36Å; R554-R563 HydrophobicContact CG-CG 3.93Å; R554-R563 WeakPolarHBondContact CG-O 3.37Å; R554-R563 PolarHBondContact N-O 2.68Å; R554-R563 WeakPolarHBondContact O-CG 3.26Å; R554-R563 PolarHBondContact O-N 3.41Å; R554-R563 VanDerWaalsContact O-O 3.06Å; P555-R563 PolarHBondContact O-NE 3.11Å; L556-R563 HydrophobicContact CD1-CB 4.1Å; L556-R563 HydrophobicContact CD1-CG 4.49Å; R563-E727 IonicContact CZ-OE1 2.65Å; R563-E727 IonicContact NH2-OE1 2.81Å; R563-E727 PolarHBondContact NH2-OE1 2.68Å; R563-E727 IonicContact NH2-OE2 3.06Å; R563-E727 PolarHBondContact NH2-OE2 3.38Å
564	P	89.3	Confident	86.2	Confident	98 Å²	98	64.2 Å²	64.2	64%	0.636	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63	143.4	-178	24.4	-33.9	0	0	0	112.4
565	T	86.9	Confident	86	Confident	12 Å²	12	67.5 Å²	67.5	7%	0.074	36%	0.356	C	S	.	.	P	Polyproline II helix	trans	-75.1	130.4	176	-57.7	0	0	0	0	110	D552 Y718 A729	D552-T565 WeakPolarHBondContact O-CB 3.37Å; D552-T565 PolarHBondContact O-N 2.67Å; D552-T565 VanDerWaalsContact O-N 3.08Å; D552-T565 PolarHBondContact O-OG1 3.08Å; D552-T565 VanDerWaalsContact O-OG1 3.07Å; T565-Y718 HydrophobicContact CG2-CD1 4.25Å; T565-Y718 HydrophobicContact CG2-CE1 4.4Å; T565-A729 HydrophobicContact CG2-CB 3.92Å; T565-A729 WeakPolarHBondContact CG2-O 3.49Å
566	P	85.7	Confident	85.7	Confident	54 Å²	54	72.2 Å²	72.2	35%	0.351	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-65.6	137.8	-178.8	27.3	-35	0	0	0	111.3	A729 R730 G731	P566-A729 WeakPolarHBondContact CD-O 3.49Å; P566-R730 HydrophobicContact CG-CG 4.49Å; P566-R730 WeakPolarHBondContact O-CA 3.44Å; P566-G731 PolarHBondContact O-N 3.31Å
567	I	84.3	Confident	85.7	Confident	85 Å²	85	69.1 Å²	69.1	44%	0.436	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	128.2	179.1	-57.1	165.5	0	0	0	108.8	I716 G731 L733	I567-I716 HydrophobicContact CD1-CD1 3.73Å; I567-I716 HydrophobicContact CG1-CG2 4.39Å; I567-G731 CarbonylContact C-O 3.59Å; I567-G731 VanDerWaalsContact CA-O 3.28Å; I567-G731 WeakPolarHBondContact CA-O 3.08Å; I567-L733 HydrophobicContact CG2-CB 3.82Å
568	I	82	Confident	85.9	Confident	41 Å²	41	65.8 Å²	65.8	21%	0.21	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.3	172.7	60.8	168.8	0	0	0	110.7	L721 R730 G731 I732 L733	I568-L721 HydrophobicContact CD1-CD1 3.51Å; I568-L721 HydrophobicContact CG1-CD1 4.42Å; I568-R730 HydrophobicContact CD1-CB 4.37Å; I568-R730 HydrophobicContact CG1-CB 4.36Å; I568-R730 HydrophobicContact CG2-CB 4.25Å; I568-R730 HydrophobicContact CG2-CG 4.23Å; I568-G731 WeakPolarHBondContact CG1-O 3.29Å; I568-G731 PolarHBondContact N-O 3.33Å; I568-I732 HydrophobicContact CD1-CG1 4.2Å; I568-I732 HydrophobicContact CG1-CG1 4.15Å; I568-L733 PolarHBondContact O-N 3Å; I568-L733 VanDerWaalsContact O-N 3.16Å
569	K	81.6	Confident	85.9	Confident	85 Å²	85	66 Å²	66	37%	0.37	35%	0.347	S	S	.	.			trans	-134.3	160.9	176.7	58.4	179.9	174.3	-179	0	110.4	E571 E635	K569-E571 PolarHBondContact O-N 3.04Å; K569-E635 HydrophobicContact CD-CG 4.22Å; K569-E635 WeakPolarHBondContact CD-OE1 3.34Å; K569-E635 IonicContact NZ-OE1 3.52Å; K569-E635 PolarHBondContact NZ-OE1 3.03Å; K569-E635 IonicContact NZ-OE2 3.95Å; K569-E635 PolarHBondContact NZ-OE2 3.25Å
570	L	77.9	Confident	86.1	Confident	17 Å²	17	63.6 Å²	63.6	9%	0.089	34%	0.338	C	S	.	.			trans	-71.4	111.3	173.8	-177	65.8	0	0	0	109.4	I633 F805	L570-I633 HydrophobicContact CD2-CB 4.31Å; L570-I633 HydrophobicContact CD2-CG1 4.24Å; L570-I633 HydrophobicContact CD2-CG2 4.1Å; L570-I633 HydrophobicContact CG-CG2 4.43Å; L570-F805 HydrophobicContact CB-CE1 4.44Å; L570-F805 HydrophobicContact CD1-CD1 3.42Å; L570-F805 VanDerWaalsContact CD1-CD1 3.42Å; L570-F805 HydrophobicContact CD1-CE1 3.59Å
571	E	81.7	Confident	86.2	Confident	114 Å²	114	61.2 Å²	61.2	53%	0.533	32%	0.323	S	S	.	.			trans	-90.4	146.3	176	-63.5	-174.1	173.1	0	0	111.4	K569 S573 S574	K569-E571 PolarHBondContact O-N 3.04Å; E571-S573 WeakPolarHBondContact CB-OG 3.44Å; E571-S573 PolarHBondContact O-N 3.28Å; E571-S573 PolarHBondContact OE2-OG 2.77Å; E571-S574 WeakPolarHBondContact O-CB 3.27Å; E571-S574 PolarHBondContact O-N 3.22Å
572	W	83.6	Confident	86.4	Confident	131 Å²	131	66.5 Å²	66.5	50%	0.496	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-23.1	176.9	-64.3	93.1	0	0	0	113.5	S574 V581 F630 I633 A634	W572-S574 VanDerWaalsContact C-N 3.27Å; W572-V581 HydrophobicContact CE3-CG2 4.27Å; W572-V581 HydrophobicContact CZ3-CG2 3.98Å; W572-F630 HydrophobicContact CH2-CB 4.37Å; W572-F630 HydrophobicContact CH2-CD1 4.23Å; W572-F630 HydrophobicContact CZ3-CD1 4.14Å; W572-I633 HydrophobicContact CD2-CG2 3.99Å; W572-I633 HydrophobicContact CE3-CG2 3.7Å; W572-I633 HydrophobicContact CH2-CB 4.28Å; W572-I633 HydrophobicContact CH2-CG2 4.17Å; W572-I633 HydrophobicContact CZ2-CG2 4.43Å; W572-I633 HydrophobicContact CZ3-CB 4.16Å; W572-I633 HydrophobicContact CZ3-CG2 3.8Å; W572-A634 HydrophobicContact CZ2-CB 4.08Å
573	S	81.6	Confident	86.4	Confident	83 Å²	83	67.3 Å²	67.3	58%	0.58	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-13.6	175.4	51.3	0	0	0	0	113.4	E571	E571-S573 WeakPolarHBondContact CB-OG 3.44Å; E571-S573 PolarHBondContact O-N 3.28Å; E571-S573 PolarHBondContact OE2-OG 2.77Å
574	S	84.8	Confident	86.5	Confident	22 Å²	22	64.1 Å²	64.1	15%	0.154	33%	0.331	C	S	.	.	S	Bend	trans	-66.7	135.8	-177.1	-178.7	0	0	0	0	111.3	E571 W572 W576 A577 I578	E571-S574 WeakPolarHBondContact O-CB 3.27Å; E571-S574 PolarHBondContact O-N 3.22Å; W572-S574 VanDerWaalsContact C-N 3.27Å; S574-W576 PolarHBondContact O-N 3.24Å; S574-W576 VanDerWaalsContact O-N 3.08Å; S574-A577 PolarHBondContact O-N 3.03Å; S574-I578 WeakPolarHBondContact O-CG1 3.28Å; S574-I578 PolarHBondContact O-N 3.26Å
575	P	84.5	Confident	86.7	Confident	95 Å²	95	63.1 Å²	63.1	62%	0.617	32%	0.32	S	S	*	.	H	α-helix	trans	-52.5	-33.4	175.3	-26.9	34.8	0	0	0	113.3	A577	P575-A577 VanDerWaalsContact C-N 3.31Å; P575-A577 PolarHBondContact O-N 3.19Å
576	W	85.8	Confident	87.1	Confident	102 Å²	102	66.7 Å²	66.7	39%	0.386	34%	0.338	S	S	.	.	H	α-helix	trans	-65.7	-29.7	177.8	-61.3	115.4	0	0	0	113.1	S574 P580 E802 F805 I806 T809	S574-W576 PolarHBondContact O-N 3.24Å; S574-W576 VanDerWaalsContact O-N 3.08Å; W576-P580 WeakPolarHBondContact O-CD 3.42Å; W576-P580 WeakPolarHBondContact O-CG 3.39Å; W576-E802 PolarHBondContact NE1-OE2 3.23Å; W576-F805 HydrophobicContact CG-CB 4.24Å; W576-I806 HydrophobicContact CH2-CG1 4.26Å; W576-I806 HydrophobicContact CZ2-CG1 4.42Å; W576-I806 HydrophobicContact CZ3-CG1 4.48Å; W576-T809 HydrophobicContact CE3-CG2 4.36Å; W576-T809 WeakPolarHBondContact O-CG2 3.26Å; W576-T809 PolarHBondContact O-OG1 3.29Å
577	A	87.6	Confident	87.5	Confident	1 Å²	1	64.3 Å²	64.3	1%	0.008	32%	0.323	C	S	.	.	H	α-helix	trans	-87.3	-30.5	179.5	0	0	0	0	0	113.4	S574 P575 I579 P580 V581 I633	S574-A577 PolarHBondContact O-N 3.03Å; P575-A577 VanDerWaalsContact C-N 3.31Å; P575-A577 PolarHBondContact O-N 3.19Å; A577-I579 PolarHBondContact O-N 3.13Å; A577-P580 WeakPolarHBondContact O-CD 3.48Å; A577-V581 WeakPolarHBondContact O-CB 3.28Å; A577-V581 WeakPolarHBondContact O-CG2 3.34Å; A577-V581 PolarHBondContact O-N 3.25Å; A577-I633 HydrophobicContact CB-CD1 4.17Å; A577-I633 HydrophobicContact CB-CG2 3.84Å
578	I	88.8	Confident	88	Confident	95 Å²	95	61.9 Å²	61.9	49%	0.487	31%	0.311	S	S	.	.	H	α-helix	trans	-63.5	-45	-173.6	-67.5	169.3	0	0	0	112	S574 V581 F582	S574-I578 WeakPolarHBondContact O-CG1 3.28Å; S574-I578 PolarHBondContact O-N 3.26Å; I578-V581 PolarHBondContact O-N 2.74Å; I578-F582 WeakPolarHBondContact O-CB 3.47Å; I578-F582 PolarHBondContact O-N 2.76Å
579	I	88.6	Confident	88.6	Confident	106 Å²	106	65.5 Å²	65.5	54%	0.544	33%	0.33	S	S	.	.	H	α-helix	trans	-64.4	-51.7	-175.4	-61.9	169	0	0	0	111.9	A577 V581 F582 L583	A577-I579 PolarHBondContact O-N 3.13Å; I579-V581 VanDerWaalsContact C-N 3.34Å; I579-V581 PolarHBondContact O-N 2.76Å; I579-F582 PolarHBondContact O-N 3.22Å; I579-L583 HydrophobicContact CG2-CD1 4.43Å; I579-L583 PolarHBondContact O-N 3.38Å
580	P	91.1	Very high	89.2	Confident	0 Å²	0	63.7 Å²	63.7	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-59.2	-41.1	175.9	-21.2	28.3	0	0	0	113.5	W576 A577 L583 A584 T629 I633 T809 T812 V813	W576-P580 WeakPolarHBondContact O-CD 3.42Å; W576-P580 WeakPolarHBondContact O-CG 3.39Å; A577-P580 WeakPolarHBondContact O-CD 3.48Å; P580-L583 PolarHBondContact O-N 3.16Å; P580-A584 WeakPolarHBondContact O-CB 3.22Å; P580-A584 PolarHBondContact O-N 3.03Å; P580-T629 HydrophobicContact CB-CG2 3.69Å; P580-I633 HydrophobicContact CB-CD1 4.28Å; P580-T809 HydrophobicContact CG-CG2 3.87Å; P580-T812 WeakPolarHBondContact CB-OG1 3.46Å; P580-V813 HydrophobicContact CB-CG2 4.43Å; P580-V813 HydrophobicContact CG-CG2 3.98Å
581	V	92	Very high	89.9	Confident	25 Å²	25	62.9 Å²	62.9	15%	0.152	33%	0.327	C	S	.	.	H	α-helix	trans	-63	-44.6	-179.5	169.9	0	0	0	0	110.9	W572 A577 I578 I579 L583 A584 I585 F630 I633	W572-V581 HydrophobicContact CE3-CG2 4.27Å; W572-V581 HydrophobicContact CZ3-CG2 3.98Å; A577-V581 WeakPolarHBondContact O-CB 3.28Å; A577-V581 WeakPolarHBondContact O-CG2 3.34Å; A577-V581 PolarHBondContact O-N 3.25Å; I578-V581 PolarHBondContact O-N 2.74Å; I579-V581 VanDerWaalsContact C-N 3.34Å; I579-V581 PolarHBondContact O-N 2.76Å; V581-L583 PolarHBondContact O-N 3.16Å; V581-A584 PolarHBondContact O-N 3.2Å; V581-I585 HydrophobicContact CG1-CD1 3.75Å; V581-I585 HydrophobicContact CG1-CG1 4.37Å; V581-I585 VanDerWaalsContact O-CG1 3.31Å; V581-I585 WeakPolarHBondContact O-CG1 3.47Å; V581-I585 PolarHBondContact O-N 3.03Å; V581-F630 HydrophobicContact CG1-CE1 4.07Å; V581-I633 HydrophobicContact CG2-CD1 3.52Å
582	F	92.3	Very high	90.5	Very high	127 Å²	127	60.3 Å²	60.3	56%	0.557	32%	0.319	S	S	*	.	H	α-helix	trans	-60	-46.4	177.5	179.6	-103.4	0	0	0	112.1	I578 I579 A584 I585 L586	I578-F582 WeakPolarHBondContact O-CB 3.47Å; I578-F582 PolarHBondContact O-N 2.76Å; I579-F582 PolarHBondContact O-N 3.22Å; F582-A584 VanDerWaalsContact C-N 3.34Å; F582-A584 PolarHBondContact O-N 3.48Å; F582-I585 PolarHBondContact O-N 3.02Å; F582-L586 HydrophobicContact CD1-CD1 4.05Å; F582-L586 HydrophobicContact CE1-CD1 3.42Å; F582-L586 VanDerWaalsContact CE1-CD1 3.42Å; F582-L586 HydrophobicContact CE1-CG 4.36Å; F582-L586 HydrophobicContact CE2-CD1 4.27Å; F582-L586 HydrophobicContact CE2-CG 4.49Å; F582-L586 HydrophobicContact CZ-CD1 3.56Å; F582-L586 HydrophobicContact CZ-CG 4.24Å; F582-L586 PolarHBondContact O-N 3.13Å; F582-L586 VanDerWaalsContact O-N 3.13Å
583	L	91.9	Very high	90.9	Very high	53 Å²	53	55.8 Å²	55.8	28%	0.277	31%	0.313	S	S	.	.	H	α-helix	trans	-62.5	-39.7	176.4	-69.3	176.6	0	0	0	112.2	I579 P580 V581 G587	I579-L583 HydrophobicContact CG2-CD1 4.43Å; I579-L583 PolarHBondContact O-N 3.38Å; P580-L583 PolarHBondContact O-N 3.16Å; V581-L583 PolarHBondContact O-N 3.16Å; L583-G587 PolarHBondContact O-N 3.09Å
584	A	94.3	Very high	91.3	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-66.5	-42.2	178.2	0	0	0	0	0	112.5	P580 V581 F582 G587 I588 T629 F630	P580-A584 WeakPolarHBondContact O-CB 3.22Å; P580-A584 PolarHBondContact O-N 3.03Å; V581-A584 PolarHBondContact O-N 3.2Å; F582-A584 VanDerWaalsContact C-N 3.34Å; F582-A584 PolarHBondContact O-N 3.48Å; A584-G587 PolarHBondContact O-N 2.82Å; A584-I588 VanDerWaalsContact O-CG1 3.32Å; A584-I588 WeakPolarHBondContact O-CG1 3.48Å; A584-I588 PolarHBondContact O-N 3.23Å; A584-T629 HydrophobicContact CB-CG2 3.92Å; A584-F630 HydrophobicContact CB-CE2 4.03Å; A584-F630 HydrophobicContact CB-CZ 4.36Å
585	I	94.9	Very high	91.6	Very high	77 Å²	77	53.6 Å²	53.6	40%	0.395	29%	0.293	S	S	.	.	H	α-helix	trans	-61.4	-49.4	176.7	-68.2	166.4	0	0	0	110.5	V581 F582 G587 I588 L589 F630	V581-I585 HydrophobicContact CG1-CD1 3.75Å; V581-I585 HydrophobicContact CG1-CG1 4.37Å; V581-I585 VanDerWaalsContact O-CG1 3.31Å; V581-I585 WeakPolarHBondContact O-CG1 3.47Å; V581-I585 PolarHBondContact O-N 3.03Å; F582-I585 PolarHBondContact O-N 3.02Å; I585-G587 VanDerWaalsContact C-N 3.3Å; I585-G587 PolarHBondContact O-N 3.25Å; I585-I588 PolarHBondContact O-N 2.03Å; I585-L589 HydrophobicContact CG2-CD1 4.08Å; I585-L589 WeakPolarHBondContact O-CG 3.03Å; I585-L589 PolarHBondContact O-N 2.99Å; I585-F630 HydrophobicContact CG1-CE1 4.37Å; I585-F630 HydrophobicContact CG1-CZ 3.82Å
586	L	94.7	Very high	91.9	Very high	87 Å²	87	53.1 Å²	53.1	46%	0.455	29%	0.288	S	S	.	.	H	α-helix	trans	-59.8	-42.5	176.7	-72.2	-179.2	0	0	0	111.8	F582 L589 A590	F582-L586 HydrophobicContact CD1-CD1 4.05Å; F582-L586 HydrophobicContact CE1-CD1 3.42Å; F582-L586 VanDerWaalsContact CE1-CD1 3.42Å; F582-L586 HydrophobicContact CE1-CG 4.36Å; F582-L586 HydrophobicContact CE2-CD1 4.27Å; F582-L586 HydrophobicContact CE2-CG 4.49Å; F582-L586 HydrophobicContact CZ-CD1 3.56Å; F582-L586 HydrophobicContact CZ-CG 4.24Å; F582-L586 PolarHBondContact O-N 3.13Å; F582-L586 VanDerWaalsContact O-N 3.13Å; L586-L589 PolarHBondContact O-N 2.93Å; L586-A590 WeakPolarHBondContact O-CB 3.22Å; L586-A590 PolarHBondContact O-N 2.93Å
587	G	94	Very high	92	Very high	4 Å²	4	49.3 Å²	49.3	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-61.3	-43.7	176.6	0	0	0	0	0	113.5	L583 A584 I585 A590 T591 Y626	L583-G587 PolarHBondContact O-N 3.09Å; A584-G587 PolarHBondContact O-N 2.82Å; I585-G587 VanDerWaalsContact C-N 3.3Å; I585-G587 PolarHBondContact O-N 3.25Å; G587-A590 PolarHBondContact O-N 3.49Å; G587-T591 VanDerWaalsContact O-CB 3.27Å; G587-T591 WeakPolarHBondContact O-CB 3.36Å; G587-T591 PolarHBondContact O-N 3.16Å; G587-T591 PolarHBondContact O-OG1 2.82Å; G587-Y626 VanDerWaalsContact CA-CZ 3.47Å
588	I	95.4	Very high	92	Very high	34 Å²	34	49.3 Å²	49.3	17%	0.174	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-46	177	-73.4	168.2	0	0	0	111	A584 I585 T591 T592 F623 Y626 F630	A584-I588 VanDerWaalsContact O-CG1 3.32Å; A584-I588 WeakPolarHBondContact O-CG1 3.48Å; A584-I588 PolarHBondContact O-N 3.23Å; I585-I588 PolarHBondContact O-N 2.03Å; I588-T591 PolarHBondContact O-N 3.13Å; I588-T592 VanDerWaalsContact O-CB 3.31Å; I588-T592 WeakPolarHBondContact O-CB 3.43Å; I588-T592 PolarHBondContact O-N 2.92Å; I588-T592 PolarHBondContact O-OG1 3.22Å; I588-F623 HydrophobicContact CG2-CE2 3.93Å; I588-Y626 HydrophobicContact CG1-CG 4.47Å; I588-F630 HydrophobicContact CD1-CE2 3.65Å; I588-F630 HydrophobicContact CD1-CZ 4.41Å
589	L	94.6	Very high	92	Very high	117 Å²	117	48.9 Å²	48.9	61%	0.613	28%	0.278	S	S	*	.	H	α-helix	trans	-60.9	-46.9	178	-69.9	173.7	0	0	0	111.1	I585 L586 T592 G593	I585-L589 HydrophobicContact CG2-CD1 4.08Å; I585-L589 WeakPolarHBondContact O-CG 3.03Å; I585-L589 PolarHBondContact O-N 2.99Å; L586-L589 PolarHBondContact O-N 2.93Å; L589-T592 PolarHBondContact O-N 2.96Å; L589-G593 PolarHBondContact O-N 2.66Å
590	A	92.9	Very high	92	Very high	47 Å²	47	52.9 Å²	52.9	39%	0.388	29%	0.286	S	S	.	.	H	α-helix	trans	-63.1	-46	177.3	0	0	0	0	0	111.9	L586 G587 T592 G593 V594 L823	L586-A590 WeakPolarHBondContact O-CB 3.22Å; L586-A590 PolarHBondContact O-N 2.93Å; G587-A590 PolarHBondContact O-N 3.49Å; A590-T592 PolarHBondContact O-N 2.93Å; A590-G593 PolarHBondContact O-N 2.9Å; A590-V594 WeakPolarHBondContact O-CG2 3.38Å; A590-V594 PolarHBondContact O-N 3.49Å; A590-L823 HydrophobicContact CB-CD2 3.65Å
591	T	93.7	Very high	91.7	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-62.7	-42.8	179.5	-55.9	0	0	0	0	111.3	G587 I588 G593 V594 I595 L619 I622 F623	G587-T591 VanDerWaalsContact O-CB 3.27Å; G587-T591 WeakPolarHBondContact O-CB 3.36Å; G587-T591 PolarHBondContact O-N 3.16Å; G587-T591 PolarHBondContact O-OG1 2.82Å; I588-T591 PolarHBondContact O-N 3.13Å; T591-G593 VanDerWaalsContact C-N 3.34Å; T591-G593 PolarHBondContact O-N 3.26Å; T591-V594 PolarHBondContact O-N 3.02Å; T591-I595 HydrophobicContact CG2-CD1 3.96Å; T591-I595 HydrophobicContact CG2-CG1 4.47Å; T591-I595 VanDerWaalsContact O-CG1 3.31Å; T591-I595 WeakPolarHBondContact O-CG1 3.49Å; T591-I595 PolarHBondContact O-N 3.43Å; T591-L619 HydrophobicContact CG2-CD2 4.38Å; T591-I622 HydrophobicContact CG2-CG2 4.07Å; T591-F623 HydrophobicContact CG2-CB 4.14Å
592	T	92.8	Very high	91.3	Very high	60 Å²	60	57.4 Å²	57.4	37%	0.368	31%	0.306	S	S	.	.	H	α-helix	trans	-63.7	-39.9	176.4	-54.2	0	0	0	0	111.3	I588 L589 A590 I595 T596	I588-T592 VanDerWaalsContact O-CB 3.31Å; I588-T592 WeakPolarHBondContact O-CB 3.43Å; I588-T592 PolarHBondContact O-N 2.92Å; I588-T592 PolarHBondContact O-OG1 3.22Å; L589-T592 PolarHBondContact O-N 2.96Å; A590-T592 PolarHBondContact O-N 2.93Å; T592-I595 PolarHBondContact O-N 3.29Å; T592-T596 WeakPolarHBondContact O-CB 3.5Å; T592-T596 PolarHBondContact O-N 2.9Å; T592-T596 PolarHBondContact O-OG1 3.42Å
593	G	91.9	Very high	90.7	Very high	36 Å²	36	56.4 Å²	56.4	37%	0.371	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-43.1	173.4	0	0	0	0	0	113.1	L589 A590 T591 T597	L589-G593 PolarHBondContact O-N 2.66Å; A590-G593 PolarHBondContact O-N 2.9Å; T591-G593 VanDerWaalsContact C-N 3.34Å; T591-G593 PolarHBondContact O-N 3.26Å; G593-T597 WeakPolarHBondContact O-CB 3.41Å; G593-T597 PolarHBondContact O-N 2.73Å; G593-T597 PolarHBondContact O-OG1 3.17Å
594	V	91.4	Very high	90.3	Very high	11 Å²	11	54.9 Å²	54.9	7%	0.067	30%	0.299	C	S	.	.	H	α-helix	trans	-65	-46.8	175.2	175.5	0	0	0	0	111.2	A590 T591 T596 T597 F598 L619 L823 Y827 V831	A590-V594 WeakPolarHBondContact O-CG2 3.38Å; A590-V594 PolarHBondContact O-N 3.49Å; T591-V594 PolarHBondContact O-N 3.02Å; V594-T596 PolarHBondContact O-N 3.08Å; V594-T597 PolarHBondContact O-N 3.22Å; V594-F598 HydrophobicContact CG1-CD2 3.93Å; V594-F598 HydrophobicContact CG1-CE2 4.03Å; V594-F598 WeakPolarHBondContact O-CB 3.03Å; V594-F598 WeakPolarHBondContact O-CD2 3.49Å; V594-F598 PolarHBondContact O-N 2.96Å; V594-L619 HydrophobicContact CB-CD2 4.41Å; V594-L619 HydrophobicContact CG1-CD1 4.08Å; V594-L619 HydrophobicContact CG1-CD2 3.83Å; V594-L823 HydrophobicContact CB-CD1 4.22Å; V594-L823 HydrophobicContact CG1-CD1 4.45Å; V594-L823 HydrophobicContact CG2-CD1 3.82Å; V594-L823 HydrophobicContact CG2-CG 4.5Å; V594-Y827 HydrophobicContact CG1-CD1 3.91Å; V594-Y827 HydrophobicContact CG1-CG 4.07Å; V594-V831 HydrophobicContact CB-CG2 4.48Å; V594-V831 HydrophobicContact CG1-CG2 4.1Å; V594-V831 HydrophobicContact CG2-CG2 4.13Å
595	I	91.1	Very high	89.5	Confident	48 Å²	48	57 Å²	57	25%	0.246	31%	0.312	C	S	.	.	H	α-helix	trans	-57.8	-49.3	177.3	-70	168.1	0	0	0	110.2	T591 T592 T597 F598 V599 L619	T591-I595 HydrophobicContact CG2-CD1 3.96Å; T591-I595 HydrophobicContact CG2-CG1 4.47Å; T591-I595 VanDerWaalsContact O-CG1 3.31Å; T591-I595 WeakPolarHBondContact O-CG1 3.49Å; T591-I595 PolarHBondContact O-N 3.43Å; T592-I595 PolarHBondContact O-N 3.29Å; I595-T597 VanDerWaalsContact C-N 3.32Å; I595-T597 PolarHBondContact O-N 3.47Å; I595-F598 PolarHBondContact O-N 3.26Å; I595-V599 HydrophobicContact CG2-CG2 4.25Å; I595-V599 VanDerWaalsContact O-CG2 3.31Å; I595-V599 WeakPolarHBondContact O-CG2 3.39Å; I595-V599 PolarHBondContact O-N 3.43Å; I595-L619 HydrophobicContact CD1-CB 4.19Å; I595-L619 HydrophobicContact CG1-CB 3.87Å; I595-L619 HydrophobicContact CG1-CD1 3.95Å; I595-L619 HydrophobicContact CG1-CG 4.34Å
596	T	89.8	Confident	88.8	Confident	86 Å²	86	55.2 Å²	55.2	53%	0.528	30%	0.303	S	S	.	.	H	α-helix	trans	-58.9	-44.2	179.8	-56.6	0	0	0	0	111.3	T592 V594 V599 R600	T592-T596 WeakPolarHBondContact O-CB 3.5Å; T592-T596 PolarHBondContact O-N 2.9Å; T592-T596 PolarHBondContact O-OG1 3.42Å; V594-T596 PolarHBondContact O-N 3.08Å; T596-V599 PolarHBondContact O-N 3.28Å; T596-R600 VanDerWaalsContact O-CB 3.29Å; T596-R600 WeakPolarHBondContact O-CB 3.17Å; T596-R600 PolarHBondContact O-N 3.47Å
597	T	88.5	Confident	88.2	Confident	22 Å²	22	51.1 Å²	51.1	14%	0.135	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-45.4	176.8	-54.8	0	0	0	0	111.4	G593 V594 I595 V599 R600 F601 V831 I834 I835	G593-T597 WeakPolarHBondContact O-CB 3.41Å; G593-T597 PolarHBondContact O-N 2.73Å; G593-T597 PolarHBondContact O-OG1 3.17Å; V594-T597 PolarHBondContact O-N 3.22Å; I595-T597 VanDerWaalsContact C-N 3.32Å; I595-T597 PolarHBondContact O-N 3.47Å; T597-V599 PolarHBondContact O-N 3.03Å; T597-R600 PolarHBondContact O-N 3.4Å; T597-F601 HydrophobicContact CG2-CD2 3.93Å; T597-F601 HydrophobicContact CG2-CE2 4.41Å; T597-F601 WeakPolarHBondContact O-CB 3.42Å; T597-F601 WeakPolarHBondContact O-CD2 3.36Å; T597-F601 PolarHBondContact O-N 3.12Å; T597-V831 HydrophobicContact CG2-CG1 4.3Å; T597-V831 HydrophobicContact CG2-CG2 4.5Å; T597-I834 HydrophobicContact CG2-CG2 4.12Å; T597-I835 HydrophobicContact CG2-CD1 4.3Å; T597-I835 HydrophobicContact CG2-CG1 4.33Å
598	F	88.2	Confident	87.5	Confident	1 Å²	1	57.7 Å²	57.7	0%	0.004	31%	0.306	C	S	.	.	H	α-helix	trans	-66.7	-34.7	179.9	-90.2	-123.2	0	0	0	112.7	V594 I595 N602 V607 Y616 Y827 K830 V831	V594-F598 HydrophobicContact CG1-CD2 3.93Å; V594-F598 HydrophobicContact CG1-CE2 4.03Å; V594-F598 WeakPolarHBondContact O-CB 3.03Å; V594-F598 WeakPolarHBondContact O-CD2 3.49Å; V594-F598 PolarHBondContact O-N 2.96Å; I595-F598 PolarHBondContact O-N 3.26Å; F598-N602 VanDerWaalsContact O-CA 3.26Å; F598-N602 WeakPolarHBondContact O-CA 3.49Å; F598-N602 PolarHBondContact O-N 2.98Å; F598-V607 HydrophobicContact CD1-CG1 3.99Å; F598-V607 HydrophobicContact CD1-CG2 4.23Å; F598-V607 HydrophobicContact CE1-CG1 4.43Å; F598-V607 HydrophobicContact CE1-CG2 4.35Å; F598-V607 HydrophobicContact CG-CG2 4.43Å; F598-Y616 HydrophobicContact CB-CE1 4.08Å; F598-Y616 PolarHBondContact O-OH 2.97Å; F598-Y827 AromaticContact CE1-CD1 3.9Å; F598-Y827 HydrophobicContact CE1-CD1 3.9Å; F598-Y827 AromaticContact CE1-CE1 3.84Å; F598-Y827 HydrophobicContact CE1-CE1 3.84Å; F598-Y827 HydrophobicContact CE2-CD1 4.03Å; F598-Y827 AromaticContact CZ-CD1 3.52Å; F598-Y827 HydrophobicContact CZ-CD1 3.52Å; F598-Y827 AromaticContact CZ-CE1 3.97Å; F598-Y827 HydrophobicContact CZ-CE1 3.97Å; F598-K830 HydrophobicContact CZ-CB 4.27Å; F598-K830 HydrophobicContact CZ-CD 4.27Å; F598-V831 HydrophobicContact CD2-CG2 4.21Å; F598-V831 HydrophobicContact CE2-CG2 3.74Å
599	V	88.2	Confident	86.4	Confident	85 Å²	85	59.3 Å²	59.3	52%	0.515	32%	0.324	S	S	.	.	H	α-helix	trans	-72.1	-43.6	174.4	173.3	0	0	0	0	110.8	I595 T596 T597 F601 N602 Y616	I595-V599 HydrophobicContact CG2-CG2 4.25Å; I595-V599 VanDerWaalsContact O-CG2 3.31Å; I595-V599 WeakPolarHBondContact O-CG2 3.39Å; I595-V599 PolarHBondContact O-N 3.43Å; T596-V599 PolarHBondContact O-N 3.28Å; T597-V599 PolarHBondContact O-N 3.03Å; V599-F601 VanDerWaalsContact C-N 3.34Å; V599-F601 PolarHBondContact O-N 3.35Å; V599-N602 WeakPolarHBondContact O-CB 3.36Å; V599-N602 PolarHBondContact O-N 2.81Å; V599-Y616 HydrophobicContact CG2-CE1 3.85Å
600	R	88.1	Confident	85.5	Confident	190 Å²	190	53.9 Å²	53.9	72%	0.717	30%	0.296	S	S	*	.	H	α-helix	trans	-65.9	-35.8	-179	-174.2	63	-178.4	85.6	-3.6	113.1	T596 T597	T596-R600 VanDerWaalsContact O-CB 3.29Å; T596-R600 WeakPolarHBondContact O-CB 3.17Å; T596-R600 PolarHBondContact O-N 3.47Å; T597-R600 PolarHBondContact O-N 3.4Å
601	F	85.9	Confident	85	Confident	84 Å²	84	52.2 Å²	52.2	37%	0.368	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108	30.7	-179.1	-66.5	-72.4	0	0	0	112.8	T597 V599 D603 T604 I834	T597-F601 HydrophobicContact CG2-CD2 3.93Å; T597-F601 HydrophobicContact CG2-CE2 4.41Å; T597-F601 WeakPolarHBondContact O-CB 3.42Å; T597-F601 WeakPolarHBondContact O-CD2 3.36Å; T597-F601 PolarHBondContact O-N 3.12Å; V599-F601 VanDerWaalsContact C-N 3.34Å; V599-F601 PolarHBondContact O-N 3.35Å; F601-D603 PolarHBondContact O-N 2.9Å; F601-D603 VanDerWaalsContact O-N 3.1Å; F601-T604 HydrophobicContact CB-CG2 3.79Å; F601-T604 HydrophobicContact CD1-CG2 4.15Å; F601-T604 HydrophobicContact CG-CG2 4.42Å; F601-T604 WeakPolarHBondContact O-CB 3.39Å; F601-T604 WeakPolarHBondContact O-CG2 3.5Å; F601-T604 PolarHBondContact O-N 2.71Å; F601-T604 PolarHBondContact O-OG1 2.65Å; F601-I834 HydrophobicContact CB-CG2 4.1Å; F601-I834 HydrophobicContact CD1-CG2 4.47Å; F601-I834 HydrophobicContact CD2-CG2 3.64Å; F601-I834 HydrophobicContact CE2-CG2 4.14Å; F601-I834 HydrophobicContact CG-CG2 3.82Å
602	N	83.3	Confident	84.5	Confident	37 Å²	37	54.9 Å²	54.9	20%	0.198	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59	-29.5	-170.6	-166	13	0	0	0	114.2	F598 V599 R612 Y616	F598-N602 VanDerWaalsContact O-CA 3.26Å; F598-N602 WeakPolarHBondContact O-CA 3.49Å; F598-N602 PolarHBondContact O-N 2.98Å; V599-N602 WeakPolarHBondContact O-CB 3.36Å; V599-N602 PolarHBondContact O-N 2.81Å; N602-R612 PolarHBondContact O-NH2 3.13Å; N602-R612 WeakPolarHBondContact OD1-CD 3.28Å; N602-R612 VanDerWaalsContact OD1-CG 3.29Å; N602-R612 WeakPolarHBondContact OD1-CG 3.47Å; N602-R612 PolarHBondContact OD1-NE 3.19Å; N602-R612 PolarHBondContact OD1-NH2 2.73Å; N602-Y616 PolarHBondContact OD1-OH 3.44Å
603	D	80	Confident	84.2	Confident	106 Å²	106	55.9 Å²	55.9	57%	0.567	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-0.4	-178.8	-67.7	-41	0	0	0	114.9	F601 R608 R612	F601-D603 PolarHBondContact O-N 2.9Å; F601-D603 VanDerWaalsContact O-N 3.1Å; D603-R608 IonicContact OD1-CZ 2.81Å; D603-R608 IonicContact OD1-NE 2.68Å; D603-R608 IonicContact OD1-NH2 3.72Å; D603-R608 PolarHBondContact OD1-NH2 3.26Å; D603-R612 IonicContact OD1-CZ 2.72Å; D603-R612 IonicContact OD1-NH2 3.43Å; D603-R612 PolarHBondContact OD1-NH2 2.84Å
604	T	82.7	Confident	84	Confident	21 Å²	21	54.4 Å²	54.4	13%	0.129	28%	0.277	C	S	.	.	S	Bend	trans	-67.9	145.3	176.9	60.9	0	0	0	0	112.1	F601 I606 V607 R608 N841	F601-T604 HydrophobicContact CB-CG2 3.79Å; F601-T604 HydrophobicContact CD1-CG2 4.15Å; F601-T604 HydrophobicContact CG-CG2 4.42Å; F601-T604 WeakPolarHBondContact O-CB 3.39Å; F601-T604 WeakPolarHBondContact O-CG2 3.5Å; F601-T604 PolarHBondContact O-N 2.71Å; F601-T604 PolarHBondContact O-OG1 2.65Å; T604-I606 PolarHBondContact O-N 3.3Å; T604-V607 PolarHBondContact O-N 3.06Å; T604-V607 WeakPolarHBondContact OG1-CG2 3.4Å; T604-R608 PolarHBondContact O-N 3.28Å; T604-R608 VanDerWaalsContact O-N 3.08Å; T604-N841 WeakPolarHBondContact CB-ND2 3.22Å; T604-N841 WeakPolarHBondContact CB-OD1 3.31Å; T604-N841 VanDerWaalsContact CG2-ND2 3.26Å; T604-N841 WeakPolarHBondContact CG2-ND2 3.47Å
605	P	77.6	Confident	83.9	Confident	43 Å²	43	54 Å²	54	28%	0.279	27%	0.274	S	S	.	.	H	α-helix	trans	-61.8	-30.3	-176.5	23.2	-33.3	0	0	0	113	A609 N841	P605-A609 WeakPolarHBondContact O-CB 3.5Å; P605-A609 PolarHBondContact O-N 3.23Å; P605-N841 WeakPolarHBondContact CD-OD1 3.45Å; P605-N841 VanDerWaalsContact CG-O 3.26Å; P605-N841 WeakPolarHBondContact CG-O 3.11Å
606	I	80.3	Confident	83.9	Confident	40 Å²	40	53.9 Å²	53.9	21%	0.205	27%	0.271	C	S	.	.	H	α-helix	trans	-65.9	-45.9	177.4	-65	174	0	0	0	111.2	T604 A609 S610 K830 V833 I834 N841	T604-I606 PolarHBondContact O-N 3.3Å; I606-A609 PolarHBondContact O-N 3.45Å; I606-S610 PolarHBondContact O-N 3.08Å; I606-K830 HydrophobicContact CG2-CB 4.39Å; I606-K830 HydrophobicContact CG2-CG 4.43Å; I606-V833 HydrophobicContact CD1-CB 4.42Å; I606-V833 HydrophobicContact CD1-CG1 3.59Å; I606-I834 HydrophobicContact CD1-CG1 4.41Å; I606-I834 HydrophobicContact CG2-CD1 4.31Å; I606-I834 HydrophobicContact CG2-CG1 4.46Å; I606-N841 HydrophobicContact CD1-CB 4.08Å; I606-N841 WeakPolarHBondContact CD1-OD1 3.29Å; I606-N841 WeakPolarHBondContact CG1-OD1 3.22Å
607	V	81.9	Confident	84	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	26%	0.256	C	S	.	.	H	α-helix	trans	-69	-41.4	179.3	177.5	0	0	0	0	111	F598 T604 S610 I834	F598-V607 HydrophobicContact CD1-CG1 3.99Å; F598-V607 HydrophobicContact CD1-CG2 4.23Å; F598-V607 HydrophobicContact CE1-CG1 4.43Å; F598-V607 HydrophobicContact CE1-CG2 4.35Å; F598-V607 HydrophobicContact CG-CG2 4.43Å; T604-V607 PolarHBondContact O-N 3.06Å; T604-V607 WeakPolarHBondContact OG1-CG2 3.4Å; V607-S610 PolarHBondContact O-N 3.41Å; V607-I834 HydrophobicContact CG2-CD1 3.82Å
608	R	78.9	Confident	84.2	Confident	143 Å²	143	50.5 Å²	50.5	54%	0.54	25%	0.25	S	S	.	.	H	α-helix	trans	-64.6	-39.6	175.7	-73.5	-177.9	172	-176.4	2.3	112.6	D603 T604 G611 R612	D603-R608 IonicContact OD1-CZ 2.81Å; D603-R608 IonicContact OD1-NE 2.68Å; D603-R608 IonicContact OD1-NH2 3.72Å; D603-R608 PolarHBondContact OD1-NH2 3.26Å; T604-R608 PolarHBondContact O-N 3.28Å; T604-R608 VanDerWaalsContact O-N 3.08Å; R608-G611 PolarHBondContact O-N 3.47Å; R608-R612 VanDerWaalsContact NE-NH2 3.14Å
609	A	73.3	Confident	84.4	Confident	68 Å²	68	50.5 Å²	50.5	56%	0.562	25%	0.25	S	S	*	.	H	α-helix	trans	-65.3	-38.1	178.2	0	0	0	0	0	112.7	P605 I606 G611	P605-A609 WeakPolarHBondContact O-CB 3.5Å; P605-A609 PolarHBondContact O-N 3.23Å; I606-A609 PolarHBondContact O-N 3.45Å; A609-G611 PolarHBondContact O-N 3.08Å; A609-G611 VanDerWaalsContact O-N 3.16Å
610	S	76.2	Confident	84.6	Confident	3 Å²	3	50 Å²	50	2%	0.021	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-9	177.8	179.6	0	0	0	0	114.2	I606 V607 S615 K662 E772 K830	I606-S610 PolarHBondContact O-N 3.08Å; V607-S610 PolarHBondContact O-N 3.41Å; S610-S615 PolarHBondContact O-OG 3.42Å; S610-S615 PolarHBondContact OG-OG 2.99Å; S610-K662 WeakPolarHBondContact O-CE 3.47Å; S610-K662 PolarHBondContact O-NZ 3.47Å; S610-K662 PolarHBondContact OG-NZ 2.7Å; S610-E772 PolarHBondContact OG-OE1 3.37Å; S610-K830 PolarHBondContact OG-NZ 2.94Å
611	G	80.5	Confident	84.8	Confident	11 Å²	11	40.9 Å²	40.9	11%	0.113	21%	0.213	C	C	.	.			trans	75.5	85	-173.1	0	0	0	0	0	111.3	R608 A609 E613 L614 S615	R608-G611 PolarHBondContact O-N 3.47Å; A609-G611 PolarHBondContact O-N 3.08Å; A609-G611 VanDerWaalsContact O-N 3.16Å; G611-E613 PolarHBondContact O-N 3.16Å; G611-L614 PolarHBondContact O-N 2.71Å; G611-S615 WeakPolarHBondContact O-CB 3.47Å; G611-S615 PolarHBondContact O-N 3.24Å; G611-S615 PolarHBondContact O-OG 2.81Å
612	R	83.4	Confident	85.2	Confident	57 Å²	57	37 Å²	37	22%	0.215	20%	0.196	C	C	.	.	H	α-helix	trans	-42.4	-59.5	-178.7	178.5	-172.3	-64.5	-171.6	-12.9	113.3	N602 D603 R608 S615 Y616	N602-R612 PolarHBondContact O-NH2 3.13Å; N602-R612 WeakPolarHBondContact OD1-CD 3.28Å; N602-R612 VanDerWaalsContact OD1-CG 3.29Å; N602-R612 WeakPolarHBondContact OD1-CG 3.47Å; N602-R612 PolarHBondContact OD1-NE 3.19Å; N602-R612 PolarHBondContact OD1-NH2 2.73Å; D603-R612 IonicContact OD1-CZ 2.72Å; D603-R612 IonicContact OD1-NH2 3.43Å; D603-R612 PolarHBondContact OD1-NH2 2.84Å; R608-R612 VanDerWaalsContact NE-NH2 3.14Å; R612-S615 WeakPolarHBondContact O-CB 3.08Å; R612-S615 PolarHBondContact O-N 3.17Å; R612-Y616 HydrophobicContact CG-CD2 4.05Å; R612-Y616 HydrophobicContact CG-CE2 3.45Å; R612-Y616 VanDerWaalsContact CG-CE2 3.45Å; R612-Y616 WeakPolarHBondContact O-CD2 3.5Å; R612-Y616 PolarHBondContact O-N 3Å; R612-Y616 VanDerWaalsContact O-N 3.09Å
613	E	87.5	Confident	85.7	Confident	81 Å²	81	38.4 Å²	38.4	38%	0.379	20%	0.201	S	C	.	.	H	α-helix	trans	-62.6	-48.9	-173.7	-52.2	-50.4	137.8	0	0	113.1	G611 S615 Y616 V617 L689	G611-E613 PolarHBondContact O-N 3.16Å; E613-S615 PolarHBondContact O-N 3.41Å; E613-Y616 PolarHBondContact O-N 3.25Å; E613-V617 WeakPolarHBondContact O-CG2 3.44Å; E613-V617 PolarHBondContact O-N 3.01Å; E613-V617 VanDerWaalsContact O-N 3.11Å; E613-L689 HydrophobicContact CB-CD1 3.94Å; E613-L689 HydrophobicContact CB-CD2 3.98Å; E613-L689 HydrophobicContact CB-CG 4.1Å; E613-L689 HydrophobicContact CG-CD1 4.25Å
614	L	86.8	Confident	86.3	Confident	5 Å²	5	35 Å²	35	3%	0.026	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-30.6	177.3	-69.6	177.7	0	0	0	112.5	G611 V617 L618 T661 K662 Q688 L689 T692	G611-L614 PolarHBondContact O-N 2.71Å; L614-V617 PolarHBondContact O-N 2.88Å; L614-L618 WeakPolarHBondContact O-CB 3.34Å; L614-L618 PolarHBondContact O-N 3.3Å; L614-T661 HydrophobicContact CD1-CG2 4.11Å; L614-T661 HydrophobicContact CD2-CG2 4.15Å; L614-K662 HydrophobicContact CD1-CB 4.37Å; L614-Q688 HydrophobicContact CD1-CB 4.06Å; L614-Q688 HydrophobicContact CD1-CG 4.43Å; L614-Q688 HydrophobicContact CD2-CB 4.3Å; L614-Q688 HydrophobicContact CG-CB 4.33Å; L614-L689 HydrophobicContact CD2-CD2 4.39Å; L614-T692 WeakPolarHBondContact CD2-OG1 3.45Å
615	S	89.6	Confident	86.9	Confident	1 Å²	1	34.1 Å²	34.1	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-70.9	-34	178.1	-58	0	0	0	0	111.5	S610 G611 R612 E613 L619 Y827	S610-S615 PolarHBondContact O-OG 3.42Å; S610-S615 PolarHBondContact OG-OG 2.99Å; G611-S615 WeakPolarHBondContact O-CB 3.47Å; G611-S615 PolarHBondContact O-N 3.24Å; G611-S615 PolarHBondContact O-OG 2.81Å; R612-S615 WeakPolarHBondContact O-CB 3.08Å; R612-S615 PolarHBondContact O-N 3.17Å; E613-S615 PolarHBondContact O-N 3.41Å; S615-L619 WeakPolarHBondContact O-CB 3.32Å; S615-L619 WeakPolarHBondContact O-CD1 3.38Å; S615-L619 VanDerWaalsContact O-CG 3.25Å; S615-L619 WeakPolarHBondContact O-CG 3.46Å; S615-L619 PolarHBondContact O-N 3.41Å; S615-Y827 WeakPolarHBondContact CA-OH 3.35Å; S615-Y827 PolarHBondContact O-OH 3.08Å
616	Y	91.1	Very high	87.7	Confident	46 Å²	46	32.2 Å²	32.2	18%	0.18	16%	0.164	C	C	.	.	H	α-helix	trans	-70.9	-39.6	171.9	-67.4	-48.6	0	0	0	112.6	F598 V599 N602 R612 E613 L618 L619 T620	F598-Y616 HydrophobicContact CB-CE1 4.08Å; F598-Y616 PolarHBondContact O-OH 2.97Å; V599-Y616 HydrophobicContact CG2-CE1 3.85Å; N602-Y616 PolarHBondContact OD1-OH 3.44Å; R612-Y616 HydrophobicContact CG-CD2 4.05Å; R612-Y616 HydrophobicContact CG-CE2 3.45Å; R612-Y616 VanDerWaalsContact CG-CE2 3.45Å; R612-Y616 WeakPolarHBondContact O-CD2 3.5Å; R612-Y616 PolarHBondContact O-N 3Å; R612-Y616 VanDerWaalsContact O-N 3.09Å; E613-Y616 PolarHBondContact O-N 3.25Å; Y616-L618 VanDerWaalsContact C-N 3.35Å; Y616-L618 PolarHBondContact O-N 3.14Å; Y616-L619 PolarHBondContact O-N 3.46Å; Y616-T620 WeakPolarHBondContact O-CB 3.33Å; Y616-T620 PolarHBondContact O-N 3.31Å; Y616-T620 PolarHBondContact O-OG1 3.24Å
617	V	92.6	Very high	88.3	Confident	35 Å²	35	32.7 Å²	32.7	21%	0.212	17%	0.167	C	C	.	.	H	α-helix	trans	-61.3	-44.9	174.3	177.9	0	0	0	0	110.7	E613 L614 T620 G621 I654 A658 L689 T692 I696	E613-V617 WeakPolarHBondContact O-CG2 3.44Å; E613-V617 PolarHBondContact O-N 3.01Å; E613-V617 VanDerWaalsContact O-N 3.11Å; L614-V617 PolarHBondContact O-N 2.88Å; V617-T620 PolarHBondContact O-N 3.4Å; V617-G621 PolarHBondContact O-N 3.38Å; V617-I654 HydrophobicContact CG1-CG2 3.8Å; V617-I654 WeakPolarHBondContact O-CG2 3.43Å; V617-A658 HydrophobicContact CB-CB 4.35Å; V617-A658 HydrophobicContact CG1-CB 4.04Å; V617-L689 HydrophobicContact CG2-CD2 3.9Å; V617-T692 HydrophobicContact CG1-CG2 4.07Å; V617-I696 HydrophobicContact CG1-CD1 4.48Å
618	L	92	Very high	88.7	Confident	3 Å²	3	32.8 Å²	32.8	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-62.3	-45.8	176.3	178.8	57	0	0	0	112.3	L614 Y616 T620 G621 I622 S655 A658 L826 Y827	L614-L618 WeakPolarHBondContact O-CB 3.34Å; L614-L618 PolarHBondContact O-N 3.3Å; Y616-L618 VanDerWaalsContact C-N 3.35Å; Y616-L618 PolarHBondContact O-N 3.14Å; L618-T620 VanDerWaalsContact C-N 3.3Å; L618-T620 PolarHBondContact O-N 2.94Å; L618-G621 PolarHBondContact O-N 2.87Å; L618-I622 HydrophobicContact CD1-CD1 4.3Å; L618-I622 HydrophobicContact CG-CD1 4.18Å; L618-I622 WeakPolarHBondContact O-CG1 3.31Å; L618-I622 PolarHBondContact O-N 3.13Å; L618-S655 VanDerWaalsContact CD1-O 3.26Å; L618-S655 WeakPolarHBondContact CD1-O 3.47Å; L618-A658 HydrophobicContact CB-CB 3.97Å; L618-L826 HydrophobicContact CD2-CD1 4Å; L618-Y827 HydrophobicContact CD2-CE2 3.88Å; L618-Y827 WeakPolarHBondContact CD2-OH 3.41Å; L618-Y827 HydrophobicContact CG-CE2 4.23Å
619	L	92.8	Very high	89.3	Confident	0 Å²	0	26 Å²	26	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-64.8	-33.3	177.1	-73.1	166.5	0	0	0	112.5	T591 V594 I595 S615 Y616 I622 F623 L823 Y827	T591-L619 HydrophobicContact CG2-CD2 4.38Å; V594-L619 HydrophobicContact CB-CD2 4.41Å; V594-L619 HydrophobicContact CG1-CD1 4.08Å; V594-L619 HydrophobicContact CG1-CD2 3.83Å; I595-L619 HydrophobicContact CD1-CB 4.19Å; I595-L619 HydrophobicContact CG1-CB 3.87Å; I595-L619 HydrophobicContact CG1-CD1 3.95Å; I595-L619 HydrophobicContact CG1-CG 4.34Å; S615-L619 WeakPolarHBondContact O-CB 3.32Å; S615-L619 WeakPolarHBondContact O-CD1 3.38Å; S615-L619 VanDerWaalsContact O-CG 3.25Å; S615-L619 WeakPolarHBondContact O-CG 3.46Å; S615-L619 PolarHBondContact O-N 3.41Å; Y616-L619 PolarHBondContact O-N 3.46Å; L619-I622 PolarHBondContact O-N 3.47Å; L619-F623 WeakPolarHBondContact O-CB 3.35Å; L619-F623 PolarHBondContact O-N 3.39Å; L619-L823 HydrophobicContact CD2-CD1 4.01Å; L619-Y827 HydrophobicContact CD1-CD1 4.37Å; L619-Y827 HydrophobicContact CD1-CE1 3.87Å; L619-Y827 HydrophobicContact CD2-CD1 4.26Å; L619-Y827 HydrophobicContact CD2-CD2 4.17Å; L619-Y827 HydrophobicContact CD2-CE1 4.1Å; L619-Y827 HydrophobicContact CD2-CE2 4.03Å; L619-Y827 HydrophobicContact CD2-CG 4.28Å; L619-Y827 HydrophobicContact CG-CE1 3.94Å; L619-Y827 HydrophobicContact CG-CE2 4.31Å
620	T	92.6	Very high	90.2	Very high	74 Å²	74	25.3 Å²	25.3	45%	0.454	13%	0.126	S	C	.	.	H	α-helix	trans	-66.2	-42.4	173.8	-55.2	0	0	0	0	111.1	Y616 V617 L618 F623 L624	Y616-T620 WeakPolarHBondContact O-CB 3.33Å; Y616-T620 PolarHBondContact O-N 3.31Å; Y616-T620 PolarHBondContact O-OG1 3.24Å; V617-T620 PolarHBondContact O-N 3.4Å; L618-T620 VanDerWaalsContact C-N 3.3Å; L618-T620 PolarHBondContact O-N 2.94Å; T620-F623 PolarHBondContact O-N 3.45Å; T620-L624 HydrophobicContact CG2-CD1 4.45Å; T620-L624 WeakPolarHBondContact O-CG 3.21Å; T620-L624 PolarHBondContact O-N 3.29Å
621	G	92.6	Very high	90.9	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-60.3	-45.5	173	0	0	0	0	0	112.6	V617 L618 F623 L624 I625 S655	V617-G621 PolarHBondContact O-N 3.38Å; L618-G621 PolarHBondContact O-N 2.87Å; G621-F623 PolarHBondContact O-N 2.92Å; G621-L624 PolarHBondContact O-N 2.89Å; G621-I625 VanDerWaalsContact O-CG1 3.3Å; G621-I625 WeakPolarHBondContact O-CG1 3.35Å; G621-I625 PolarHBondContact O-N 3.12Å; G621-S655 WeakPolarHBondContact CA-OG 3.49Å
622	I	93.8	Very high	91.3	Very high	1 Å²	1	28.2 Å²	28.2	1%	0.005	14%	0.136	C	C	.	.	H	α-helix	trans	-60.1	-44.2	176.3	-69.5	169.5	0	0	0	111.2	T591 L618 L619 L624 I625 Y626 S655 A819 Y827	T591-I622 HydrophobicContact CG2-CG2 4.07Å; L618-I622 HydrophobicContact CD1-CD1 4.3Å; L618-I622 HydrophobicContact CG-CD1 4.18Å; L618-I622 WeakPolarHBondContact O-CG1 3.31Å; L618-I622 PolarHBondContact O-N 3.13Å; L619-I622 PolarHBondContact O-N 3.47Å; I622-L624 PolarHBondContact O-N 3.19Å; I622-I625 PolarHBondContact O-N 2.95Å; I622-Y626 HydrophobicContact CG2-CD2 4.15Å; I622-Y626 HydrophobicContact CG2-CE2 3.72Å; I622-Y626 WeakPolarHBondContact O-CD2 3.11Å; I622-Y626 PolarHBondContact O-N 3.2Å; I622-S655 PolarHBondContact N-OG 3.37Å; I622-A819 HydrophobicContact CG2-CB 4.22Å; I622-Y827 HydrophobicContact CD1-CE2 4.42Å
623	F	94.5	Very high	91.5	Very high	68 Å²	68	25.7 Å²	25.7	30%	0.298	13%	0.127	S	C	.	.	H	α-helix	trans	-60.2	-44.7	176.3	-179.4	-92.5	0	0	0	111.9	I588 T591 L619 T620 G621 I625 Y626 L627	I588-F623 HydrophobicContact CG2-CE2 3.93Å; T591-F623 HydrophobicContact CG2-CB 4.14Å; L619-F623 WeakPolarHBondContact O-CB 3.35Å; L619-F623 PolarHBondContact O-N 3.39Å; T620-F623 PolarHBondContact O-N 3.45Å; G621-F623 PolarHBondContact O-N 2.92Å; F623-I625 VanDerWaalsContact C-N 3.31Å; F623-I625 PolarHBondContact O-N 3.42Å; F623-Y626 PolarHBondContact O-N 3.13Å; F623-L627 HydrophobicContact CE1-CD2 4.34Å; F623-L627 WeakPolarHBondContact O-CB 3.35Å; F623-L627 PolarHBondContact O-N 3.19Å
624	L	92.6	Very high	91.6	Very high	33 Å²	33	22.7 Å²	22.7	17%	0.173	12%	0.116	C	C	.	.	H	α-helix	trans	-64.8	-32.3	177.8	-69.1	174.2	0	0	0	112.9	T620 G621 I622 L627 I628 L647 I654	T620-L624 HydrophobicContact CG2-CD1 4.45Å; T620-L624 WeakPolarHBondContact O-CG 3.21Å; T620-L624 PolarHBondContact O-N 3.29Å; G621-L624 PolarHBondContact O-N 2.89Å; I622-L624 PolarHBondContact O-N 3.19Å; L624-L627 HydrophobicContact CD2-CD2 4.24Å; L624-L627 PolarHBondContact O-N 3.37Å; L624-I628 PolarHBondContact O-N 3.28Å; L624-I628 VanDerWaalsContact O-N 3.08Å; L624-L647 HydrophobicContact CD2-CD2 4.33Å; L624-I654 HydrophobicContact CD1-CD1 3.88Å
625	I	93.6	Very high	91.6	Very high	4 Å²	4	27.2 Å²	27.2	2%	0.021	14%	0.137	C	C	.	.	H	α-helix	trans	-66.3	-37.7	175.3	-66.8	160.8	0	0	0	111.8	G621 I622 F623 I628 M652 S655 M815 A819	G621-I625 VanDerWaalsContact O-CG1 3.3Å; G621-I625 WeakPolarHBondContact O-CG1 3.35Å; G621-I625 PolarHBondContact O-N 3.12Å; I622-I625 PolarHBondContact O-N 2.95Å; F623-I625 VanDerWaalsContact C-N 3.31Å; F623-I625 PolarHBondContact O-N 3.42Å; I625-I628 WeakPolarHBondContact O-CG2 3.05Å; I625-M652 HydrophobicContact CD1-CG 4.34Å; I625-M652 HydrophobicContact CD1-SD 3.46Å; I625-M652 WeakPolarHBondContact CD1-SD 3.1Å; I625-M652 HydrophobicContact CG1-CG 4.31Å; I625-M652 HydrophobicContact CG1-SD 3.83Å; I625-M652 HydrophobicContact CG2-SD 4.23Å; I625-S655 WeakPolarHBondContact CD1-OG 3.49Å; I625-M815 HydrophobicContact CG2-CB 3.95Å; I625-M815 WeakPolarHBondContact CG2-O 3.29Å; I625-A819 HydrophobicContact CB-CB 4.24Å; I625-A819 HydrophobicContact CG2-CB 3.85Å
626	Y	94.3	Very high	91.5	Very high	2 Å²	2	27.8 Å²	27.8	1%	0.008	14%	0.14	C	C	.	.	H	α-helix	trans	-75.3	-31.9	173.7	-66.4	-61	0	0	0	112.4	G587 I588 I622 F623 T629 A819 T820	G587-Y626 VanDerWaalsContact CA-CZ 3.47Å; I588-Y626 HydrophobicContact CG1-CG 4.47Å; I622-Y626 HydrophobicContact CG2-CD2 4.15Å; I622-Y626 HydrophobicContact CG2-CE2 3.72Å; I622-Y626 WeakPolarHBondContact O-CD2 3.11Å; I622-Y626 PolarHBondContact O-N 3.2Å; F623-Y626 PolarHBondContact O-N 3.13Å; Y626-T629 WeakPolarHBondContact O-CB 3.12Å; Y626-T629 PolarHBondContact O-N 3.18Å; Y626-A819 HydrophobicContact CD1-CB 4.49Å; Y626-A819 HydrophobicContact CD2-CB 4.42Å; Y626-A819 HydrophobicContact CE1-CB 3.91Å; Y626-A819 HydrophobicContact CE2-CB 3.82Å; Y626-T820 WeakPolarHBondContact OH-CA 3.47Å; Y626-T820 WeakPolarHBondContact OH-CB 3.44Å; Y626-T820 PolarHBondContact OH-N 2.74Å; Y626-T820 PolarHBondContact OH-OG1 2.65Å
627	L	93.1	Very high	91.3	Very high	51 Å²	51	28.1 Å²	28.1	27%	0.267	15%	0.149	S	C	.	.	H	α-helix	trans	-66.9	-37.2	179.4	-175.8	63.6	0	0	0	112.8	F623 L624 T629 F630 F631	F623-L627 HydrophobicContact CE1-CD2 4.34Å; F623-L627 WeakPolarHBondContact O-CB 3.35Å; F623-L627 PolarHBondContact O-N 3.19Å; L624-L627 HydrophobicContact CD2-CD2 4.24Å; L624-L627 PolarHBondContact O-N 3.37Å; L627-T629 PolarHBondContact O-N 3.36Å; L627-F630 PolarHBondContact O-N 3.38Å; L627-F631 HydrophobicContact CD1-CE2 4.29Å; L627-F631 HydrophobicContact CD2-CE2 4.41Å; L627-F631 HydrophobicContact CG-CD2 4.48Å; L627-F631 HydrophobicContact CG-CE2 3.99Å
628	I	91.6	Very high	91.1	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.015	16%	0.162	C	C	.	.	H	α-helix	trans	-62.9	-25.3	-179.8	-176	55.8	0	0	0	113.1	L624 I625 F630 F631 M632 L647 M815	L624-I628 PolarHBondContact O-N 3.28Å; L624-I628 VanDerWaalsContact O-N 3.08Å; I625-I628 WeakPolarHBondContact O-CG2 3.05Å; I628-F630 VanDerWaalsContact C-N 3.26Å; I628-F630 PolarHBondContact O-N 3.11Å; I628-F631 HydrophobicContact CD1-CB 3.98Å; I628-F631 PolarHBondContact O-N 3.03Å; I628-F631 VanDerWaalsContact O-N 3.08Å; I628-M632 HydrophobicContact CD1-CG 4.26Å; I628-M632 HydrophobicContact CG1-CG 4.08Å; I628-M632 WeakPolarHBondContact O-CG 3.31Å; I628-M632 PolarHBondContact O-N 3.47Å; I628-L647 HydrophobicContact CB-CB 4.15Å; I628-L647 HydrophobicContact CD1-CB 3.66Å; I628-L647 HydrophobicContact CD1-CD1 4.5Å; I628-L647 HydrophobicContact CG1-CB 4.1Å; I628-M815 HydrophobicContact CG2-SD 4.48Å
629	T	91.6	Very high	90.9	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-55.7	-39.6	176.6	-58.6	0	0	0	0	112.3	P580 A584 Y626 L627 M632 I633 T812	P580-T629 HydrophobicContact CB-CG2 3.69Å; A584-T629 HydrophobicContact CB-CG2 3.92Å; Y626-T629 WeakPolarHBondContact O-CB 3.12Å; Y626-T629 PolarHBondContact O-N 3.18Å; L627-T629 PolarHBondContact O-N 3.36Å; T629-M632 PolarHBondContact O-N 3.27Å; T629-I633 HydrophobicContact CG2-CD1 4.26Å; T629-I633 PolarHBondContact O-N 3.03Å; T629-T812 HydrophobicContact CG2-CG2 4.31Å
630	F	91.8	Very high	90.8	Very high	53 Å²	53	32 Å²	32	23%	0.232	19%	0.187	C	C	.	.	H	α-helix	trans	-67.5	-41.4	177.1	-63.5	-85.2	0	0	0	112	W572 V581 A584 I585 I588 L627 I628 M632 I633 A634	W572-F630 HydrophobicContact CH2-CB 4.37Å; W572-F630 HydrophobicContact CH2-CD1 4.23Å; W572-F630 HydrophobicContact CZ3-CD1 4.14Å; V581-F630 HydrophobicContact CG1-CE1 4.07Å; A584-F630 HydrophobicContact CB-CE2 4.03Å; A584-F630 HydrophobicContact CB-CZ 4.36Å; I585-F630 HydrophobicContact CG1-CE1 4.37Å; I585-F630 HydrophobicContact CG1-CZ 3.82Å; I588-F630 HydrophobicContact CD1-CE2 3.65Å; I588-F630 HydrophobicContact CD1-CZ 4.41Å; L627-F630 PolarHBondContact O-N 3.38Å; I628-F630 VanDerWaalsContact C-N 3.26Å; I628-F630 PolarHBondContact O-N 3.11Å; F630-M632 VanDerWaalsContact C-N 3.34Å; F630-M632 PolarHBondContact O-N 2.81Å; F630-I633 PolarHBondContact O-N 3.24Å; F630-A634 WeakPolarHBondContact O-CB 3.33Å; F630-A634 PolarHBondContact O-N 3.33Å
631	F	90.9	Very high	90.7	Very high	58 Å²	58	28.5 Å²	28.5	25%	0.254	17%	0.166	S	C	.	.	H	α-helix	trans	-69.3	-32.9	179.5	-69.4	-70.6	0	0	0	112.2	L627 I628 I633 V640 I643 R644 L647	L627-F631 HydrophobicContact CD1-CE2 4.29Å; L627-F631 HydrophobicContact CD2-CE2 4.41Å; L627-F631 HydrophobicContact CG-CD2 4.48Å; L627-F631 HydrophobicContact CG-CE2 3.99Å; I628-F631 HydrophobicContact CD1-CB 3.98Å; I628-F631 PolarHBondContact O-N 3.03Å; I628-F631 VanDerWaalsContact O-N 3.08Å; F631-I633 VanDerWaalsContact C-N 3.26Å; F631-I633 PolarHBondContact O-N 3.41Å; F631-V640 WeakPolarHBondContact O-CG1 3.49Å; F631-I643 HydrophobicContact CB-CG2 4.19Å; F631-I643 HydrophobicContact CD1-CB 4.3Å; F631-I643 HydrophobicContact CD1-CD1 4.2Å; F631-I643 HydrophobicContact CD1-CG2 3.76Å; F631-I643 HydrophobicContact CD2-CG2 3.71Å; F631-I643 HydrophobicContact CE1-CD1 3.76Å; F631-I643 HydrophobicContact CE1-CG2 4.01Å; F631-I643 HydrophobicContact CE2-CG2 3.95Å; F631-I643 HydrophobicContact CG-CB 4.49Å; F631-I643 HydrophobicContact CG-CG2 3.6Å; F631-I643 HydrophobicContact CZ-CD1 4.25Å; F631-I643 HydrophobicContact CZ-CG2 4.1Å; F631-R644 HydrophobicContact CB-CG 4.45Å; F631-R644 VanDerWaalsContact O-CZ 3.25Å; F631-R644 PolarHBondContact O-NE 2.88Å; F631-R644 PolarHBondContact O-NH2 3.38Å; F631-L647 HydrophobicContact CD2-CD1 4.19Å; F631-L647 HydrophobicContact CE2-CD1 4.32Å
632	M	87.9	Confident	90.5	Very high	18 Å²	18	30.8 Å²	30.8	9%	0.089	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-25.1	174.5	-71.6	-62.6	-66.1	0	0	113.4	I628 T629 F630 R644 L648 T808 L811 T812	I628-M632 HydrophobicContact CD1-CG 4.26Å; I628-M632 HydrophobicContact CG1-CG 4.08Å; I628-M632 WeakPolarHBondContact O-CG 3.31Å; I628-M632 PolarHBondContact O-N 3.47Å; T629-M632 PolarHBondContact O-N 3.27Å; F630-M632 VanDerWaalsContact C-N 3.34Å; F630-M632 PolarHBondContact O-N 2.81Å; M632-R644 VanDerWaalsContact C-NH2 3.32Å; M632-R644 VanDerWaalsContact O-CZ 3.32Å; M632-R644 PolarHBondContact O-NH2 2.94Å; M632-R644 HydrophobicContact SD-CB 4.22Å; M632-R644 HydrophobicContact SD-CG 3.78Å; M632-L648 HydrophobicContact SD-CD1 4.29Å; M632-T808 HydrophobicContact CB-CG2 4.28Å; M632-T808 HydrophobicContact CE-CG2 4.15Å; M632-L811 HydrophobicContact CE-CD2 4.04Å; M632-T812 HydrophobicContact CB-CG2 3.69Å; M632-T812 HydrophobicContact CG-CG2 3.97Å
633	I	88.6	Confident	90.3	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	19%	0.194	C	C	.	.	H	α-helix	trans	-96.4	-29.2	179.4	-64.7	168.5	0	0	0	112.3	L570 W572 A577 P580 V581 T629 F630 F631	L570-I633 HydrophobicContact CD2-CB 4.31Å; L570-I633 HydrophobicContact CD2-CG1 4.24Å; L570-I633 HydrophobicContact CD2-CG2 4.1Å; L570-I633 HydrophobicContact CG-CG2 4.43Å; W572-I633 HydrophobicContact CD2-CG2 3.99Å; W572-I633 HydrophobicContact CE3-CG2 3.7Å; W572-I633 HydrophobicContact CH2-CB 4.28Å; W572-I633 HydrophobicContact CH2-CG2 4.17Å; W572-I633 HydrophobicContact CZ2-CG2 4.43Å; W572-I633 HydrophobicContact CZ3-CB 4.16Å; W572-I633 HydrophobicContact CZ3-CG2 3.8Å; A577-I633 HydrophobicContact CB-CD1 4.17Å; A577-I633 HydrophobicContact CB-CG2 3.84Å; P580-I633 HydrophobicContact CB-CD1 4.28Å; V581-I633 HydrophobicContact CG2-CD1 3.52Å; T629-I633 HydrophobicContact CG2-CD1 4.26Å; T629-I633 PolarHBondContact O-N 3.03Å; F630-I633 PolarHBondContact O-N 3.24Å; F631-I633 VanDerWaalsContact C-N 3.26Å; F631-I633 PolarHBondContact O-N 3.41Å
634	A	88.8	Confident	90	Very high	18 Å²	18	31.3 Å²	31.3	15%	0.149	18%	0.183	C	C	.	.	S	Bend	trans	-54.4	158	-179.1	0	0	0	0	0	113.6	W572 F630 P636 V640 R644	W572-A634 HydrophobicContact CZ2-CB 4.08Å; F630-A634 WeakPolarHBondContact O-CB 3.33Å; F630-A634 PolarHBondContact O-N 3.33Å; A634-P636 WeakPolarHBondContact O-CD 3.28Å; A634-V640 HydrophobicContact CB-CG1 4.2Å; A634-V640 HydrophobicContact CB-CG2 4.33Å; A634-R644 PolarHBondContact O-NH2 2.99Å
635	E	86.6	Confident	89.8	Confident	100 Å²	100	30 Å²	30	47%	0.467	18%	0.176	S	C	.	.	P	Polyproline II helix	trans	-58.8	126.6	178.7	-175	160.3	-171.8	0	0	111.1	K569 S637	K569-E635 HydrophobicContact CD-CG 4.22Å; K569-E635 WeakPolarHBondContact CD-OE1 3.34Å; K569-E635 IonicContact NZ-OE1 3.52Å; K569-E635 PolarHBondContact NZ-OE1 3.03Å; K569-E635 IonicContact NZ-OE2 3.95Å; K569-E635 PolarHBondContact NZ-OE2 3.25Å; E635-S637 PolarHBondContact O-N 3.07Å; E635-S637 VanDerWaalsContact O-N 3.13Å
636	P	87.3	Confident	89.6	Confident	12 Å²	12	32.1 Å²	32.1	8%	0.078	19%	0.187	C	C	.	.	P	Polyproline II helix	trans	-58.4	118.6	178.2	-24.8	34.7	0	0	0	111	A634 T714 L733	A634-P636 WeakPolarHBondContact O-CD 3.28Å; P636-T714 HydrophobicContact CB-CG2 4.04Å; P636-L733 HydrophobicContact CB-CG 4.35Å; P636-L733 HydrophobicContact CG-CG 4.44Å
637	S	88.2	Confident	89.3	Confident	53 Å²	53	33 Å²	33	37%	0.371	19%	0.192	S	C	.	.			trans	-138.3	162	171.3	60.9	0	0	0	0	108	E635 G639 V640 C641	E635-S637 PolarHBondContact O-N 3.07Å; E635-S637 VanDerWaalsContact O-N 3.13Å; S637-G639 PolarHBondContact O-N 3.18Å; S637-G639 VanDerWaalsContact O-N 3.13Å; S637-V640 PolarHBondContact O-N 2.89Å; S637-V640 WeakPolarHBondContact OG-CB 3.31Å; S637-V640 VanDerWaalsContact OG-CG2 3.27Å; S637-V640 WeakPolarHBondContact OG-CG2 3.27Å; S637-V640 PolarHBondContact OG-N 2.9Å; S637-C641 WeakPolarHBondContact O-CB 3.31Å; S637-C641 PolarHBondContact O-N 2.93Å; S637-C641 PolarHBondContact O-SG 3.37Å
638	A	87.1	Confident	88.9	Confident	58 Å²	58	30.7 Å²	30.7	48%	0.479	18%	0.18	S	C	.	.	H	α-helix	trans	-51.5	-40.6	178.5	0	0	0	0	0	112.3	T642	A638-T642 WeakPolarHBondContact O-CB 3.33Å; A638-T642 PolarHBondContact O-N 2.87Å; A638-T642 VanDerWaalsContact O-N 3.09Å; A638-T642 PolarHBondContact O-OG1 3.37Å
639	G	88.8	Confident	88.6	Confident	41 Å²	41	30.6 Å²	30.6	42%	0.423	18%	0.179	S	C	.	.	H	α-helix	trans	-65.6	-48	175.2	0	0	0	0	0	113.2	S637 C641 T642 I643	S637-G639 PolarHBondContact O-N 3.18Å; S637-G639 VanDerWaalsContact O-N 3.13Å; G639-C641 PolarHBondContact O-N 3.26Å; G639-T642 WeakPolarHBondContact O-CB 3.41Å; G639-T642 PolarHBondContact O-N 3.38Å; G639-I643 WeakPolarHBondContact O-CG1 3.32Å; G639-I643 PolarHBondContact O-N 3.47Å
640	V	90.7	Very high	88.6	Confident	21 Å²	21	31.5 Å²	31.5	13%	0.127	18%	0.184	C	C	.	.	H	α-helix	trans	-63.4	-42.3	178.8	171	0	0	0	0	111.2	F631 A634 S637 T642 I643 R644	F631-V640 WeakPolarHBondContact O-CG1 3.49Å; A634-V640 HydrophobicContact CB-CG1 4.2Å; A634-V640 HydrophobicContact CB-CG2 4.33Å; S637-V640 PolarHBondContact O-N 2.89Å; S637-V640 WeakPolarHBondContact OG-CB 3.31Å; S637-V640 VanDerWaalsContact OG-CG2 3.27Å; S637-V640 WeakPolarHBondContact OG-CG2 3.27Å; S637-V640 PolarHBondContact OG-N 2.9Å; V640-T642 VanDerWaalsContact C-N 3.3Å; V640-T642 PolarHBondContact O-N 2.98Å; V640-I643 PolarHBondContact O-N 3.16Å; V640-R644 HydrophobicContact CG1-CG 4.31Å; V640-R644 WeakPolarHBondContact O-CB 3.35Å; V640-R644 VanDerWaalsContact O-CG 3.28Å; V640-R644 WeakPolarHBondContact O-CG 3.46Å; V640-R644 PolarHBondContact O-N 3.08Å
641	C	89.5	Confident	88.5	Confident	1 Å²	1	29 Å²	29	1%	0.007	17%	0.173	C	C	.	.	H	α-helix	trans	-63.3	-36.7	177.1	-59.9	0	0	0	0	112.1	S637 G639 R645 P712 C735	S637-C641 WeakPolarHBondContact O-CB 3.31Å; S637-C641 PolarHBondContact O-N 2.93Å; S637-C641 PolarHBondContact O-SG 3.37Å; G639-C641 PolarHBondContact O-N 3.26Å; C641-R645 WeakPolarHBondContact O-CG 3.49Å; C641-R645 PolarHBondContact O-N 2.81Å; C641-R645 VanDerWaalsContact O-N 3.12Å; C641-P712 HydrophobicContact CB-CB 4.23Å; C641-C735 WeakPolarHBondContact CA-SG 3.27Å; C641-C735 HydrophobicContact CB-CB 3.82Å; C641-C735 WeakPolarHBondContact CB-SG 3.44Å; C641-C735 VanDerWaalsContact SG-CA 3.6Å; C641-C735 WeakPolarHBondContact SG-CB 3.29Å; C641-C735 CovalentContact SG-SG 2.03Å; C641-C735 PolarHBondContact SG-SG 3.47Å
642	T	88.9	Confident	88.4	Confident	48 Å²	48	26.3 Å²	26.3	29%	0.294	16%	0.161	S	C	.	.	H	α-helix	trans	-63.4	-49.4	174.2	-55.8	0	0	0	0	111.1	A638 G639 V640 R644 R645 L646 F707 P712	A638-T642 WeakPolarHBondContact O-CB 3.33Å; A638-T642 PolarHBondContact O-N 2.87Å; A638-T642 VanDerWaalsContact O-N 3.09Å; A638-T642 PolarHBondContact O-OG1 3.37Å; G639-T642 WeakPolarHBondContact O-CB 3.41Å; G639-T642 PolarHBondContact O-N 3.38Å; V640-T642 VanDerWaalsContact C-N 3.3Å; V640-T642 PolarHBondContact O-N 2.98Å; T642-R644 PolarHBondContact O-N 2.96Å; T642-R645 PolarHBondContact O-N 3Å; T642-L646 PolarHBondContact O-N 2.93Å; T642-F707 HydrophobicContact CG2-CE2 4.03Å; T642-F707 HydrophobicContact CG2-CZ 3.88Å; T642-P712 HydrophobicContact CG2-CG 4.3Å; T642-P712 WeakPolarHBondContact OG1-CG 3.3Å
643	I	89.9	Confident	88.7	Confident	58 Å²	58	25.4 Å²	25.4	30%	0.297	16%	0.157	S	C	.	.	H	α-helix	trans	-64.2	-40.6	179.7	-65.8	169.3	0	0	0	111	F631 G639 V640 L646 L647	F631-I643 HydrophobicContact CB-CG2 4.19Å; F631-I643 HydrophobicContact CD1-CB 4.3Å; F631-I643 HydrophobicContact CD1-CD1 4.2Å; F631-I643 HydrophobicContact CD1-CG2 3.76Å; F631-I643 HydrophobicContact CD2-CG2 3.71Å; F631-I643 HydrophobicContact CE1-CD1 3.76Å; F631-I643 HydrophobicContact CE1-CG2 4.01Å; F631-I643 HydrophobicContact CE2-CG2 3.95Å; F631-I643 HydrophobicContact CG-CB 4.49Å; F631-I643 HydrophobicContact CG-CG2 3.6Å; F631-I643 HydrophobicContact CZ-CD1 4.25Å; F631-I643 HydrophobicContact CZ-CG2 4.1Å; G639-I643 WeakPolarHBondContact O-CG1 3.32Å; G639-I643 PolarHBondContact O-N 3.47Å; V640-I643 PolarHBondContact O-N 3.16Å; I643-L646 PolarHBondContact O-N 3.22Å; I643-L647 HydrophobicContact CG2-CD1 3.56Å; I643-L647 HydrophobicContact CG2-CG 4.06Å; I643-L647 WeakPolarHBondContact O-CB 3.29Å; I643-L647 PolarHBondContact O-N 3.38Å
644	R	89.3	Confident	89	Confident	21 Å²	21	26.2 Å²	26.2	8%	0.079	16%	0.161	C	C	.	.	H	α-helix	trans	-54.5	-54.3	174.5	-77.6	179.5	-172.3	-170.8	-0.3	111	F631 M632 A634 V640 T642 L646 L648	F631-R644 HydrophobicContact CB-CG 4.45Å; F631-R644 VanDerWaalsContact O-CZ 3.25Å; F631-R644 PolarHBondContact O-NE 2.88Å; F631-R644 PolarHBondContact O-NH2 3.38Å; M632-R644 VanDerWaalsContact C-NH2 3.32Å; M632-R644 VanDerWaalsContact O-CZ 3.32Å; M632-R644 PolarHBondContact O-NH2 2.94Å; M632-R644 HydrophobicContact SD-CB 4.22Å; M632-R644 HydrophobicContact SD-CG 3.78Å; A634-R644 PolarHBondContact O-NH2 2.99Å; V640-R644 HydrophobicContact CG1-CG 4.31Å; V640-R644 WeakPolarHBondContact O-CB 3.35Å; V640-R644 VanDerWaalsContact O-CG 3.28Å; V640-R644 WeakPolarHBondContact O-CG 3.46Å; V640-R644 PolarHBondContact O-N 3.08Å; T642-R644 PolarHBondContact O-N 2.96Å; R644-L646 VanDerWaalsContact C-N 3.3Å; R644-L646 PolarHBondContact O-N 3.16Å; R644-L648 WeakPolarHBondContact O-CB 3.34Å; R644-L648 PolarHBondContact O-N 2.76Å; R644-L648 VanDerWaalsContact O-N 3.11Å
645	R	87.7	Confident	89.2	Confident	5 Å²	5	25.5 Å²	25.5	2%	0.019	16%	0.155	C	C	.	.	H	α-helix	trans	-63.1	-35.8	-179.2	-71.8	-174.6	-177.1	-177.9	3.6	112.7	C641 T642 F707 V710 D736 M737	C641-R645 WeakPolarHBondContact O-CG 3.49Å; C641-R645 PolarHBondContact O-N 2.81Å; C641-R645 VanDerWaalsContact O-N 3.12Å; T642-R645 PolarHBondContact O-N 3Å; R645-F707 HydrophobicContact CB-CE1 3.76Å; R645-F707 HydrophobicContact CB-CZ 4.32Å; R645-V710 PolarHBondContact NH1-O 3.17Å; R645-D736 PolarHBondContact NH2-O 2.91Å; R645-M737 HydrophobicContact CG-SD 4.06Å
646	L	88.3	Confident	89.5	Confident	49 Å²	49	21 Å²	21	26%	0.257	13%	0.134	S	C	.	.	H	α-helix	trans	-70.8	-52.9	179.2	-177.6	64.8	0	0	0	112.6	T642 I643 R644 L650 L700 V703 F707	T642-L646 PolarHBondContact O-N 2.93Å; I643-L646 PolarHBondContact O-N 3.22Å; R644-L646 VanDerWaalsContact C-N 3.3Å; R644-L646 PolarHBondContact O-N 3.16Å; L646-L650 HydrophobicContact CD1-CD2 4.39Å; L646-L650 HydrophobicContact CG-CD2 4.46Å; L646-L650 WeakPolarHBondContact O-CB 3.41Å; L646-L700 HydrophobicContact CD1-CD2 4.43Å; L646-V703 HydrophobicContact CD1-CG1 4.04Å; L646-F707 HydrophobicContact CB-CZ 4.33Å
647	L	88.9	Confident	89.8	Confident	21 Å²	21	20.4 Å²	20.4	11%	0.11	13%	0.13	C	C	.	.	H	α-helix	trans	-80.8	-26.5	-169.7	-67.2	-176.9	0	0	0	113.6	L624 I628 F631 I643 G649 L650 G651	L624-L647 HydrophobicContact CD2-CD2 4.33Å; I628-L647 HydrophobicContact CB-CB 4.15Å; I628-L647 HydrophobicContact CD1-CB 3.66Å; I628-L647 HydrophobicContact CD1-CD1 4.5Å; I628-L647 HydrophobicContact CG1-CB 4.1Å; F631-L647 HydrophobicContact CD2-CD1 4.19Å; F631-L647 HydrophobicContact CE2-CD1 4.32Å; I643-L647 HydrophobicContact CG2-CD1 3.56Å; I643-L647 HydrophobicContact CG2-CG 4.06Å; I643-L647 WeakPolarHBondContact O-CB 3.29Å; I643-L647 PolarHBondContact O-N 3.38Å; L647-G649 PolarHBondContact O-N 2.81Å; L647-L650 PolarHBondContact O-N 3.29Å; L647-G651 PolarHBondContact O-N 3.02Å
648	L	85.3	Confident	90	Very high	3 Å²	3	18 Å²	18	2%	0.016	11%	0.113	C	C	.	.	H	α-helix	trans	-56.4	-47.3	-175.9	-173.4	74.9	0	0	0	112.8	M632 R644 M737 L742 L746 L811 M815	M632-L648 HydrophobicContact SD-CD1 4.29Å; R644-L648 WeakPolarHBondContact O-CB 3.34Å; R644-L648 PolarHBondContact O-N 2.76Å; R644-L648 VanDerWaalsContact O-N 3.11Å; L648-M737 HydrophobicContact CD2-CE 3.82Å; L648-L742 HydrophobicContact CD2-CG 4.19Å; L648-L746 HydrophobicContact CG-CD2 4.2Å; L648-L811 HydrophobicContact CD1-CD2 3.92Å; L648-L811 HydrophobicContact CD1-CG 4.45Å; L648-M815 HydrophobicContact CD1-CE 3.35Å; L648-M815 HydrophobicContact CD1-SD 3.9Å; L648-M815 HydrophobicContact CG-CE 3.89Å
649	G	85.3	Confident	90.2	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-87.5	-32	176.4	0	0	0	0	0	113.7	L647 C653 S749	L647-G649 PolarHBondContact O-N 2.81Å; G649-C653 VanDerWaalsContact O-CB 3.24Å; G649-C653 WeakPolarHBondContact O-CB 3.49Å; G649-C653 PolarHBondContact O-N 3.42Å; G649-C653 VanDerWaalsContact O-N 3.07Å; G649-S749 PolarHBondContact O-OG 2.88Å
650	L	90.4	Very high	90.3	Very high	19 Å²	19	14 Å²	14	10%	0.099	8%	0.075	C	C	.	.	H	α-helix	trans	-70.3	-41.7	-171	-174.9	62.3	0	0	0	113.2	L646 L647 M652 C653 I654 I696 L700	L646-L650 HydrophobicContact CD1-CD2 4.39Å; L646-L650 HydrophobicContact CG-CD2 4.46Å; L646-L650 WeakPolarHBondContact O-CB 3.41Å; L647-L650 PolarHBondContact O-N 3.29Å; L650-M652 PolarHBondContact O-N 3.26Å; L650-C653 PolarHBondContact O-N 2.96Å; L650-I654 HydrophobicContact CD1-CD1 4.06Å; L650-I654 HydrophobicContact CD1-CG1 4.17Å; L650-I654 HydrophobicContact CG-CD1 3.83Å; L650-I654 HydrophobicContact CG-CG1 4.37Å; L650-I654 VanDerWaalsContact O-CG1 3.27Å; L650-I654 WeakPolarHBondContact O-CG1 3.33Å; L650-I654 PolarHBondContact O-N 3.48Å; L650-I696 HydrophobicContact CD1-CG2 3.97Å; L650-L700 HydrophobicContact CD1-CD1 4.48Å; L650-L700 HydrophobicContact CD1-CD2 3.56Å; L650-L700 HydrophobicContact CD1-CG 3.81Å; L650-L700 HydrophobicContact CD2-CD2 3.81Å; L650-L700 HydrophobicContact CG-CD2 4.3Å
651	G	90	Very high	90.3	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.07	C	C	.	.	H	α-helix	trans	-62.6	-44.1	-179	0	0	0	0	0	113.1	L647 S655	L647-G651 PolarHBondContact O-N 3.02Å; G651-S655 PolarHBondContact O-N 3.22Å; G651-S655 PolarHBondContact O-OG 3.46Å
652	M	90	Very high	90.2	Very high	2 Å²	2	13.9 Å²	13.9	1%	0.01	7%	0.073	C	C	.	.	H	α-helix	trans	-66.7	-42.1	175.4	-63.8	-64.5	-58.4	0	0	111.4	I625 L650 S655 Y656 W787 M815	I625-M652 HydrophobicContact CD1-CG 4.34Å; I625-M652 HydrophobicContact CD1-SD 3.46Å; I625-M652 WeakPolarHBondContact CD1-SD 3.1Å; I625-M652 HydrophobicContact CG1-CG 4.31Å; I625-M652 HydrophobicContact CG1-SD 3.83Å; I625-M652 HydrophobicContact CG2-SD 4.23Å; L650-M652 PolarHBondContact O-N 3.26Å; M652-S655 PolarHBondContact O-N 2.93Å; M652-Y656 HydrophobicContact CE-CD2 4.19Å; M652-Y656 HydrophobicContact CE-CE2 3.23Å; M652-Y656 WeakPolarHBondContact CE-OH 3.46Å; M652-Y656 WeakPolarHBondContact O-CD2 3.43Å; M652-Y656 PolarHBondContact O-N 3.45Å; M652-W787 HydrophobicContact CE-CZ2 3.59Å; M652-W787 HydrophobicContact SD-CZ2 4.23Å; M652-M815 HydrophobicContact CG-CE 4.47Å
653	C	93.7	Very high	90.1	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-61	-47.8	177.8	178.9	0	0	0	0	112	G649 L650 S655 Y656 A657 Q699 S749	G649-C653 VanDerWaalsContact O-CB 3.24Å; G649-C653 WeakPolarHBondContact O-CB 3.49Å; G649-C653 PolarHBondContact O-N 3.42Å; G649-C653 VanDerWaalsContact O-N 3.07Å; L650-C653 PolarHBondContact O-N 2.96Å; C653-S655 VanDerWaalsContact C-N 3.3Å; C653-S655 PolarHBondContact O-N 2.85Å; C653-Y656 PolarHBondContact O-N 3.49Å; C653-A657 WeakPolarHBondContact O-CB 3.45Å; C653-A657 PolarHBondContact O-N 2.95Å; C653-Q699 HydrophobicContact CB-CB 4.1Å; C653-Q699 HydrophobicContact CB-CG 4.02Å; C653-Q699 VanDerWaalsContact SG-CB 3.59Å; C653-S749 PolarHBondContact N-OG 3.41Å
654	I	93.9	Very high	90	Very high	20 Å²	20	10.9 Å²	10.9	10%	0.103	6%	0.055	C	C	.	.	H	α-helix	trans	-57.6	-45.7	177.2	-68.7	167.6	0	0	0	110.6	V617 L624 L650 A658 I696	V617-I654 HydrophobicContact CG1-CG2 3.8Å; V617-I654 WeakPolarHBondContact O-CG2 3.43Å; L624-I654 HydrophobicContact CD1-CD1 3.88Å; L650-I654 HydrophobicContact CD1-CD1 4.06Å; L650-I654 HydrophobicContact CD1-CG1 4.17Å; L650-I654 HydrophobicContact CG-CD1 3.83Å; L650-I654 HydrophobicContact CG-CG1 4.37Å; L650-I654 VanDerWaalsContact O-CG1 3.27Å; L650-I654 WeakPolarHBondContact O-CG1 3.33Å; L650-I654 PolarHBondContact O-N 3.48Å; I654-A658 WeakPolarHBondContact O-CB 3.25Å; I654-A658 PolarHBondContact O-N 2.7Å; I654-A658 VanDerWaalsContact O-N 3.13Å; I654-I696 HydrophobicContact CB-CD1 4.36Å; I654-I696 HydrophobicContact CG1-CD1 3.93Å; I654-I696 HydrophobicContact CG1-CG1 4.09Å; I654-I696 HydrophobicContact CG1-CG2 4.14Å; I654-I696 HydrophobicContact CG2-CD1 4.38Å
655	S	92.9	Very high	89.8	Confident	4 Å²	4	13.3 Å²	13.3	3%	0.028	6%	0.064	C	C	.	.	H	α-helix	trans	-62.8	-53.3	-179.4	-57	0	0	0	0	111.6	L618 G621 I622 I625 G651 M652 C653 A658 M659	L618-S655 VanDerWaalsContact CD1-O 3.26Å; L618-S655 WeakPolarHBondContact CD1-O 3.47Å; G621-S655 WeakPolarHBondContact CA-OG 3.49Å; I622-S655 PolarHBondContact N-OG 3.37Å; I625-S655 WeakPolarHBondContact CD1-OG 3.49Å; G651-S655 PolarHBondContact O-N 3.22Å; G651-S655 PolarHBondContact O-OG 3.46Å; M652-S655 PolarHBondContact O-N 2.93Å; C653-S655 VanDerWaalsContact C-N 3.3Å; C653-S655 PolarHBondContact O-N 2.85Å; S655-A658 PolarHBondContact O-N 3.47Å; S655-M659 WeakPolarHBondContact O-CB 3.18Å; S655-M659 PolarHBondContact O-N 2.95Å
656	Y	93	Very high	89.6	Confident	4 Å²	4	14.4 Å²	14.4	2%	0.016	7%	0.07	C	C	.	.	H	α-helix	trans	-73.6	-29.5	-178	-66.8	-47.8	0	0	0	113.7	M652 C653 M659 L660 M753 M780 S818	M652-Y656 HydrophobicContact CE-CD2 4.19Å; M652-Y656 HydrophobicContact CE-CE2 3.23Å; M652-Y656 WeakPolarHBondContact CE-OH 3.46Å; M652-Y656 WeakPolarHBondContact O-CD2 3.43Å; M652-Y656 PolarHBondContact O-N 3.45Å; C653-Y656 PolarHBondContact O-N 3.49Å; Y656-M659 PolarHBondContact O-N 3.44Å; Y656-L660 WeakPolarHBondContact O-CB 3.47Å; Y656-L660 PolarHBondContact O-N 3.24Å; Y656-M753 HydrophobicContact CD1-CB 4.41Å; Y656-M753 HydrophobicContact CD2-CB 3.97Å; Y656-M753 HydrophobicContact CE1-CB 4.32Å; Y656-M753 HydrophobicContact CE1-CG 4.07Å; Y656-M753 HydrophobicContact CE2-CB 3.8Å; Y656-M753 HydrophobicContact CE2-CG 4.13Å; Y656-M753 HydrophobicContact CE2-SD 4.35Å; Y656-M753 HydrophobicContact CG-CB 4.26Å; Y656-M780 HydrophobicContact CD1-CE 4.46Å; Y656-M780 HydrophobicContact CE1-CE 4.4Å; Y656-S818 PolarHBondContact OH-OG 3.15Å
657	A	94	Very high	89.3	Confident	0 Å²	0	14.7 Å²	14.7	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-64.4	-43.2	173.3	0	0	0	0	0	111.6	C653 T661 T692 L695 I696 L752	C653-A657 WeakPolarHBondContact O-CB 3.45Å; C653-A657 PolarHBondContact O-N 2.95Å; A657-T661 WeakPolarHBondContact O-CB 3.24Å; A657-T661 PolarHBondContact O-N 3.28Å; A657-T661 PolarHBondContact O-OG1 3.07Å; A657-T692 HydrophobicContact CB-CG2 4.12Å; A657-L695 HydrophobicContact CB-CB 3.89Å; A657-L695 HydrophobicContact CB-CD1 4.33Å; A657-I696 HydrophobicContact CB-CG1 3.98Å; A657-L752 HydrophobicContact CB-CD1 4.44Å
658	A	92.1	Very high	89	Confident	2 Å²	2	16.7 Å²	16.7	2%	0.017	8%	0.075	C	C	.	.	H	α-helix	trans	-65.5	-43.6	175.1	0	0	0	0	0	111.4	V617 L618 I654 S655 T661 K662 T692	V617-A658 HydrophobicContact CB-CB 4.35Å; V617-A658 HydrophobicContact CG1-CB 4.04Å; L618-A658 HydrophobicContact CB-CB 3.97Å; I654-A658 WeakPolarHBondContact O-CB 3.25Å; I654-A658 PolarHBondContact O-N 2.7Å; I654-A658 VanDerWaalsContact O-N 3.13Å; S655-A658 PolarHBondContact O-N 3.47Å; A658-T661 PolarHBondContact O-N 3.32Å; A658-K662 WeakPolarHBondContact O-CB 3.32Å; A658-K662 PolarHBondContact O-N 3Å; A658-T692 HydrophobicContact CB-CG2 4.24Å
659	M	90.7	Very high	88.7	Confident	2 Å²	2	19.8 Å²	19.8	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-66.4	-39.8	178.6	-165.9	169.1	178	0	0	112.8	S655 Y656 K662 T663 I776 T779 M780 L826	S655-M659 WeakPolarHBondContact O-CB 3.18Å; S655-M659 PolarHBondContact O-N 2.95Å; Y656-M659 PolarHBondContact O-N 3.44Å; M659-K662 PolarHBondContact O-N 3.06Å; M659-T663 WeakPolarHBondContact O-CB 3.45Å; M659-T663 PolarHBondContact O-N 2.95Å; M659-T663 PolarHBondContact O-OG1 3.42Å; M659-I776 HydrophobicContact CE-CB 4.36Å; M659-I776 HydrophobicContact CE-CG2 3.8Å; M659-I776 WeakPolarHBondContact CE-O 3.34Å; M659-T779 HydrophobicContact CE-CG2 3.61Å; M659-T779 HydrophobicContact SD-CG2 4.24Å; M659-M780 HydrophobicContact CE-CG 3.53Å; M659-M780 HydrophobicContact CE-SD 3.3Å; M659-M780 WeakPolarHBondContact CE-SD 3.33Å; M659-M780 HydrophobicContact CG-SD 4.2Å; M659-M780 HydrophobicContact SD-CG 4.42Å; M659-M780 HydrophobicContact SD-SD 3.4Å; M659-L826 HydrophobicContact CE-CD1 4.19Å; M659-L826 HydrophobicContact SD-CD1 4.37Å
660	L	91.8	Very high	88.3	Confident	15 Å²	15	22.8 Å²	22.8	8%	0.079	10%	0.104	C	C	.	.	H	α-helix	trans	-64.2	-45.9	174	176.4	61.2	0	0	0	110.9	Y656 K662 T663 N664 L695 L752 T755 C756 Y759	Y656-L660 WeakPolarHBondContact O-CB 3.47Å; Y656-L660 PolarHBondContact O-N 3.24Å; L660-K662 VanDerWaalsContact C-N 3.27Å; L660-K662 PolarHBondContact O-N 3.07Å; L660-T663 PolarHBondContact O-N 3.47Å; L660-N664 WeakPolarHBondContact O-CB 3.27Å; L660-N664 PolarHBondContact O-N 3.46Å; L660-L695 HydrophobicContact CD2-CD1 4.12Å; L660-L752 HydrophobicContact CD2-CD2 3.99Å; L660-T755 HydrophobicContact CD1-CG2 4.01Å; L660-T755 HydrophobicContact CD2-CG2 4.19Å; L660-C756 HydrophobicContact CB-CB 4.15Å; L660-C756 HydrophobicContact CD1-CB 4.07Å; L660-Y759 HydrophobicContact CD1-CD2 3.59Å; L660-Y759 HydrophobicContact CD1-CE2 4.15Å; L660-Y759 HydrophobicContact CD1-CG 4.42Å
661	T	90.7	Very high	87.7	Confident	5 Å²	5	24.3 Å²	24.3	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-60.4	-40.8	177.3	-56.2	0	0	0	0	110.9	L614 A657 A658 R665 Q688 I691 T692	L614-T661 HydrophobicContact CD1-CG2 4.11Å; L614-T661 HydrophobicContact CD2-CG2 4.15Å; A657-T661 WeakPolarHBondContact O-CB 3.24Å; A657-T661 PolarHBondContact O-N 3.28Å; A657-T661 PolarHBondContact O-OG1 3.07Å; A658-T661 PolarHBondContact O-N 3.32Å; T661-R665 WeakPolarHBondContact O-CB 3.42Å; T661-R665 PolarHBondContact O-N 3.24Å; T661-Q688 HydrophobicContact CG2-CB 4Å; T661-Q688 HydrophobicContact CG2-CG 4.28Å; T661-I691 HydrophobicContact CG2-CG2 4.41Å; T661-T692 WeakPolarHBondContact CB-OG1 3.47Å; T661-T692 WeakPolarHBondContact CG2-OG1 3.4Å; T661-T692 PolarHBondContact OG1-OG1 3.21Å
662	K	87.4	Confident	87	Confident	14 Å²	14	27.1 Å²	27.1	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-65.3	-44.2	176.8	-168.1	169.2	-178.1	167.9	0	112.5	S610 L614 A658 M659 L660 R665 I666 E772 I776	S610-K662 WeakPolarHBondContact O-CE 3.47Å; S610-K662 PolarHBondContact O-NZ 3.47Å; S610-K662 PolarHBondContact OG-NZ 2.7Å; L614-K662 HydrophobicContact CD1-CB 4.37Å; A658-K662 WeakPolarHBondContact O-CB 3.32Å; A658-K662 PolarHBondContact O-N 3Å; M659-K662 PolarHBondContact O-N 3.06Å; L660-K662 VanDerWaalsContact C-N 3.27Å; L660-K662 PolarHBondContact O-N 3.07Å; K662-R665 WeakPolarHBondContact O-CB 3.37Å; K662-R665 PolarHBondContact O-N 3.32Å; K662-I666 WeakPolarHBondContact O-CG1 3.49Å; K662-I666 PolarHBondContact O-N 3.4Å; K662-E772 VanDerWaalsContact CE-CD 3.41Å; K662-E772 WeakPolarHBondContact CE-OE1 3.39Å; K662-E772 IonicContact NZ-OE1 2.66Å; K662-E772 PolarHBondContact NZ-OE1 3.38Å; K662-I776 HydrophobicContact CD-CD1 4.43Å; K662-I776 HydrophobicContact CG-CD1 4.38Å
663	T	87.8	Confident	86	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.9	-42	178.5	-51.1	0	0	0	0	111.7	M659 L660 R665 I666 Y667 A760 I776	M659-T663 WeakPolarHBondContact O-CB 3.45Å; M659-T663 PolarHBondContact O-N 2.95Å; M659-T663 PolarHBondContact O-OG1 3.42Å; L660-T663 PolarHBondContact O-N 3.47Å; T663-R665 VanDerWaalsContact C-N 3.32Å; T663-R665 PolarHBondContact O-N 3.24Å; T663-I666 PolarHBondContact O-N 2.92Å; T663-I666 VanDerWaalsContact O-N 3.15Å; T663-Y667 PolarHBondContact O-N 3.29Å; T663-A760 HydrophobicContact CG2-CB 4.23Å; T663-I776 HydrophobicContact CG2-CG2 4.38Å; T663-I776 WeakPolarHBondContact OG1-CG2 3.34Å
664	N	87.1	Confident	85	Confident	42 Å²	42	35.6 Å²	35.6	23%	0.225	17%	0.174	C	C	.	.	H	α-helix	trans	-62.3	-38.8	176.4	-174.1	23.2	0	0	0	111.4	L660 I666 Y667 R668	L660-N664 WeakPolarHBondContact O-CB 3.27Å; L660-N664 PolarHBondContact O-N 3.46Å; N664-I666 PolarHBondContact O-N 3.26Å; N664-Y667 PolarHBondContact O-N 2.94Å; N664-R668 WeakPolarHBondContact O-CB 3.33Å; N664-R668 VanDerWaalsContact O-CG 3.25Å; N664-R668 WeakPolarHBondContact O-CG 3.35Å; N664-R668 PolarHBondContact O-N 3.08Å; N664-R668 WeakPolarHBondContact OD1-CD 3.46Å
665	R	85.1	Confident	83.9	Confident	72 Å²	72	42.7 Å²	42.7	27%	0.272	20%	0.204	S	C	.	.	H	α-helix	trans	-56.8	-49.3	171.7	179.6	-159.2	173.4	-172.3	-11.3	111.4	T661 K662 T663 R668 I669	T661-R665 WeakPolarHBondContact O-CB 3.42Å; T661-R665 PolarHBondContact O-N 3.24Å; K662-R665 WeakPolarHBondContact O-CB 3.37Å; K662-R665 PolarHBondContact O-N 3.32Å; T663-R665 VanDerWaalsContact C-N 3.32Å; T663-R665 PolarHBondContact O-N 3.24Å; R665-R668 PolarHBondContact O-N 3.3Å; R665-I669 HydrophobicContact CG-CD1 3.86Å; R665-I669 VanDerWaalsContact O-CG1 3.27Å; R665-I669 WeakPolarHBondContact O-CG1 3.4Å; R665-I669 PolarHBondContact O-N 3.48Å
666	I	82.8	Confident	82.8	Confident	29 Å²	29	45 Å²	45	15%	0.149	22%	0.221	C	C	.	.	H	α-helix	trans	-60.8	-46.9	179.8	-65.4	169.2	0	0	0	110.3	K662 T663 N664 R668 I669 F670 V766 A773 I776	K662-I666 WeakPolarHBondContact O-CG1 3.49Å; K662-I666 PolarHBondContact O-N 3.4Å; T663-I666 PolarHBondContact O-N 2.92Å; T663-I666 VanDerWaalsContact O-N 3.15Å; N664-I666 PolarHBondContact O-N 3.26Å; I666-R668 PolarHBondContact O-N 3.34Å; I666-I669 PolarHBondContact O-N 3.42Å; I666-F670 PolarHBondContact O-N 3.07Å; I666-F670 VanDerWaalsContact O-N 3.13Å; I666-V766 HydrophobicContact CG2-CG2 4.17Å; I666-A773 HydrophobicContact CG2-CB 4.45Å; I666-I776 HydrophobicContact CD1-CD1 3.91Å
667	Y	82.9	Confident	81.4	Confident	54 Å²	54	50.8 Å²	50.8	21%	0.212	26%	0.256	C	S	.	.	H	α-helix	trans	-58.5	-48.2	177.5	172.9	-109.3	0	0	0	112.4	T663 N664 I669 F670 E671 Y759 K762	T663-Y667 PolarHBondContact O-N 3.29Å; N664-Y667 PolarHBondContact O-N 2.94Å; Y667-I669 PolarHBondContact O-N 3.32Å; Y667-F670 PolarHBondContact O-N 3.41Å; Y667-E671 HydrophobicContact CE2-CB 4.2Å; Y667-E671 HydrophobicContact CE2-CG 4.38Å; Y667-E671 VanDerWaalsContact O-CB 3.29Å; Y667-E671 WeakPolarHBondContact O-CB 3.23Å; Y667-E671 PolarHBondContact O-N 3.19Å; Y667-Y759 AromaticContact CD1-CD1 3.93Å; Y667-Y759 HydrophobicContact CD1-CD1 3.93Å; Y667-Y759 AromaticContact CD1-CE1 3.88Å; Y667-Y759 HydrophobicContact CD1-CE1 3.88Å; Y667-Y759 HydrophobicContact CE1-CD1 4.45Å; Y667-Y759 HydrophobicContact CE1-CE1 4.11Å; Y667-Y759 HydrophobicContact CG-CD1 4.17Å; Y667-K762 HydrophobicContact CD2-CB 3.94Å; Y667-K762 HydrophobicContact CE2-CB 3.93Å; Y667-K762 HydrophobicContact CE2-CD 4.15Å
668	R	81.1	Confident	80.2	Confident	64 Å²	64	54.8 Å²	54.8	24%	0.242	28%	0.28	C	S	.	.	H	α-helix	trans	-65.6	-37.9	-178.5	-69.6	177.8	71.6	-126.6	-8.4	112.8	N664 R665 I666 Q672 P680 K681	N664-R668 WeakPolarHBondContact O-CB 3.33Å; N664-R668 VanDerWaalsContact O-CG 3.25Å; N664-R668 WeakPolarHBondContact O-CG 3.35Å; N664-R668 PolarHBondContact O-N 3.08Å; N664-R668 WeakPolarHBondContact OD1-CD 3.46Å; R665-R668 PolarHBondContact O-N 3.3Å; I666-R668 PolarHBondContact O-N 3.34Å; R668-Q672 VanDerWaalsContact O-CB 3.22Å; R668-Q672 WeakPolarHBondContact O-CB 3.3Å; R668-Q672 PolarHBondContact O-N 2.76Å; R668-Q672 VanDerWaalsContact O-N 3.09Å; R668-P680 WeakPolarHBondContact O-CG 3.26Å; R668-K681 PolarHBondContact NH1-O 3.36Å; R668-K681 PolarHBondContact NH2-O 3.17Å
669	I	80.1	Confident	78.9	Confident	68 Å²	68	59.7 Å²	59.7	35%	0.349	31%	0.312	S	S	.	.	H	α-helix	trans	-62	-46.4	175.1	-70.4	168.5	0	0	0	110.5	R665 I666 Y667 G673 I683	R665-I669 HydrophobicContact CG-CD1 3.86Å; R665-I669 VanDerWaalsContact O-CG1 3.27Å; R665-I669 WeakPolarHBondContact O-CG1 3.4Å; R665-I669 PolarHBondContact O-N 3.48Å; I666-I669 PolarHBondContact O-N 3.42Å; Y667-I669 PolarHBondContact O-N 3.32Å; I669-G673 PolarHBondContact O-N 2.9Å; I669-I683 HydrophobicContact CG1-CD1 4.11Å
670	F	76.5	Confident	77.9	Confident	63 Å²	63	60.3 Å²	60.3	28%	0.276	32%	0.316	S	S	.	.	H	α-helix	trans	-73.1	-43.3	-177.1	-172.1	-109.5	0	0	0	112.7	I666 Y667 G673 K674 G765 V766	I666-F670 PolarHBondContact O-N 3.07Å; I666-F670 VanDerWaalsContact O-N 3.13Å; Y667-F670 PolarHBondContact O-N 3.41Å; F670-G673 PolarHBondContact O-N 2.91Å; F670-K674 PolarHBondContact O-N 3.22Å; F670-G765 WeakPolarHBondContact CZ-O 3.28Å; F670-V766 HydrophobicContact CB-CG2 4.17Å; F670-V766 HydrophobicContact CD1-CG2 4.25Å; F670-V766 HydrophobicContact CD2-CG2 4.07Å; F670-V766 HydrophobicContact CG-CG2 3.91Å
671	E	78.3	Confident	77	Confident	50 Å²	50	67.7 Å²	67.7	23%	0.234	35%	0.348	C	S	.	.	H	α-helix	trans	-70.2	-37.4	-177.4	-170.2	60.6	-162.2	0	0	112.4	Y667 K674	Y667-E671 HydrophobicContact CE2-CB 4.2Å; Y667-E671 HydrophobicContact CE2-CG 4.38Å; Y667-E671 VanDerWaalsContact O-CB 3.29Å; Y667-E671 WeakPolarHBondContact O-CB 3.23Å; Y667-E671 PolarHBondContact O-N 3.19Å; E671-K674 PolarHBondContact O-N 2.99Å; E671-K674 IonicContact OE2-NZ 2.78Å; E671-K674 PolarHBondContact OE2-NZ 3.34Å
672	Q	74.6	Confident	76.2	Confident	60 Å²	60	74 Å²	74	28%	0.28	38%	0.375	S	S	.	.	H	α-helix	trans	-72.8	-33.7	172.5	-169.1	155.3	-22	0	0	111.7	R668 K674 K675 S676 T678 P680	R668-Q672 VanDerWaalsContact O-CB 3.22Å; R668-Q672 WeakPolarHBondContact O-CB 3.3Å; R668-Q672 PolarHBondContact O-N 2.76Å; R668-Q672 VanDerWaalsContact O-N 3.09Å; Q672-K674 PolarHBondContact O-N 3.23Å; Q672-K675 PolarHBondContact O-N 3.02Å; Q672-S676 PolarHBondContact O-N 3.5Å; Q672-T678 PolarHBondContact NE2-O 3.38Å; Q672-T678 VanDerWaalsContact NE2-O 3.14Å; Q672-P680 HydrophobicContact CB-CG 3.73Å; Q672-P680 VanDerWaalsContact CD-CA 3.47Å; Q672-P680 HydrophobicContact CG-CG 4.1Å
673	G	69.6	Low	75.7	Confident	50 Å²	50	75.5 Å²	75.5	52%	0.515	38%	0.383	S	S	.	.	H	α-helix	trans	-61.3	-22.3	173.5	0	0	0	0	0	114.3	I669 F670	I669-G673 PolarHBondContact O-N 2.9Å; F670-G673 PolarHBondContact O-N 2.91Å
674	K	72.9	Confident	75.3	Confident	130 Å²	130	78.3 Å²	78.3	57%	0.565	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-24.3	169.9	-65.8	174.7	-169.5	162.4	0	113.6	F670 E671 Q672	F670-K674 PolarHBondContact O-N 3.22Å; E671-K674 PolarHBondContact O-N 2.99Å; E671-K674 IonicContact OE2-NZ 2.78Å; E671-K674 PolarHBondContact OE2-NZ 3.34Å; Q672-K674 PolarHBondContact O-N 3.23Å
675	K	70.9	Confident	75	Confident	169 Å²	169	80 Å²	80	74%	0.735	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.4	-30.1	-170.9	-64.1	-177.2	-177.2	-179.6	0	113.8	Q672	Q672-K675 PolarHBondContact O-N 3.02Å
676	S	69.4	Low	74.9	Confident	53 Å²	53	81.1 Å²	81.1	37%	0.371	43%	0.431	S	S	.	.			trans	-159.4	155.3	-177.2	177.7	0	0	0	0	112.5	Q672 T678	Q672-S676 PolarHBondContact O-N 3.5Å; S676-T678 VanDerWaalsContact C-N 3.34Å; S676-T678 PolarHBondContact OG-N 3.43Å; S676-T678 PolarHBondContact OG-OG1 3.47Å
677	V	64.6	Low	75.1	Confident	124 Å²	124	80.7 Å²	80.7	75%	0.752	43%	0.431	S	S	*	.	S	Bend	trans	-82.8	-9.8	176.3	-170.7	0	0	0	0	112.2	F849	V677-F849 HydrophobicContact CG1-CD1 4.36Å; V677-F849 HydrophobicContact CG1-CE1 4.21Å
678	T	68.9	Low	75.2	Confident	84 Å²	84	78.5 Å²	78.5	52%	0.515	42%	0.422	S	S	.	.	S	Bend	trans	-77.5	135.9	177.4	55	0	0	0	0	112	Q672 S676	Q672-T678 PolarHBondContact NE2-O 3.38Å; Q672-T678 VanDerWaalsContact NE2-O 3.14Å; S676-T678 VanDerWaalsContact C-N 3.34Å; S676-T678 PolarHBondContact OG-N 3.43Å; S676-T678 PolarHBondContact OG-OG1 3.47Å
679	P	63.1	Low	75.6	Confident	106 Å²	106	78.2 Å²	78.2	69%	0.688	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-63.7	139.5	179.5	26.1	-33.5	0	0	0	111.8	I683	P679-I683 HydrophobicContact CB-CD1 4.3Å
680	P	69.8	Low	76.1	Confident	15 Å²	15	79.9 Å²	79.9	10%	0.097	43%	0.434	C	S	.	.	P	Polyproline II helix	trans	-53.2	147	170.8	-15.5	12.8	0	0	0	114.4	R668 Q672 I683	R668-P680 WeakPolarHBondContact O-CG 3.26Å; Q672-P680 HydrophobicContact CB-CG 3.73Å; Q672-P680 VanDerWaalsContact CD-CA 3.47Å; Q672-P680 HydrophobicContact CG-CG 4.1Å; P680-I683 HydrophobicContact CB-CD1 3.72Å; P680-I683 HydrophobicContact CB-CG1 4.09Å; P680-I683 VanDerWaalsContact CD-CD1 3.46Å; P680-I683 HydrophobicContact CG-CD1 3.58Å; P680-I683 HydrophobicContact CG-CG1 4.36Å; P680-I683 VanDerWaalsContact O-CD1 3.22Å; P680-I683 WeakPolarHBondContact O-CD1 3.38Å; P680-I683 WeakPolarHBondContact O-CG1 3.45Å
681	K	73.1	Confident	76.7	Confident	170 Å²	170	79.5 Å²	79.5	74%	0.739	43%	0.434	S	S	*	.	S	Bend	trans	-60.4	154.7	168.2	-62.5	-176.2	179.3	-179	0	110	R668	R668-K681 PolarHBondContact NH1-O 3.36Å; R668-K681 PolarHBondContact NH2-O 3.17Å
682	F	73.9	Confident	77.3	Confident	138 Å²	138	77.2 Å²	77.2	61%	0.605	42%	0.424	S	S	*	.	S	Bend	trans	62.9	39.8	176.9	-41.6	-64.3	0	0	0	117	S687 I691	F682-S687 VanDerWaalsContact C-OG 3.27Å; F682-S687 WeakPolarHBondContact CA-OG 3.46Å; F682-I691 HydrophobicContact CB-CD1 4.48Å
683	I	76.7	Confident	78.2	Confident	45 Å²	45	80.8 Å²	80.8	23%	0.231	44%	0.438	C	S	.	.			trans	-97.6	-12.1	171.7	-62	171.5	0	0	0	112.2	I669 P679 P680 Q688	I669-I683 HydrophobicContact CG1-CD1 4.11Å; P679-I683 HydrophobicContact CB-CD1 4.3Å; P680-I683 HydrophobicContact CB-CD1 3.72Å; P680-I683 HydrophobicContact CB-CG1 4.09Å; P680-I683 VanDerWaalsContact CD-CD1 3.46Å; P680-I683 HydrophobicContact CG-CD1 3.58Å; P680-I683 HydrophobicContact CG-CG1 4.36Å; P680-I683 VanDerWaalsContact O-CD1 3.22Å; P680-I683 WeakPolarHBondContact O-CD1 3.38Å; P680-I683 WeakPolarHBondContact O-CG1 3.45Å; I683-Q688 PolarHBondContact O-NE2 3.46Å
684	S	80.9	Confident	79.3	Confident	58 Å²	58	83.3 Å²	83.3	41%	0.406	44%	0.439	S	S	.	.	S	Bend	trans	-60.9	140.8	179.3	-178.9	0	0	0	0	111.1	T686 S687 Q688	S684-T686 PolarHBondContact O-N 3.18Å; S684-T686 PolarHBondContact OG-N 3.29Å; S684-T686 PolarHBondContact OG-OG1 3.04Å; S684-S687 PolarHBondContact N-OG 3.43Å; S684-S687 PolarHBondContact O-N 3.03Å; S684-S687 PolarHBondContact O-OG 3.33Å; S684-Q688 PolarHBondContact O-N 3.24Å
685	P	80.2	Confident	80.3	Confident	78 Å²	78	79 Å²	79	51%	0.506	42%	0.422	S	S	.	.	H	α-helix	trans	-50.7	-38.1	172.7	-27.4	35	0	0	0	113.1	Q688 L689	P685-Q688 PolarHBondContact O-N 3.43Å; P685-L689 PolarHBondContact O-N 3.46Å
686	T	83.3	Confident	81.4	Confident	95 Å²	95	71.7 Å²	71.7	58%	0.583	39%	0.391	S	S	*	.	H	α-helix	trans	-63.4	-45.5	176.7	51.1	0	0	0	0	112.4	S684 Q688 L689 I690	S684-T686 PolarHBondContact O-N 3.18Å; S684-T686 PolarHBondContact OG-N 3.29Å; S684-T686 PolarHBondContact OG-OG1 3.04Å; T686-Q688 VanDerWaalsContact C-N 3.3Å; T686-Q688 PolarHBondContact O-N 3.47Å; T686-L689 PolarHBondContact O-N 3.43Å; T686-I690 VanDerWaalsContact O-CG1 3.32Å; T686-I690 WeakPolarHBondContact O-CG1 3.46Å; T686-I690 PolarHBondContact O-N 3.24Å; T686-I690 VanDerWaalsContact O-N 3.12Å
687	S	85.5	Confident	82.5	Confident	20 Å²	20	71.2 Å²	71.2	14%	0.14	39%	0.388	C	S	.	.	H	α-helix	trans	-66.5	-30	176.6	57.1	0	0	0	0	113.3	F682 S684 I691	F682-S687 VanDerWaalsContact C-OG 3.27Å; F682-S687 WeakPolarHBondContact CA-OG 3.46Å; S684-S687 PolarHBondContact N-OG 3.43Å; S684-S687 PolarHBondContact O-N 3.03Å; S684-S687 PolarHBondContact O-OG 3.33Å; S687-I691 WeakPolarHBondContact O-CD1 3.25Å; S687-I691 VanDerWaalsContact O-CG1 3.29Å; S687-I691 WeakPolarHBondContact O-CG1 3.48Å; S687-I691 PolarHBondContact O-N 3.03Å; S687-I691 VanDerWaalsContact O-N 3.17Å
688	Q	86.4	Confident	83.8	Confident	8 Å²	8	69 Å²	69	4%	0.037	37%	0.374	C	S	.	.	H	α-helix	trans	-70.9	-44.5	176.5	-72.4	168.6	13.7	0	0	111.6	L614 T661 I683 S684 P685 T686 I690 I691 T692	L614-Q688 HydrophobicContact CD1-CB 4.06Å; L614-Q688 HydrophobicContact CD1-CG 4.43Å; L614-Q688 HydrophobicContact CD2-CB 4.3Å; L614-Q688 HydrophobicContact CG-CB 4.33Å; T661-Q688 HydrophobicContact CG2-CB 4Å; T661-Q688 HydrophobicContact CG2-CG 4.28Å; I683-Q688 PolarHBondContact O-NE2 3.46Å; S684-Q688 PolarHBondContact O-N 3.24Å; P685-Q688 PolarHBondContact O-N 3.43Å; T686-Q688 VanDerWaalsContact C-N 3.3Å; T686-Q688 PolarHBondContact O-N 3.47Å; Q688-I690 VanDerWaalsContact C-N 3.31Å; Q688-I690 PolarHBondContact O-N 3.41Å; Q688-I691 PolarHBondContact O-N 3.05Å; Q688-T692 PolarHBondContact O-N 3.44Å; Q688-T692 PolarHBondContact O-OG1 3.24Å; Q688-T692 VanDerWaalsContact O-OG1 3.05Å
689	L	88.7	Confident	84.8	Confident	59 Å²	59	65.7 Å²	65.7	31%	0.309	35%	0.353	S	S	.	.	H	α-helix	trans	-60.9	-40.7	175.1	-73.7	177.1	0	0	0	112.1	E613 L614 V617 P685 T686 T692 F693	E613-L689 HydrophobicContact CB-CD1 3.94Å; E613-L689 HydrophobicContact CB-CD2 3.98Å; E613-L689 HydrophobicContact CB-CG 4.1Å; E613-L689 HydrophobicContact CG-CD1 4.25Å; L614-L689 HydrophobicContact CD2-CD2 4.39Å; V617-L689 HydrophobicContact CG2-CD2 3.9Å; P685-L689 PolarHBondContact O-N 3.46Å; T686-L689 PolarHBondContact O-N 3.43Å; L689-T692 PolarHBondContact O-N 2.94Å; L689-F693 WeakPolarHBondContact O-CB 3.5Å; L689-F693 PolarHBondContact O-N 3.4Å
690	I	90.5	Very high	86.2	Confident	103 Å²	103	62.8 Å²	62.8	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-61.3	-46	176.3	-67.2	165.8	0	0	0	110.9	T686 Q688 T692 F693 I694	T686-I690 VanDerWaalsContact O-CG1 3.32Å; T686-I690 WeakPolarHBondContact O-CG1 3.46Å; T686-I690 PolarHBondContact O-N 3.24Å; T686-I690 VanDerWaalsContact O-N 3.12Å; Q688-I690 VanDerWaalsContact C-N 3.31Å; Q688-I690 PolarHBondContact O-N 3.41Å; I690-T692 PolarHBondContact O-N 3.4Å; I690-F693 PolarHBondContact O-N 2.93Å; I690-I694 HydrophobicContact CG2-CD1 3.86Å; I690-I694 HydrophobicContact CG2-CG1 4.47Å; I690-I694 VanDerWaalsContact O-CG1 3.28Å; I690-I694 WeakPolarHBondContact O-CG1 3.5Å; I690-I694 PolarHBondContact O-N 3.49Å
691	I	89.4	Confident	87.2	Confident	55 Å²	55	67.6 Å²	67.6	28%	0.282	36%	0.356	S	S	.	.	H	α-helix	trans	-60.9	-45.2	177.1	-68	164.7	0	0	0	110.9	T661 F682 S687 Q688 F693 I694 L695	T661-I691 HydrophobicContact CG2-CG2 4.41Å; F682-I691 HydrophobicContact CB-CD1 4.48Å; S687-I691 WeakPolarHBondContact O-CD1 3.25Å; S687-I691 VanDerWaalsContact O-CG1 3.29Å; S687-I691 WeakPolarHBondContact O-CG1 3.48Å; S687-I691 PolarHBondContact O-N 3.03Å; S687-I691 VanDerWaalsContact O-N 3.17Å; Q688-I691 PolarHBondContact O-N 3.05Å; I691-F693 VanDerWaalsContact C-N 3.35Å; I691-F693 PolarHBondContact O-N 3.19Å; I691-I694 PolarHBondContact O-N 3.34Å; I691-L695 HydrophobicContact CG2-CD1 4.38Å; I691-L695 WeakPolarHBondContact O-CG 3.48Å; I691-L695 PolarHBondContact O-N 3.09Å; I691-L695 VanDerWaalsContact O-N 3.12Å
692	T	91.4	Very high	88	Confident	2 Å²	2	61.5 Å²	61.5	1%	0.012	34%	0.341	C	S	.	.	H	α-helix	trans	-62.4	-41.9	177.4	-56	0	0	0	0	111.6	L614 V617 A657 A658 T661 Q688 L689 I690 L695 I696	L614-T692 WeakPolarHBondContact CD2-OG1 3.45Å; V617-T692 HydrophobicContact CG1-CG2 4.07Å; A657-T692 HydrophobicContact CB-CG2 4.12Å; A658-T692 HydrophobicContact CB-CG2 4.24Å; T661-T692 WeakPolarHBondContact CB-OG1 3.47Å; T661-T692 WeakPolarHBondContact CG2-OG1 3.4Å; T661-T692 PolarHBondContact OG1-OG1 3.21Å; Q688-T692 PolarHBondContact O-N 3.44Å; Q688-T692 PolarHBondContact O-OG1 3.24Å; Q688-T692 VanDerWaalsContact O-OG1 3.05Å; L689-T692 PolarHBondContact O-N 2.94Å; I690-T692 PolarHBondContact O-N 3.4Å; T692-L695 PolarHBondContact O-N 2.95Å; T692-I696 HydrophobicContact CG2-CD1 3.81Å; T692-I696 WeakPolarHBondContact O-CD1 3.49Å; T692-I696 VanDerWaalsContact O-CG1 3.29Å; T692-I696 WeakPolarHBondContact O-CG1 3.33Å; T692-I696 PolarHBondContact O-N 2.91Å
693	F	91.9	Very high	88.7	Confident	134 Å²	134	55.1 Å²	55.1	59%	0.588	31%	0.313	S	S	*	.	H	α-helix	trans	-66.3	-38.1	178.3	-168.7	-94.6	0	0	0	112.5	L689 I690 I691 I696 S697	L689-F693 WeakPolarHBondContact O-CB 3.5Å; L689-F693 PolarHBondContact O-N 3.4Å; I690-F693 PolarHBondContact O-N 2.93Å; I691-F693 VanDerWaalsContact C-N 3.35Å; I691-F693 PolarHBondContact O-N 3.19Å; F693-I696 PolarHBondContact O-N 3.38Å; F693-S697 WeakPolarHBondContact CE1-OG 3.43Å; F693-S697 WeakPolarHBondContact O-CB 3.5Å; F693-S697 PolarHBondContact O-N 3.19Å; F693-S697 PolarHBondContact O-OG 2.99Å
694	I	93.5	Very high	89.3	Confident	103 Å²	103	59.1 Å²	59.1	53%	0.528	33%	0.329	S	S	.	.	H	α-helix	trans	-60.7	-46.1	173.9	-69.8	165.3	0	0	0	110.4	I690 I691 I696 S697 V698	I690-I694 HydrophobicContact CG2-CD1 3.86Å; I690-I694 HydrophobicContact CG2-CG1 4.47Å; I690-I694 VanDerWaalsContact O-CG1 3.28Å; I690-I694 WeakPolarHBondContact O-CG1 3.5Å; I690-I694 PolarHBondContact O-N 3.49Å; I691-I694 PolarHBondContact O-N 3.34Å; I694-I696 PolarHBondContact O-N 3.49Å; I694-S697 PolarHBondContact O-N 3.46Å; I694-V698 PolarHBondContact O-N 2.9Å
695	L	93.2	Very high	89.7	Confident	39 Å²	39	60.5 Å²	60.5	20%	0.204	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-40.4	177.5	-67.1	172.9	0	0	0	112.2	A657 L660 I691 T692 Y748 L752	A657-L695 HydrophobicContact CB-CB 3.89Å; A657-L695 HydrophobicContact CB-CD1 4.33Å; L660-L695 HydrophobicContact CD2-CD1 4.12Å; I691-L695 HydrophobicContact CG2-CD1 4.38Å; I691-L695 WeakPolarHBondContact O-CG 3.48Å; I691-L695 PolarHBondContact O-N 3.09Å; I691-L695 VanDerWaalsContact O-N 3.12Å; T692-L695 PolarHBondContact O-N 2.95Å; L695-Y748 WeakPolarHBondContact O-CE1 3.34Å; L695-Y748 PolarHBondContact O-OH 3Å; L695-Y748 VanDerWaalsContact O-OH 3.05Å; L695-L752 HydrophobicContact CD2-CD2 4.36Å
696	I	94.3	Very high	90	Very high	17 Å²	17	58.9 Å²	58.9	9%	0.087	32%	0.319	C	S	.	.	H	α-helix	trans	-67.2	-37.7	176.4	-66.4	162	0	0	0	111.5	V617 L650 I654 A657 T692 F693 I694 V698 Q699 L700	V617-I696 HydrophobicContact CG1-CD1 4.48Å; L650-I696 HydrophobicContact CD1-CG2 3.97Å; I654-I696 HydrophobicContact CB-CD1 4.36Å; I654-I696 HydrophobicContact CG1-CD1 3.93Å; I654-I696 HydrophobicContact CG1-CG1 4.09Å; I654-I696 HydrophobicContact CG1-CG2 4.14Å; I654-I696 HydrophobicContact CG2-CD1 4.38Å; A657-I696 HydrophobicContact CB-CG1 3.98Å; T692-I696 HydrophobicContact CG2-CD1 3.81Å; T692-I696 WeakPolarHBondContact O-CD1 3.49Å; T692-I696 VanDerWaalsContact O-CG1 3.29Å; T692-I696 WeakPolarHBondContact O-CG1 3.33Å; T692-I696 PolarHBondContact O-N 2.91Å; F693-I696 PolarHBondContact O-N 3.38Å; I694-I696 PolarHBondContact O-N 3.49Å; I696-V698 PolarHBondContact O-N 3.21Å; I696-Q699 PolarHBondContact O-N 2.79Å; I696-Q699 VanDerWaalsContact O-N 3.15Å; I696-L700 HydrophobicContact CG2-CD1 4.01Å; I696-L700 HydrophobicContact CG2-CG 4.34Å; I696-L700 PolarHBondContact O-N 2.9Å; I696-L700 VanDerWaalsContact O-N 3.14Å
697	S	92.3	Very high	90.2	Very high	43 Å²	43	56.4 Å²	56.4	30%	0.301	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-30.5	-177.9	-61.9	0	0	0	0	112.7	F693 I694 L700 L701	F693-S697 WeakPolarHBondContact CE1-OG 3.43Å; F693-S697 WeakPolarHBondContact O-CB 3.5Å; F693-S697 PolarHBondContact O-N 3.19Å; F693-S697 PolarHBondContact O-OG 2.99Å; I694-S697 PolarHBondContact O-N 3.46Å; S697-L700 PolarHBondContact O-N 2.72Å; S697-L701 WeakPolarHBondContact O-CB 3.46Å; S697-L701 PolarHBondContact O-N 3.21Å
698	V	92	Very high	90.2	Very high	77 Å²	77	58.8 Å²	58.8	47%	0.467	33%	0.328	S	S	.	.	H	α-helix	trans	-62.2	-45.4	175.6	176.9	0	0	0	0	111.2	I694 I696 G702 Y748	I694-V698 PolarHBondContact O-N 2.9Å; I696-V698 PolarHBondContact O-N 3.21Å; V698-G702 PolarHBondContact O-N 3.45Å; V698-G702 VanDerWaalsContact O-N 3.17Å; V698-Y748 HydrophobicContact CB-CE1 4.23Å; V698-Y748 HydrophobicContact CB-CE2 4.42Å; V698-Y748 HydrophobicContact CG1-CD2 4.41Å; V698-Y748 HydrophobicContact CG1-CE1 4.32Å; V698-Y748 HydrophobicContact CG1-CE2 3.88Å
699	Q	91.5	Very high	90.3	Very high	14 Å²	14	63.7 Å²	63.7	7%	0.065	36%	0.358	C	S	.	.	H	α-helix	trans	-66.4	-43	176.8	-176.7	67.7	33.3	0	0	111.4	C653 I696 G702 V703 C745 Y748	C653-Q699 HydrophobicContact CB-CB 4.1Å; C653-Q699 HydrophobicContact CB-CG 4.02Å; C653-Q699 VanDerWaalsContact SG-CB 3.59Å; I696-Q699 PolarHBondContact O-N 2.79Å; I696-Q699 VanDerWaalsContact O-N 3.15Å; Q699-G702 PolarHBondContact O-N 2.9Å; Q699-V703 WeakPolarHBondContact O-CG2 3.3Å; Q699-V703 PolarHBondContact O-N 3.46Å; Q699-C745 PolarHBondContact NE2-O 2.9Å; Q699-Y748 HydrophobicContact CB-CD1 3.94Å; Q699-Y748 HydrophobicContact CB-CE1 4.15Å; Q699-Y748 VanDerWaalsContact OE1-CB 3.31Å; Q699-Y748 VanDerWaalsContact OE1-CD1 3.23Å
700	L	90.9	Very high	90.1	Very high	45 Å²	45	63.3 Å²	63.3	24%	0.236	36%	0.358	C	S	.	.	H	α-helix	trans	-61	-46	179	-75.3	173.2	0	0	0	111.7	L646 L650 I696 S697 G702 V703 F704	L646-L700 HydrophobicContact CD1-CD2 4.43Å; L650-L700 HydrophobicContact CD1-CD1 4.48Å; L650-L700 HydrophobicContact CD1-CD2 3.56Å; L650-L700 HydrophobicContact CD1-CG 3.81Å; L650-L700 HydrophobicContact CD2-CD2 3.81Å; L650-L700 HydrophobicContact CG-CD2 4.3Å; I696-L700 HydrophobicContact CG2-CD1 4.01Å; I696-L700 HydrophobicContact CG2-CG 4.34Å; I696-L700 PolarHBondContact O-N 2.9Å; I696-L700 VanDerWaalsContact O-N 3.14Å; S697-L700 PolarHBondContact O-N 2.72Å; L700-G702 VanDerWaalsContact C-N 3.32Å; L700-G702 PolarHBondContact O-N 2.93Å; L700-V703 PolarHBondContact O-N 2.86Å; L700-F704 HydrophobicContact CB-CE2 4.44Å; L700-F704 WeakPolarHBondContact O-CD2 3.33Å; L700-F704 PolarHBondContact O-N 3.46Å
701	L	91.6	Very high	89.9	Confident	117 Å²	117	62.3 Å²	62.3	61%	0.613	36%	0.358	S	S	*	.	H	α-helix	trans	-59	-44.1	176.9	-176.2	66	0	0	0	111.3	S697 V703 F704 V705	S697-L701 WeakPolarHBondContact O-CB 3.46Å; S697-L701 PolarHBondContact O-N 3.21Å; L701-V703 PolarHBondContact O-N 2.97Å; L701-F704 PolarHBondContact O-N 2.7Å; L701-V705 VanDerWaalsContact O-CG2 3.32Å; L701-V705 WeakPolarHBondContact O-CG2 3.32Å; L701-V705 PolarHBondContact O-N 2.92Å
702	G	89	Confident	89.7	Confident	42 Å²	42	60.9 Å²	60.9	43%	0.433	35%	0.352	S	S	.	.	H	α-helix	trans	-59.2	-42.9	176.7	0	0	0	0	0	113.3	V698 Q699 L700 W706	V698-G702 PolarHBondContact O-N 3.45Å; V698-G702 VanDerWaalsContact O-N 3.17Å; Q699-G702 PolarHBondContact O-N 2.9Å; L700-G702 VanDerWaalsContact C-N 3.32Å; L700-G702 PolarHBondContact O-N 2.93Å; G702-W706 WeakPolarHBondContact O-CB 3.1Å; G702-W706 PolarHBondContact O-N 3.25Å; G702-W706 VanDerWaalsContact O-N 3.07Å
703	V	88.4	Confident	89.4	Confident	4 Å²	4	64.5 Å²	64.5	2%	0.024	37%	0.369	C	S	.	.	H	α-helix	trans	-67.1	-41.5	177.3	174.8	0	0	0	0	111.7	L646 Q699 L700 L701 W706 F707	L646-V703 HydrophobicContact CD1-CG1 4.04Å; Q699-V703 WeakPolarHBondContact O-CG2 3.3Å; Q699-V703 PolarHBondContact O-N 3.46Å; L700-V703 PolarHBondContact O-N 2.86Å; L701-V703 PolarHBondContact O-N 2.97Å; V703-W706 WeakPolarHBondContact O-CB 3.49Å; V703-W706 PolarHBondContact O-N 3.4Å; V703-F707 HydrophobicContact CG1-CD1 4.46Å; V703-F707 HydrophobicContact CG1-CE1 3.97Å; V703-F707 HydrophobicContact CG1-CE2 4.19Å; V703-F707 HydrophobicContact CG1-CZ 3.83Å; V703-F707 PolarHBondContact O-N 2.86Å
704	F	89.3	Confident	89.3	Confident	128 Å²	128	60.8 Å²	60.8	56%	0.561	36%	0.358	S	S	*	.	H	α-helix	trans	-67.5	-39.5	178.2	-77.2	-62.9	0	0	0	112.9	L700 L701 W706 F707 G708	L700-F704 HydrophobicContact CB-CE2 4.44Å; L700-F704 WeakPolarHBondContact O-CD2 3.33Å; L700-F704 PolarHBondContact O-N 3.46Å; L701-F704 PolarHBondContact O-N 2.7Å; F704-W706 VanDerWaalsContact C-N 3.27Å; F704-W706 PolarHBondContact O-N 3.17Å; F704-F707 HydrophobicContact CD1-CD2 4.3Å; F704-F707 PolarHBondContact O-N 3.29Å; F704-G708 PolarHBondContact O-N 3.28Å
705	V	89.8	Confident	88.9	Confident	88 Å²	88	58 Å²	58	53%	0.533	35%	0.345	S	S	.	.	H	α-helix	trans	-59.4	-43.3	171.8	170.3	0	0	0	0	110	L701 F707 G708 V709	L701-V705 VanDerWaalsContact O-CG2 3.32Å; L701-V705 WeakPolarHBondContact O-CG2 3.32Å; L701-V705 PolarHBondContact O-N 2.92Å; V705-F707 PolarHBondContact O-N 3.43Å; V705-G708 PolarHBondContact O-N 3.14Å; V705-G708 VanDerWaalsContact O-N 3.13Å; V705-V709 WeakPolarHBondContact O-CG2 3.44Å; V705-V709 PolarHBondContact O-N 3.33Å; V705-V709 VanDerWaalsContact O-N 3.12Å
706	W	86.6	Confident	88.5	Confident	44 Å²	44	59.3 Å²	59.3	17%	0.167	35%	0.352	C	S	.	.	H	α-helix	trans	-63.5	-40	177.5	-175.7	6.1	0	0	0	112.5	G702 V703 F704 G708 V709 V710 M737 S741 C745	G702-W706 WeakPolarHBondContact O-CB 3.1Å; G702-W706 PolarHBondContact O-N 3.25Å; G702-W706 VanDerWaalsContact O-N 3.07Å; V703-W706 WeakPolarHBondContact O-CB 3.49Å; V703-W706 PolarHBondContact O-N 3.4Å; F704-W706 VanDerWaalsContact C-N 3.27Å; F704-W706 PolarHBondContact O-N 3.17Å; W706-G708 PolarHBondContact O-N 3.15Å; W706-V709 PolarHBondContact O-N 3.47Å; W706-V710 PolarHBondContact O-N 3Å; W706-M737 HydrophobicContact CH2-CE 3.96Å; W706-S741 WeakPolarHBondContact CH2-O 3.47Å; W706-S741 WeakPolarHBondContact CZ3-O 3.47Å; W706-C745 HydrophobicContact CH2-CB 4.28Å; W706-C745 HydrophobicContact CZ3-CB 3.75Å; W706-C745 WeakPolarHBondContact CZ3-SG 3.37Å
707	F	88.3	Confident	87.8	Confident	42 Å²	42	60 Å²	60	18%	0.184	36%	0.356	C	S	.	.	H	α-helix	trans	-59	-34.4	172.7	-71.7	-7.4	0	0	0	113.4	T642 R645 L646 V703 F704 V705	T642-F707 HydrophobicContact CG2-CE2 4.03Å; T642-F707 HydrophobicContact CG2-CZ 3.88Å; R645-F707 HydrophobicContact CB-CE1 3.76Å; R645-F707 HydrophobicContact CB-CZ 4.32Å; L646-F707 HydrophobicContact CB-CZ 4.33Å; V703-F707 HydrophobicContact CG1-CD1 4.46Å; V703-F707 HydrophobicContact CG1-CE1 3.97Å; V703-F707 HydrophobicContact CG1-CE2 4.19Å; V703-F707 HydrophobicContact CG1-CZ 3.83Å; V703-F707 PolarHBondContact O-N 2.86Å; F704-F707 HydrophobicContact CD1-CD2 4.3Å; F704-F707 PolarHBondContact O-N 3.29Å; V705-F707 PolarHBondContact O-N 3.43Å
708	G	85.5	Confident	87	Confident	70 Å²	70	60.1 Å²	60.1	72%	0.722	35%	0.35	S	S	*	.	H	α-helix	trans	-71	-35.9	176.1	0	0	0	0	0	113.9	F704 V705 W706	F704-G708 PolarHBondContact O-N 3.28Å; V705-G708 PolarHBondContact O-N 3.14Å; V705-G708 VanDerWaalsContact O-N 3.13Å; W706-G708 PolarHBondContact O-N 3.15Å
709	V	88	Confident	85.9	Confident	112 Å²	112	61.8 Å²	61.8	68%	0.679	36%	0.356	S	S	*	.	H	α-helix	trans	-81.5	-43.4	-179.1	-179	0	0	0	0	111.9	V705 W706	V705-V709 WeakPolarHBondContact O-CG2 3.44Å; V705-V709 PolarHBondContact O-N 3.33Å; V705-V709 VanDerWaalsContact O-N 3.12Å; W706-V709 PolarHBondContact O-N 3.47Å
710	V	84.5	Confident	84.7	Confident	50 Å²	50	65.1 Å²	65.1	30%	0.303	37%	0.372	S	S	.	.	S	Bend	trans	-132.8	100.8	-178.2	-174.8	0	0	0	0	109.2	R645 W706	R645-V710 PolarHBondContact NH1-O 3.17Å; W706-V710 PolarHBondContact O-N 3Å
711	P	86.1	Confident	83.6	Confident	83 Å²	83	64.7 Å²	64.7	54%	0.539	37%	0.37	S	S	.	.			trans	-64.6	138.8	178.7	25.9	-33	0	0	0	111	H713	P711-H713 PolarHBondContact O-N 3.32Å; P711-H713 PolarHBondContact O-ND1 2.7Å; P711-H713 VanDerWaalsContact O-ND1 3.17Å
712	P	85.5	Confident	82.7	Confident	24 Å²	24	62.9 Å²	62.9	16%	0.156	36%	0.357	C	S	.	.			trans	-68.6	115.6	178.5	27	-32.5	0	0	0	110.7	C641 T642	C641-P712 HydrophobicContact CB-CB 4.23Å; T642-P712 HydrophobicContact CG2-CG 4.3Å; T642-P712 WeakPolarHBondContact OG1-CG 3.3Å
713	H	86.1	Confident	82.1	Confident	79 Å²	79	62.8 Å²	62.8	37%	0.366	35%	0.348	S	S	.	.			trans	-136.7	169.9	175.4	68.5	-78.1	0	0	0	111	P711 T715 D736	P711-H713 PolarHBondContact O-N 3.32Å; P711-H713 PolarHBondContact O-ND1 2.7Å; P711-H713 VanDerWaalsContact O-ND1 3.17Å; H713-T715 WeakPolarHBondContact NE2-CG2 3.45Å; H713-D736 IonicContact CE1-OD2 3.59Å; H713-D736 PolarHBondContact CE1-OD2 3.33Å; H713-D736 IonicContact ND1-OD2 3.99Å; H713-D736 IonicContact NE2-OD2 2.91Å; H713-D736 PolarHBondContact O-N 3.3Å
714	T	88.6	Confident	81.5	Confident	56 Å²	56	68.5 Å²	68.5	34%	0.344	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	138.9	178	50.3	0	0	0	0	110.1	P636 K734	P636-T714 HydrophobicContact CB-CG2 4.04Å; T714-K734 WeakPolarHBondContact CA-O 3.41Å
715	T	85.5	Confident	81.1	Confident	43 Å²	43	66 Å²	66	26%	0.264	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.6	176.1	49.5	0	0	0	0	110.1	H713 K734 D736	H713-T715 WeakPolarHBondContact NE2-CG2 3.45Å; T715-K734 PolarHBondContact N-O 2.98Å; T715-K734 PolarHBondContact O-N 2.82Å; T715-D736 HydrophobicContact CG2-CB 3.91Å
716	I	84.2	Confident	80.7	Confident	68 Å²	68	62.2 Å²	62.2	35%	0.349	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	122.4	173	-56.1	161.7	0	0	0	107	I567 Y718 I732 L733	I567-I716 HydrophobicContact CD1-CD1 3.73Å; I567-I716 HydrophobicContact CG1-CG2 4.39Å; I716-Y718 HydrophobicContact CB-CE2 4Å; I716-Y718 HydrophobicContact CG2-CD1 4.38Å; I716-Y718 HydrophobicContact CG2-CD2 4.11Å; I716-Y718 HydrophobicContact CG2-CE1 3.87Å; I716-Y718 HydrophobicContact CG2-CE2 3.56Å; I716-Y718 HydrophobicContact CG2-CG 4.49Å; I716-Y718 VanDerWaalsContact CG2-CZ 3.43Å; I716-I732 WeakPolarHBondContact CA-O 3.46Å; I716-L733 HydrophobicContact CG1-CD1 3.77Å
717	D	79.8	Confident	80.4	Confident	32 Å²	32	63.7 Å²	63.7	17%	0.171	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	119	178	-170.6	-16.5	0	0	0	109.6	D719 G731 I732 K734	D717-D719 PolarHBondContact OD1-N 3.38Å; D717-G731 CarbonylContact O-C 3.56Å; D717-G731 WeakPolarHBondContact O-CA 3.5Å; D717-I732 PolarHBondContact N-O 3.43Å; D717-I732 PolarHBondContact O-N 3.17Å; D717-K734 WeakPolarHBondContact OD2-CE 3.37Å; D717-K734 IonicContact OD2-NZ 2.75Å; D717-K734 PolarHBondContact OD2-NZ 2.94Å
718	Y	76.4	Confident	80	Confident	44 Å²	44	67.5 Å²	67.5	17%	0.173	38%	0.381	C	S	.	.			trans	-103.3	-7.7	178.7	-62.9	-80.5	0	0	0	112.7	F551 D552 T565 I716	F551-Y718 HydrophobicContact CD1-CD2 4.46Å; F551-Y718 HydrophobicContact CE1-CD2 4.18Å; F551-Y718 HydrophobicContact CE1-CG 4.34Å; D552-Y718 HydrophobicContact CB-CE2 4.3Å; T565-Y718 HydrophobicContact CG2-CD1 4.25Å; T565-Y718 HydrophobicContact CG2-CE1 4.4Å; I716-Y718 HydrophobicContact CB-CE2 4Å; I716-Y718 HydrophobicContact CG2-CD1 4.38Å; I716-Y718 HydrophobicContact CG2-CD2 4.11Å; I716-Y718 HydrophobicContact CG2-CE1 3.87Å; I716-Y718 HydrophobicContact CG2-CE2 3.56Å; I716-Y718 HydrophobicContact CG2-CG 4.49Å; I716-Y718 VanDerWaalsContact CG2-CZ 3.43Å
719	D	68.7	Low	79.8	Confident	113 Å²	113	64.3 Å²	64.3	60%	0.604	35%	0.348	S	S	*	.	S	Bend	trans	-80.7	-38.9	-175.3	-80.8	-42.2	0	0	0	112.1	F551 D717 L721	F551-D719 WeakPolarHBondContact CE2-OD1 3.37Å; F551-D719 WeakPolarHBondContact CZ-OD1 3.32Å; D717-D719 PolarHBondContact OD1-N 3.38Å; D719-L721 PolarHBondContact O-N 3.33Å
720	E	65.7	Low	79.5	Confident	84 Å²	84	64.8 Å²	64.8	39%	0.393	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-24.2	-174.4	-70.8	-179.3	169.2	0	0	113.4	I732 K734	E720-I732 HydrophobicContact CB-CD1 4.27Å; E720-K734 IonicContact OE1-NZ 3.65Å; E720-K734 PolarHBondContact OE1-NZ 3Å; E720-K734 IonicContact OE2-NZ 3Å; E720-K734 PolarHBondContact OE2-NZ 3.43Å
721	L	68.8	Low	79.5	Confident	36 Å²	36	62.4 Å²	62.4	19%	0.188	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-130.5	45.6	-176.2	-75.5	169.7	0	0	0	112.5	I568 D719 P723 A729 R730 I732	I568-L721 HydrophobicContact CD1-CD1 3.51Å; I568-L721 HydrophobicContact CG1-CD1 4.42Å; D719-L721 PolarHBondContact O-N 3.33Å; L721-P723 WeakPolarHBondContact O-CD 3.36Å; L721-A729 WeakPolarHBondContact O-CA 3.44Å; L721-R730 HydrophobicContact CB-CB 4.28Å; L721-R730 VanDerWaalsContact CB-O 3.28Å; L721-R730 WeakPolarHBondContact CB-O 3.45Å; L721-R730 HydrophobicContact CD1-CB 4.2Å; L721-R730 PolarHBondContact O-N 3.23Å; L721-R730 VanDerWaalsContact O-N 3.16Å; L721-I732 HydrophobicContact CD1-CD1 3.53Å; L721-I732 HydrophobicContact CD1-CG1 3.53Å; L721-I732 HydrophobicContact CG-CD1 4.1Å; L721-I732 HydrophobicContact CG-CG1 4.41Å
722	K	72.3	Confident	79.4	Confident	78 Å²	78	58.9 Å²	58.9	34%	0.339	30%	0.3	S	S	.	.			trans	-105.6	77.7	171.5	-161.9	172.5	-174.2	168.5	0	112.1	Y537	Y537-K722 HydrophobicContact CE1-CD 4.44Å; Y537-K722 HydrophobicContact CE1-CG 4.1Å; Y537-K722 HydrophobicContact CE2-CG 4.02Å; Y537-K722 WeakPolarHBondContact OH-CG 3.44Å
723	P	76.5	Confident	79.4	Confident	40 Å²	40	59.1 Å²	59.1	26%	0.26	30%	0.3	S	S	.	.			trans	-68.4	165.7	176.7	27.5	-31.8	0	0	0	111.7	Y537 L721 N725 F728	Y537-P723 WeakPolarHBondContact CE2-O 3.46Å; Y537-P723 PolarHBondContact OH-O 2.04Å; L721-P723 WeakPolarHBondContact O-CD 3.36Å; P723-N725 PolarHBondContact O-N 3.08Å; P723-N725 VanDerWaalsContact O-N 3.16Å; P723-F728 HydrophobicContact CG-CB 3.64Å
724	P	76.3	Confident	79.4	Confident	125 Å²	125	57.8 Å²	57.8	81%	0.812	29%	0.293	S	S	*	.	S	Bend	trans	-56.4	-31.3	175.9	-23.7	32.6	0	0	0	113
725	N	79.8	Confident	79.3	Confident	75 Å²	75	55.8 Å²	55.8	40%	0.401	28%	0.281	S	S	.	.	S	Bend	trans	-90.2	116.1	176.6	-177.7	-16.8	0	0	0	110.8	P723 E727 F728	P723-N725 PolarHBondContact O-N 3.08Å; P723-N725 VanDerWaalsContact O-N 3.16Å; N725-E727 PolarHBondContact O-N 3.01Å; N725-E727 WeakPolarHBondContact OD1-CB 3.37Å; N725-E727 PolarHBondContact OD1-N 2.92Å; N725-F728 HydrophobicContact CB-CD2 3.93Å; N725-F728 HydrophobicContact CB-CE2 4.42Å; N725-F728 WeakPolarHBondContact ND2-CE2 3.35Å; N725-F728 PolarHBondContact O-N 3.11Å
726	P	80.7	Confident	79.2	Confident	9 Å²	9	56.5 Å²	56.5	6%	0.058	28%	0.283	C	S	.	.	G	3₁₀ helix	trans	-64.7	-20.9	-176	28.2	-37.9	0	0	0	114.3	G536 Y537 R554 P555 F728 A729	G536-P726 WeakPolarHBondContact O-CG 3.48Å; Y537-P726 HydrophobicContact CD1-CB 4.12Å; Y537-P726 HydrophobicContact CE1-CB 3.85Å; R554-P726 HydrophobicContact CB-CB 4.32Å; R554-P726 VanDerWaalsContact CD-O 3.26Å; R554-P726 WeakPolarHBondContact CD-O 3.36Å; R554-P726 PolarHBondContact NH1-O 3.45Å; P555-P726 HydrophobicContact CG-CB 3.93Å; P555-P726 HydrophobicContact CG-CG 3.9Å; P726-F728 PolarHBondContact O-N 3.49Å; P726-A729 WeakPolarHBondContact O-CB 3.1Å; P726-A729 PolarHBondContact O-N 3.3Å
727	E	80.8	Confident	79	Confident	75 Å²	75	55.4 Å²	55.4	35%	0.35	28%	0.277	S	S	.	.	G	3₁₀ helix	trans	-66.1	-25.3	178.4	-73.5	-60.4	131.3	0	0	112.7	R554 R563 N725	R554-E727 VanDerWaalsContact NH1-C 3.29Å; R554-E727 PolarHBondContact NH1-O 3.08Å; R563-E727 IonicContact CZ-OE1 2.65Å; R563-E727 IonicContact NH2-OE1 2.81Å; R563-E727 PolarHBondContact NH2-OE1 2.68Å; R563-E727 IonicContact NH2-OE2 3.06Å; R563-E727 PolarHBondContact NH2-OE2 3.38Å; N725-E727 PolarHBondContact O-N 3.01Å; N725-E727 WeakPolarHBondContact OD1-CB 3.37Å; N725-E727 PolarHBondContact OD1-N 2.92Å
728	F	79.4	Confident	79	Confident	122 Å²	122	56.8 Å²	56.8	54%	0.535	29%	0.289	S	S	.	.	G	3₁₀ helix	trans	-97.5	0.4	179.2	-58.9	-66	0	0	0	113.5	P723 N725 P726 R730	P723-F728 HydrophobicContact CG-CB 3.64Å; N725-F728 HydrophobicContact CB-CD2 3.93Å; N725-F728 HydrophobicContact CB-CE2 4.42Å; N725-F728 WeakPolarHBondContact ND2-CE2 3.35Å; N725-F728 PolarHBondContact O-N 3.11Å; P726-F728 PolarHBondContact O-N 3.49Å; F728-R730 PolarHBondContact O-N 3.09Å
729	A	82.2	Confident	79.3	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	29%	0.294	C	S	.	.			trans	-60.4	129	175	0	0	0	0	0	110.8	Y537 T565 P566 L721 P726	Y537-A729 HydrophobicContact CE1-CB 4.11Å; T565-A729 HydrophobicContact CG2-CB 3.92Å; T565-A729 WeakPolarHBondContact CG2-O 3.49Å; P566-A729 WeakPolarHBondContact CD-O 3.49Å; L721-A729 WeakPolarHBondContact O-CA 3.44Å; P726-A729 WeakPolarHBondContact O-CB 3.1Å; P726-A729 PolarHBondContact O-N 3.3Å
730	R	82.4	Confident	79.8	Confident	121 Å²	121	57.4 Å²	57.4	46%	0.457	30%	0.295	S	S	.	.			trans	-139.5	139.1	-180	-65.4	172.5	-173.6	-173	2.5	109.3	P566 I568 L721 F728	P566-R730 HydrophobicContact CG-CG 4.49Å; P566-R730 WeakPolarHBondContact O-CA 3.44Å; I568-R730 HydrophobicContact CD1-CB 4.37Å; I568-R730 HydrophobicContact CG1-CB 4.36Å; I568-R730 HydrophobicContact CG2-CB 4.25Å; I568-R730 HydrophobicContact CG2-CG 4.23Å; L721-R730 HydrophobicContact CB-CB 4.28Å; L721-R730 VanDerWaalsContact CB-O 3.28Å; L721-R730 WeakPolarHBondContact CB-O 3.45Å; L721-R730 HydrophobicContact CD1-CB 4.2Å; L721-R730 PolarHBondContact O-N 3.23Å; L721-R730 VanDerWaalsContact O-N 3.16Å; F728-R730 PolarHBondContact O-N 3.09Å
731	G	83.3	Confident	80.5	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	140.9	169.4	0	0	0	0	0	110.9	P566 I567 I568 D717	P566-G731 PolarHBondContact O-N 3.31Å; I567-G731 CarbonylContact C-O 3.59Å; I567-G731 VanDerWaalsContact CA-O 3.28Å; I567-G731 WeakPolarHBondContact CA-O 3.08Å; I568-G731 WeakPolarHBondContact CG1-O 3.29Å; I568-G731 PolarHBondContact N-O 3.33Å; D717-G731 CarbonylContact O-C 3.56Å; D717-G731 WeakPolarHBondContact O-CA 3.5Å
732	I	84.9	Confident	81.1	Confident	10 Å²	10	53.9 Å²	53.9	5%	0.051	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	122.3	177.5	-54.7	179.6	0	0	0	109.4	I568 I716 D717 E720 L721 K734 M804	I568-I732 HydrophobicContact CD1-CG1 4.2Å; I568-I732 HydrophobicContact CG1-CG1 4.15Å; I716-I732 WeakPolarHBondContact CA-O 3.46Å; D717-I732 PolarHBondContact N-O 3.43Å; D717-I732 PolarHBondContact O-N 3.17Å; E720-I732 HydrophobicContact CB-CD1 4.27Å; L721-I732 HydrophobicContact CD1-CD1 3.53Å; L721-I732 HydrophobicContact CD1-CG1 3.53Å; L721-I732 HydrophobicContact CG-CD1 4.1Å; L721-I732 HydrophobicContact CG-CG1 4.41Å; I732-K734 PolarHBondContact O-N 3.43Å; I732-M804 HydrophobicContact CG2-SD 3.36Å; I732-M804 WeakPolarHBondContact CG2-SD 3.49Å
733	L	85.4	Confident	81.6	Confident	29 Å²	29	52.9 Å²	52.9	15%	0.152	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	113.6	171.1	-176.6	66	0	0	0	110.2	I567 I568 P636 I716	I567-L733 HydrophobicContact CG2-CB 3.82Å; I568-L733 PolarHBondContact O-N 3Å; I568-L733 VanDerWaalsContact O-N 3.16Å; P636-L733 HydrophobicContact CB-CG 4.35Å; P636-L733 HydrophobicContact CG-CG 4.44Å; I716-L733 HydrophobicContact CG1-CD1 3.77Å
734	K	85.3	Confident	81.9	Confident	51 Å²	51	56 Å²	56	22%	0.222	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	163.3	177.8	62.7	-173.6	175.9	-163.6	0	112.5	T714 T715 D717 E720 I732 M804	T714-K734 WeakPolarHBondContact CA-O 3.41Å; T715-K734 PolarHBondContact N-O 2.98Å; T715-K734 PolarHBondContact O-N 2.82Å; D717-K734 WeakPolarHBondContact OD2-CE 3.37Å; D717-K734 IonicContact OD2-NZ 2.75Å; D717-K734 PolarHBondContact OD2-NZ 2.94Å; E720-K734 IonicContact OE1-NZ 3.65Å; E720-K734 PolarHBondContact OE1-NZ 3Å; E720-K734 IonicContact OE2-NZ 3Å; E720-K734 PolarHBondContact OE2-NZ 3.43Å; I732-K734 PolarHBondContact O-N 3.43Å; K734-M804 HydrophobicContact CB-CE 4.36Å; K734-M804 HydrophobicContact CB-SD 4.4Å
735	C	86.9	Confident	82.3	Confident	13 Å²	13	50.2 Å²	50.2	9%	0.088	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	140.4	165.7	-66.7	0	0	0	0	108.1	C641 M737	C641-C735 WeakPolarHBondContact CA-SG 3.27Å; C641-C735 HydrophobicContact CB-CB 3.82Å; C641-C735 WeakPolarHBondContact CB-SG 3.44Å; C641-C735 VanDerWaalsContact SG-CA 3.6Å; C641-C735 WeakPolarHBondContact SG-CB 3.29Å; C641-C735 CovalentContact SG-SG 2.03Å; C641-C735 PolarHBondContact SG-SG 3.47Å; C735-M737 VanDerWaalsContact C-N 3.29Å; C735-M737 PolarHBondContact O-N 3.13Å
736	D	83.8	Confident	82.7	Confident	59 Å²	59	46.8 Å²	46.8	32%	0.316	24%	0.237	S	C	.	.	S	Bend	trans	-68	88.7	174.5	-179.7	38	0	0	0	109.8	R645 H713 T715	R645-D736 PolarHBondContact NH2-O 2.91Å; H713-D736 IonicContact CE1-OD2 3.59Å; H713-D736 PolarHBondContact CE1-OD2 3.33Å; H713-D736 IonicContact ND1-OD2 3.99Å; H713-D736 IonicContact NE2-OD2 2.91Å; H713-D736 PolarHBondContact O-N 3.3Å; T715-D736 HydrophobicContact CG2-CB 3.91Å
737	M	79.6	Confident	83.1	Confident	44 Å²	44	49 Å²	49	22%	0.217	25%	0.252	C	S	.	.			trans	-145.7	107.3	-177	-175	165.7	177.3	0	0	108.1	R645 L648 W706 C735 L742	R645-M737 HydrophobicContact CG-SD 4.06Å; L648-M737 HydrophobicContact CD2-CE 3.82Å; W706-M737 HydrophobicContact CH2-CE 3.96Å; C735-M737 VanDerWaalsContact C-N 3.29Å; C735-M737 PolarHBondContact O-N 3.13Å; M737-L742 HydrophobicContact CE-CB 3.85Å; M737-L742 HydrophobicContact CE-CD1 4.44Å; M737-L742 HydrophobicContact CE-CG 4.1Å
738	S	80.4	Confident	83.6	Confident	62 Å²	62	47.7 Å²	47.7	43%	0.434	24%	0.244	S	C	.	.			trans	-70.2	153.7	179	65.2	0	0	0	0	111.9	L740 S741 L742	S738-L740 PolarHBondContact O-N 2.72Å; S738-S741 WeakPolarHBondContact O-CA 3.36Å; S738-S741 VanDerWaalsContact O-CB 3.25Å; S738-S741 WeakPolarHBondContact O-CB 3.42Å; S738-S741 PolarHBondContact O-N 3.2Å; S738-S741 WeakPolarHBondContact OG-CB 3.35Å; S738-S741 PolarHBondContact OG-N 3.24Å; S738-S741 PolarHBondContact OG-OG 2.92Å; S738-L742 PolarHBondContact O-N 2.91Å; S738-L742 VanDerWaalsContact O-N 3.08Å
739	D	81.1	Confident	84.1	Confident	52 Å²	52	42.1 Å²	42.1	28%	0.278	22%	0.22	S	C	.	.	H	α-helix	trans	-55.8	-39	177.6	-65.3	-21.7	0	0	0	111.5	S741 L742 I743 F794 K803	D739-S741 VanDerWaalsContact C-N 3.34Å; D739-S741 PolarHBondContact O-N 3.02Å; D739-L742 WeakPolarHBondContact O-CB 3.34Å; D739-L742 PolarHBondContact O-N 3.38Å; D739-I743 WeakPolarHBondContact O-CD1 3.26Å; D739-I743 WeakPolarHBondContact O-CG1 3.39Å; D739-I743 PolarHBondContact O-N 3.46Å; D739-F794 HydrophobicContact CB-CE1 4.38Å; D739-K803 IonicContact OD1-NZ 3.59Å; D739-K803 WeakPolarHBondContact OD2-CE 3.41Å; D739-K803 IonicContact OD2-NZ 2.71Å; D739-K803 PolarHBondContact OD2-NZ 3.49Å
740	L	79.6	Confident	84.5	Confident	118 Å²	118	44.3 Å²	44.3	62%	0.618	23%	0.231	S	C	*	.	H	α-helix	trans	-61	-42.9	174.5	-179.9	63.7	0	0	0	112	S738 L742 I743 L744	S738-L740 PolarHBondContact O-N 2.72Å; L740-L742 VanDerWaalsContact C-N 3.32Å; L740-L742 PolarHBondContact O-N 3.45Å; L740-I743 PolarHBondContact O-N 2.75Å; L740-L744 HydrophobicContact CD1-CD1 4.41Å; L740-L744 HydrophobicContact CD1-CG 4.43Å; L740-L744 HydrophobicContact CG-CD1 4.02Å; L740-L744 HydrophobicContact CG-CG 4.47Å; L740-L744 WeakPolarHBondContact O-CG 3.4Å; L740-L744 PolarHBondContact O-N 3.1Å
741	S	81.5	Confident	84.9	Confident	24 Å²	24	42.4 Å²	42.4	17%	0.168	23%	0.233	C	C	.	.	H	α-helix	trans	-63.9	-39.5	179.7	-62.8	0	0	0	0	111.7	W706 S738 D739 L744 C745	W706-S741 WeakPolarHBondContact CH2-O 3.47Å; W706-S741 WeakPolarHBondContact CZ3-O 3.47Å; S738-S741 WeakPolarHBondContact O-CA 3.36Å; S738-S741 VanDerWaalsContact O-CB 3.25Å; S738-S741 WeakPolarHBondContact O-CB 3.42Å; S738-S741 PolarHBondContact O-N 3.2Å; S738-S741 WeakPolarHBondContact OG-CB 3.35Å; S738-S741 PolarHBondContact OG-N 3.24Å; S738-S741 PolarHBondContact OG-OG 2.92Å; D739-S741 VanDerWaalsContact C-N 3.34Å; D739-S741 PolarHBondContact O-N 3.02Å; S741-L744 PolarHBondContact O-N 2.94Å; S741-C745 WeakPolarHBondContact O-CB 3.07Å; S741-C745 PolarHBondContact O-N 3.13Å
742	L	81.6	Confident	85.3	Confident	21 Å²	21	42.8 Å²	42.8	11%	0.11	23%	0.234	C	C	.	.	H	α-helix	trans	-60.9	-44.1	175.3	-169.3	149.7	0	0	0	111.9	L648 M737 S738 D739 L740 C745 L746 F794 L811	L648-L742 HydrophobicContact CD2-CG 4.19Å; M737-L742 HydrophobicContact CE-CB 3.85Å; M737-L742 HydrophobicContact CE-CD1 4.44Å; M737-L742 HydrophobicContact CE-CG 4.1Å; S738-L742 PolarHBondContact O-N 2.91Å; S738-L742 VanDerWaalsContact O-N 3.08Å; D739-L742 WeakPolarHBondContact O-CB 3.34Å; D739-L742 PolarHBondContact O-N 3.38Å; L740-L742 VanDerWaalsContact C-N 3.32Å; L740-L742 PolarHBondContact O-N 3.45Å; L742-C745 WeakPolarHBondContact O-CB 3.34Å; L742-C745 PolarHBondContact O-N 3.43Å; L742-L746 HydrophobicContact CD2-CD1 3.9Å; L742-L746 PolarHBondContact O-N 3.03Å; L742-F794 HydrophobicContact CD1-CE2 4.37Å; L742-F794 HydrophobicContact CD1-CZ 4.34Å; L742-F794 HydrophobicContact CD2-CE2 4.1Å; L742-F794 HydrophobicContact CD2-CZ 4.01Å; L742-L811 HydrophobicContact CD1-CD2 3.84Å; L742-L811 HydrophobicContact CD2-CD1 4.43Å; L742-L811 HydrophobicContact CD2-CD2 4.03Å; L742-L811 HydrophobicContact CG-CD2 4.27Å
743	I	82.4	Confident	85.6	Confident	58 Å²	58	42.6 Å²	42.6	30%	0.297	23%	0.234	S	C	.	.	H	α-helix	trans	-67.7	-44.5	179.1	-66.2	161.4	0	0	0	111.4	D739 L740 C745 L746 S747 F794 F795	D739-I743 WeakPolarHBondContact O-CD1 3.26Å; D739-I743 WeakPolarHBondContact O-CG1 3.39Å; D739-I743 PolarHBondContact O-N 3.46Å; L740-I743 PolarHBondContact O-N 2.75Å; I743-C745 PolarHBondContact O-N 3.19Å; I743-L746 PolarHBondContact O-N 2.7Å; I743-L746 VanDerWaalsContact O-N 3.08Å; I743-S747 PolarHBondContact O-N 3.04Å; I743-F794 HydrophobicContact CD1-CE1 4.41Å; I743-F795 HydrophobicContact CD1-CE1 3.93Å; I743-F795 HydrophobicContact CD1-CE2 4.02Å; I743-F795 HydrophobicContact CD1-CZ 3.27Å
744	L	83.4	Confident	85.9	Confident	104 Å²	104	45.6 Å²	45.6	55%	0.545	25%	0.249	S	C	.	.	H	α-helix	trans	-57.7	-40.4	176.8	-74.7	170.6	0	0	0	111.3	L740 S741 L746 S747	L740-L744 HydrophobicContact CD1-CD1 4.41Å; L740-L744 HydrophobicContact CD1-CG 4.43Å; L740-L744 HydrophobicContact CG-CD1 4.02Å; L740-L744 HydrophobicContact CG-CG 4.47Å; L740-L744 WeakPolarHBondContact O-CG 3.4Å; L740-L744 PolarHBondContact O-N 3.1Å; S741-L744 PolarHBondContact O-N 2.94Å; L744-L746 VanDerWaalsContact C-N 3.26Å; L744-L746 PolarHBondContact O-N 3.38Å; L744-S747 PolarHBondContact O-N 3.44Å; L744-S747 PolarHBondContact O-OG 3.36Å
745	C	84.8	Confident	86.2	Confident	4 Å²	4	45.5 Å²	45.5	3%	0.027	25%	0.253	C	S	.	.	H	α-helix	trans	-58.1	-36.3	176.6	-135.4	0	0	0	0	113.2	Q699 W706 S741 L742 I743	Q699-C745 PolarHBondContact NE2-O 2.9Å; W706-C745 HydrophobicContact CH2-CB 4.28Å; W706-C745 HydrophobicContact CZ3-CB 3.75Å; W706-C745 WeakPolarHBondContact CZ3-SG 3.37Å; S741-C745 WeakPolarHBondContact O-CB 3.07Å; S741-C745 PolarHBondContact O-N 3.13Å; L742-C745 WeakPolarHBondContact O-CB 3.34Å; L742-C745 PolarHBondContact O-N 3.43Å; I743-C745 PolarHBondContact O-N 3.19Å
746	L	86.8	Confident	86.4	Confident	4 Å²	4	44.9 Å²	44.9	2%	0.021	25%	0.249	C	C	.	.	H	α-helix	trans	-92.1	-19.3	-177	-63	173.2	0	0	0	113.5	L648 L742 I743 L744 Y748 S749 I750 W787 L811 M815	L648-L746 HydrophobicContact CG-CD2 4.2Å; L742-L746 HydrophobicContact CD2-CD1 3.9Å; L742-L746 PolarHBondContact O-N 3.03Å; I743-L746 PolarHBondContact O-N 2.7Å; I743-L746 VanDerWaalsContact O-N 3.08Å; L744-L746 VanDerWaalsContact C-N 3.26Å; L744-L746 PolarHBondContact O-N 3.38Å; L746-Y748 PolarHBondContact O-N 3.24Å; L746-S749 WeakPolarHBondContact O-CB 3.38Å; L746-S749 PolarHBondContact O-N 3.24Å; L746-S749 VanDerWaalsContact O-N 3.08Å; L746-I750 WeakPolarHBondContact O-CG1 3.26Å; L746-I750 PolarHBondContact O-N 3.24Å; L746-W787 HydrophobicContact CD1-CH2 4.18Å; L746-W787 HydrophobicContact CD1-CZ3 4.1Å; L746-W787 HydrophobicContact CD2-CH2 4.35Å; L746-L811 HydrophobicContact CD1-CD1 3.82Å; L746-M815 HydrophobicContact CD1-CE 4.35Å; L746-M815 HydrophobicContact CD2-CE 3.44Å; L746-M815 VanDerWaalsContact CD2-CE 3.44Å
747	S	88.8	Confident	86.7	Confident	54 Å²	54	43 Å²	43	38%	0.378	24%	0.239	S	C	.	.	H	α-helix	trans	-54	-46.9	-173.6	67.6	0	0	0	0	113.3	I743 L744 S749 I750 V751	I743-S747 PolarHBondContact O-N 3.04Å; L744-S747 PolarHBondContact O-N 3.44Å; L744-S747 PolarHBondContact O-OG 3.36Å; S747-S749 PolarHBondContact O-N 2.95Å; S747-I750 PolarHBondContact O-N 3.09Å; S747-V751 WeakPolarHBondContact O-CG2 3.41Å; S747-V751 PolarHBondContact O-N 3.36Å
748	Y	91.2	Very high	87.2	Confident	49 Å²	49	44.2 Å²	44.2	19%	0.192	25%	0.249	C	C	.	.	H	α-helix	trans	-64.8	-38.5	178.9	-178.9	-111.3	0	0	0	112.5	L695 V698 Q699 L746 I750 V751 L752	L695-Y748 WeakPolarHBondContact O-CE1 3.34Å; L695-Y748 PolarHBondContact O-OH 3Å; L695-Y748 VanDerWaalsContact O-OH 3.05Å; V698-Y748 HydrophobicContact CB-CE1 4.23Å; V698-Y748 HydrophobicContact CB-CE2 4.42Å; V698-Y748 HydrophobicContact CG1-CD2 4.41Å; V698-Y748 HydrophobicContact CG1-CE1 4.32Å; V698-Y748 HydrophobicContact CG1-CE2 3.88Å; Q699-Y748 HydrophobicContact CB-CD1 3.94Å; Q699-Y748 HydrophobicContact CB-CE1 4.15Å; Q699-Y748 VanDerWaalsContact OE1-CB 3.31Å; Q699-Y748 VanDerWaalsContact OE1-CD1 3.23Å; L746-Y748 PolarHBondContact O-N 3.24Å; Y748-I750 VanDerWaalsContact C-N 3.33Å; Y748-I750 PolarHBondContact O-N 3.24Å; Y748-V751 PolarHBondContact O-N 3.01Å; Y748-L752 HydrophobicContact CD1-CD1 4.02Å; Y748-L752 HydrophobicContact CD1-CG 4.43Å; Y748-L752 HydrophobicContact CE1-CD1 3.57Å; Y748-L752 HydrophobicContact CE1-CG 4.07Å; Y748-L752 HydrophobicContact CE2-CG 4.49Å; Y748-L752 WeakPolarHBondContact O-CG 3.41Å; Y748-L752 PolarHBondContact O-N 2.89Å
749	S	90.1	Very high	87.6	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.028	24%	0.241	C	C	.	.	H	α-helix	trans	-64.7	-37.9	175.1	-68.2	0	0	0	0	111.9	G649 C653 L746 S747 L752 M753	G649-S749 PolarHBondContact O-OG 2.88Å; C653-S749 PolarHBondContact N-OG 3.41Å; L746-S749 WeakPolarHBondContact O-CB 3.38Å; L746-S749 PolarHBondContact O-N 3.24Å; L746-S749 VanDerWaalsContact O-N 3.08Å; S747-S749 PolarHBondContact O-N 2.95Å; S749-L752 PolarHBondContact O-N 3.41Å; S749-M753 WeakPolarHBondContact O-CB 3.47Å; S749-M753 PolarHBondContact O-N 3.06Å
750	I	90.4	Very high	87.8	Confident	50 Å²	50	42.2 Å²	42.2	26%	0.256	23%	0.229	S	C	.	.	H	α-helix	trans	-65.4	-41.3	173.6	-65.9	168.8	0	0	0	110.7	L746 S747 Y748 L752 M753 I754 W787	L746-I750 WeakPolarHBondContact O-CG1 3.26Å; L746-I750 PolarHBondContact O-N 3.24Å; S747-I750 PolarHBondContact O-N 3.09Å; Y748-I750 VanDerWaalsContact C-N 3.33Å; Y748-I750 PolarHBondContact O-N 3.24Å; I750-L752 PolarHBondContact O-N 3.2Å; I750-M753 HydrophobicContact CG2-CE 4.19Å; I750-M753 WeakPolarHBondContact O-CB 3.39Å; I750-M753 PolarHBondContact O-N 3.21Å; I750-I754 HydrophobicContact CG2-CD1 3.86Å; I750-I754 HydrophobicContact CG2-CG1 4.4Å; I750-I754 WeakPolarHBondContact O-CG1 3.48Å; I750-I754 PolarHBondContact O-N 3.19Å; I750-W787 HydrophobicContact CD1-CE3 4.47Å
751	V	91.9	Very high	88.2	Confident	81 Å²	81	41 Å²	41	49%	0.491	22%	0.222	S	C	.	.	H	α-helix	trans	-61.8	-43.7	175.3	171.3	0	0	0	0	111.4	S747 Y748 M753 I754 T755	S747-V751 WeakPolarHBondContact O-CG2 3.41Å; S747-V751 PolarHBondContact O-N 3.36Å; Y748-V751 PolarHBondContact O-N 3.01Å; V751-M753 VanDerWaalsContact C-N 3.33Å; V751-M753 PolarHBondContact O-N 2.99Å; V751-I754 PolarHBondContact O-N 2.84Å; V751-T755 WeakPolarHBondContact O-CB 3.46Å; V751-T755 PolarHBondContact O-N 3.27Å; V751-T755 PolarHBondContact O-OG1 3.44Å
752	L	91.9	Very high	88.3	Confident	7 Å²	7	45.7 Å²	45.7	4%	0.037	24%	0.239	C	C	.	.	H	α-helix	trans	-61.2	-42.3	174.4	-72.1	177.8	0	0	0	111.7	A657 L660 L695 Y748 S749 I750 T755 C756	A657-L752 HydrophobicContact CB-CD1 4.44Å; L660-L752 HydrophobicContact CD2-CD2 3.99Å; L695-L752 HydrophobicContact CD2-CD2 4.36Å; Y748-L752 HydrophobicContact CD1-CD1 4.02Å; Y748-L752 HydrophobicContact CD1-CG 4.43Å; Y748-L752 HydrophobicContact CE1-CD1 3.57Å; Y748-L752 HydrophobicContact CE1-CG 4.07Å; Y748-L752 HydrophobicContact CE2-CG 4.49Å; Y748-L752 WeakPolarHBondContact O-CG 3.41Å; Y748-L752 PolarHBondContact O-N 2.89Å; S749-L752 PolarHBondContact O-N 3.41Å; I750-L752 PolarHBondContact O-N 3.2Å; L752-T755 PolarHBondContact O-N 3.16Å; L752-C756 VanDerWaalsContact O-CB 3.27Å; L752-C756 WeakPolarHBondContact O-CB 3.41Å; L752-C756 PolarHBondContact O-N 3.4Å
753	M	91.1	Very high	88.2	Confident	7 Å²	7	44.8 Å²	44.8	3%	0.034	24%	0.235	C	C	.	.	H	α-helix	trans	-60.6	-52.5	176.2	-177.9	-170.5	59.4	0	0	111.3	Y656 S749 I750 V751 T755 C756 T757 M780 W787	Y656-M753 HydrophobicContact CD1-CB 4.41Å; Y656-M753 HydrophobicContact CD2-CB 3.97Å; Y656-M753 HydrophobicContact CE1-CB 4.32Å; Y656-M753 HydrophobicContact CE1-CG 4.07Å; Y656-M753 HydrophobicContact CE2-CB 3.8Å; Y656-M753 HydrophobicContact CE2-CG 4.13Å; Y656-M753 HydrophobicContact CE2-SD 4.35Å; Y656-M753 HydrophobicContact CG-CB 4.26Å; S749-M753 WeakPolarHBondContact O-CB 3.47Å; S749-M753 PolarHBondContact O-N 3.06Å; I750-M753 HydrophobicContact CG2-CE 4.19Å; I750-M753 WeakPolarHBondContact O-CB 3.39Å; I750-M753 PolarHBondContact O-N 3.21Å; V751-M753 VanDerWaalsContact C-N 3.33Å; V751-M753 PolarHBondContact O-N 2.99Å; M753-T755 VanDerWaalsContact C-N 3.31Å; M753-T755 PolarHBondContact O-N 2.81Å; M753-C756 WeakPolarHBondContact O-CB 3.4Å; M753-C756 PolarHBondContact O-N 3.41Å; M753-C756 VanDerWaalsContact O-N 3.12Å; M753-T757 PolarHBondContact O-N 3.1Å; M753-T757 PolarHBondContact O-OG1 3.03Å; M753-T757 VanDerWaalsContact O-OG1 3.08Å; M753-M780 HydrophobicContact CB-CE 4.3Å; M753-M780 HydrophobicContact CG-CE 3.58Å; M753-M780 WeakPolarHBondContact O-CE 3.23Å; M753-W787 HydrophobicContact CE-CB 3.94Å; M753-W787 HydrophobicContact CE-CG 4.14Å; M753-W787 HydrophobicContact SD-CB 4.41Å; M753-W787 VanDerWaalsContact SD-CD1 3.51Å; M753-W787 HydrophobicContact SD-CG 4.16Å
754	I	91.4	Very high	88	Confident	91 Å²	91	51.1 Å²	51.1	47%	0.467	26%	0.255	S	S	.	.	H	α-helix	trans	-58.9	-45.1	179.2	-67.9	168.1	0	0	0	110.7	I750 V751 C756 T757 V758	I750-I754 HydrophobicContact CG2-CD1 3.86Å; I750-I754 HydrophobicContact CG2-CG1 4.4Å; I750-I754 WeakPolarHBondContact O-CG1 3.48Å; I750-I754 PolarHBondContact O-N 3.19Å; V751-I754 PolarHBondContact O-N 2.84Å; I754-C756 VanDerWaalsContact C-N 3.31Å; I754-C756 PolarHBondContact O-N 3.37Å; I754-T757 WeakPolarHBondContact O-CB 3.39Å; I754-T757 PolarHBondContact O-N 3.28Å; I754-T757 VanDerWaalsContact O-N 3.15Å; I754-V758 WeakPolarHBondContact O-CG2 3.45Å; I754-V758 PolarHBondContact O-N 3.01Å
755	T	91.5	Very high	87.4	Confident	50 Å²	50	49 Å²	49	31%	0.307	26%	0.258	S	S	.	.	H	α-helix	trans	-60.2	-43.4	177.5	-56.1	0	0	0	0	110.7	L660 V751 L752 M753 T757 V758 Y759	L660-T755 HydrophobicContact CD1-CG2 4.01Å; L660-T755 HydrophobicContact CD2-CG2 4.19Å; V751-T755 WeakPolarHBondContact O-CB 3.46Å; V751-T755 PolarHBondContact O-N 3.27Å; V751-T755 PolarHBondContact O-OG1 3.44Å; L752-T755 PolarHBondContact O-N 3.16Å; M753-T755 VanDerWaalsContact C-N 3.31Å; M753-T755 PolarHBondContact O-N 2.81Å; T755-T757 VanDerWaalsContact C-N 3.34Å; T755-T757 PolarHBondContact O-N 3.47Å; T755-V758 PolarHBondContact O-N 2.85Å; T755-Y759 HydrophobicContact CG2-CD2 3.94Å; T755-Y759 HydrophobicContact CG2-CE2 3.76Å; T755-Y759 VanDerWaalsContact O-CD2 3.22Å; T755-Y759 WeakPolarHBondContact O-CD2 3.3Å; T755-Y759 PolarHBondContact O-N 3.12Å; T755-Y759 VanDerWaalsContact O-N 3.1Å
756	C	91	Very high	86.9	Confident	0 Å²	0	49.7 Å²	49.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-62.9	-39.1	175.8	-171.4	0	0	0	0	112	L660 L752 M753 I754 Y759 A760 M780	L660-C756 HydrophobicContact CB-CB 4.15Å; L660-C756 HydrophobicContact CD1-CB 4.07Å; L752-C756 VanDerWaalsContact O-CB 3.27Å; L752-C756 WeakPolarHBondContact O-CB 3.41Å; L752-C756 PolarHBondContact O-N 3.4Å; M753-C756 WeakPolarHBondContact O-CB 3.4Å; M753-C756 PolarHBondContact O-N 3.41Å; M753-C756 VanDerWaalsContact O-N 3.12Å; I754-C756 VanDerWaalsContact C-N 3.31Å; I754-C756 PolarHBondContact O-N 3.37Å; C756-Y759 PolarHBondContact O-N 3.28Å; C756-A760 WeakPolarHBondContact O-CB 3.4Å; C756-A760 PolarHBondContact O-N 2.93Å; C756-M780 HydrophobicContact CB-CE 3.58Å; C756-M780 HydrophobicContact CB-SD 3.98Å; C756-M780 PolarHBondContact SG-SD 2.87Å
757	T	90.5	Very high	85.9	Confident	18 Å²	18	53 Å²	53	11%	0.11	28%	0.284	C	S	.	.	H	α-helix	trans	-62.2	-43.2	174.7	-56.7	0	0	0	0	111.9	M753 I754 T755 Y759 A760 I761 M780 Y781 C784	M753-T757 PolarHBondContact O-N 3.1Å; M753-T757 PolarHBondContact O-OG1 3.03Å; M753-T757 VanDerWaalsContact O-OG1 3.08Å; I754-T757 WeakPolarHBondContact O-CB 3.39Å; I754-T757 PolarHBondContact O-N 3.28Å; I754-T757 VanDerWaalsContact O-N 3.15Å; T755-T757 VanDerWaalsContact C-N 3.34Å; T755-T757 PolarHBondContact O-N 3.47Å; T757-Y759 PolarHBondContact O-N 2.84Å; T757-A760 WeakPolarHBondContact O-CB 3.25Å; T757-A760 PolarHBondContact O-N 3.46Å; T757-I761 HydrophobicContact CG2-CD1 4.25Å; T757-I761 WeakPolarHBondContact O-CG1 3.44Å; T757-I761 PolarHBondContact O-N 3.31Å; T757-M780 WeakPolarHBondContact OG1-CE 3.28Å; T757-Y781 HydrophobicContact CG2-CD1 3.97Å; T757-Y781 HydrophobicContact CG2-CE1 3.99Å; T757-C784 PolarHBondContact OG1-SG 2.91Å
758	V	90.6	Very high	84.6	Confident	70 Å²	70	56.6 Å²	56.6	42%	0.424	30%	0.295	S	S	.	.	H	α-helix	trans	-60.3	-44.8	175.9	172.7	0	0	0	0	111.2	I754 T755 I761 K762	I754-V758 WeakPolarHBondContact O-CG2 3.45Å; I754-V758 PolarHBondContact O-N 3.01Å; T755-V758 PolarHBondContact O-N 2.85Å; V758-I761 PolarHBondContact O-N 2.97Å; V758-K762 PolarHBondContact O-N 3.48Å; V758-K762 VanDerWaalsContact O-N 3.12Å
759	Y	87.5	Confident	83	Confident	71 Å²	71	60.1 Å²	60.1	28%	0.278	32%	0.321	S	S	.	.	H	α-helix	trans	-67.7	-35.5	175.9	-79.4	-72.1	0	0	0	112.6	L660 Y667 T755 C756 T757 K762 S763	L660-Y759 HydrophobicContact CD1-CD2 3.59Å; L660-Y759 HydrophobicContact CD1-CE2 4.15Å; L660-Y759 HydrophobicContact CD1-CG 4.42Å; Y667-Y759 AromaticContact CD1-CD1 3.93Å; Y667-Y759 HydrophobicContact CD1-CD1 3.93Å; Y667-Y759 AromaticContact CD1-CE1 3.88Å; Y667-Y759 HydrophobicContact CD1-CE1 3.88Å; Y667-Y759 HydrophobicContact CE1-CD1 4.45Å; Y667-Y759 HydrophobicContact CE1-CE1 4.11Å; Y667-Y759 HydrophobicContact CG-CD1 4.17Å; T755-Y759 HydrophobicContact CG2-CD2 3.94Å; T755-Y759 HydrophobicContact CG2-CE2 3.76Å; T755-Y759 VanDerWaalsContact O-CD2 3.22Å; T755-Y759 WeakPolarHBondContact O-CD2 3.3Å; T755-Y759 PolarHBondContact O-N 3.12Å; T755-Y759 VanDerWaalsContact O-N 3.1Å; C756-Y759 PolarHBondContact O-N 3.28Å; T757-Y759 PolarHBondContact O-N 2.84Å; Y759-K762 PolarHBondContact O-N 3.31Å; Y759-S763 WeakPolarHBondContact O-CB 3.2Å; Y759-S763 PolarHBondContact O-N 3.17Å; Y759-S763 PolarHBondContact O-OG 3.05Å
760	A	86.8	Confident	81.5	Confident	2 Å²	2	66.9 Å²	66.9	2%	0.017	35%	0.351	C	S	.	.	H	α-helix	trans	-62.6	-44.1	176	0	0	0	0	0	111.2	T663 C756 T757 K762 S763 R764 M780	T663-A760 HydrophobicContact CG2-CB 4.23Å; C756-A760 WeakPolarHBondContact O-CB 3.4Å; C756-A760 PolarHBondContact O-N 2.93Å; T757-A760 WeakPolarHBondContact O-CB 3.25Å; T757-A760 PolarHBondContact O-N 3.46Å; A760-K762 PolarHBondContact O-N 3.12Å; A760-S763 WeakPolarHBondContact CA-OG 3.49Å; A760-S763 CarbonylContact O-C 3.59Å; A760-S763 PolarHBondContact O-N 3.27Å; A760-S763 VanDerWaalsContact O-N 3.09Å; A760-S763 PolarHBondContact O-OG 3.05Å; A760-R764 PolarHBondContact O-N 3.29Å; A760-M780 HydrophobicContact CB-CG 4.27Å
761	I	86.7	Confident	80.2	Confident	93 Å²	93	70.7 Å²	70.7	48%	0.477	37%	0.371	S	S	.	.	H	α-helix	trans	-58.9	-47.9	174.3	-67.1	164.6	0	0	0	110.6	T757 V758 S763 R764 Y781	T757-I761 HydrophobicContact CG2-CD1 4.25Å; T757-I761 WeakPolarHBondContact O-CG1 3.44Å; T757-I761 PolarHBondContact O-N 3.31Å; V758-I761 PolarHBondContact O-N 2.97Å; I761-S763 PolarHBondContact O-N 3.05Å; I761-R764 VanDerWaalsContact O-CB 3.31Å; I761-R764 WeakPolarHBondContact O-CB 3.31Å; I761-R764 PolarHBondContact O-N 2.88Å; I761-R764 VanDerWaalsContact O-N 3.13Å; I761-Y781 HydrophobicContact CD1-CE1 4.31Å; I761-Y781 HydrophobicContact CG1-CE1 3.78Å; I761-Y781 WeakPolarHBondContact CG1-OH 3.29Å
762	K	84.3	Confident	79.4	Confident	122 Å²	122	68.6 Å²	68.6	53%	0.53	36%	0.356	S	S	.	.	H	α-helix	trans	-61.4	-26.2	177.2	-74.3	-174.6	173.9	-178.8	0	113.1	Y667 V758 Y759 A760	Y667-K762 HydrophobicContact CD2-CB 3.94Å; Y667-K762 HydrophobicContact CE2-CB 3.93Å; Y667-K762 HydrophobicContact CE2-CD 4.15Å; V758-K762 PolarHBondContact O-N 3.48Å; V758-K762 VanDerWaalsContact O-N 3.12Å; Y759-K762 PolarHBondContact O-N 3.31Å; A760-K762 PolarHBondContact O-N 3.12Å
763	S	78.7	Confident	78.8	Confident	2 Å²	2	68.7 Å²	68.7	1%	0.014	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	0.6	178.6	73.1	0	0	0	0	114.9	Y759 A760 I761 G765 V766	Y759-S763 WeakPolarHBondContact O-CB 3.2Å; Y759-S763 PolarHBondContact O-N 3.17Å; Y759-S763 PolarHBondContact O-OG 3.05Å; A760-S763 WeakPolarHBondContact CA-OG 3.49Å; A760-S763 CarbonylContact O-C 3.59Å; A760-S763 PolarHBondContact O-N 3.27Å; A760-S763 VanDerWaalsContact O-N 3.09Å; A760-S763 PolarHBondContact O-OG 3.05Å; I761-S763 PolarHBondContact O-N 3.05Å; S763-G765 VanDerWaalsContact C-N 3.27Å; S763-G765 PolarHBondContact O-N 3.49Å; S763-V766 VanDerWaalsContact O-CG2 3.22Å; S763-V766 WeakPolarHBondContact O-CG2 3.5Å; S763-V766 PolarHBondContact O-N 3.19Å
764	R	79	Confident	78.3	Confident	191 Å²	191	73.6 Å²	73.6	72%	0.721	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-25.4	-176.3	-170	177.6	-179.6	174.7	0.3	114.2	A760 I761 V766	A760-R764 PolarHBondContact O-N 3.29Å; I761-R764 VanDerWaalsContact O-CB 3.31Å; I761-R764 WeakPolarHBondContact O-CB 3.31Å; I761-R764 PolarHBondContact O-N 2.88Å; I761-R764 VanDerWaalsContact O-N 3.13Å; R764-V766 PolarHBondContact O-N 2.76Å
765	G	70.5	Confident	78	Confident	59 Å²	59	71.2 Å²	71.2	61%	0.608	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	7.8	-179.9	0	0	0	0	0	115.6	F670 S763	F670-G765 WeakPolarHBondContact CZ-O 3.28Å; S763-G765 VanDerWaalsContact C-N 3.27Å; S763-G765 PolarHBondContact O-N 3.49Å
766	V	73.3	Confident	77.8	Confident	18 Å²	18	69 Å²	69	11%	0.109	36%	0.356	C	S	.	.			trans	-74.7	129	179.3	174.7	0	0	0	0	110.1	I666 F670 S763 R764 F770 A773	I666-V766 HydrophobicContact CG2-CG2 4.17Å; F670-V766 HydrophobicContact CB-CG2 4.17Å; F670-V766 HydrophobicContact CD1-CG2 4.25Å; F670-V766 HydrophobicContact CD2-CG2 4.07Å; F670-V766 HydrophobicContact CG-CG2 3.91Å; S763-V766 VanDerWaalsContact O-CG2 3.22Å; S763-V766 WeakPolarHBondContact O-CG2 3.5Å; S763-V766 PolarHBondContact O-N 3.19Å; R764-V766 PolarHBondContact O-N 2.76Å; V766-F770 HydrophobicContact CG1-CB 3.81Å; V766-A773 HydrophobicContact CB-CB 4.4Å
767	P	67.3	Low	77.6	Confident	74 Å²	74	69.2 Å²	69.2	48%	0.481	36%	0.358	S	S	.	.			trans	-64.7	151.8	-178.8	24.9	-33.5	0	0	0	112.7	T769 F770	P767-T769 PolarHBondContact O-N 2.98Å; P767-F770 PolarHBondContact O-N 3.5Å; P767-F770 VanDerWaalsContact O-N 3.1Å
768	E	60.4	Low	77.5	Confident	130 Å²	130	74.2 Å²	74.2	61%	0.607	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-7.1	-171.5	-60.9	-169.9	150.1	0	0	115.6	F770 N771 K774	E768-F770 PolarHBondContact O-N 3.41Å; E768-N771 VanDerWaalsContact O-CG 3.26Å; E768-N771 PolarHBondContact O-OD1 2.93Å; E768-K774 IonicContact OE1-NZ 2.62Å; E768-K774 PolarHBondContact OE1-NZ 2.96Å
769	T	57.5	Low	77.5	Confident	122 Å²	122	70.9 Å²	70.9	75%	0.748	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-19.3	172.9	48.7	0	0	0	0	113	P767	P767-T769 PolarHBondContact O-N 2.98Å
770	F	59.7	Low	77.6	Confident	147 Å²	147	67.5 Å²	67.5	65%	0.645	35%	0.345	S	S	*	.	S	Bend	trans	-107.1	74.1	169.1	-75.1	-89.2	0	0	0	110.4	V766 P767 E768 E772	V766-F770 HydrophobicContact CG1-CB 3.81Å; P767-F770 PolarHBondContact O-N 3.5Å; P767-F770 VanDerWaalsContact O-N 3.1Å; E768-F770 PolarHBondContact O-N 3.41Å; F770-E772 PolarHBondContact O-N 3.23Å
771	N	62.7	Low	77.8	Confident	130 Å²	130	70.6 Å²	70.6	70%	0.695	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.1	9.8	-173.2	-87.2	-25.8	0	0	0	117.5	E768	E768-N771 VanDerWaalsContact O-CG 3.26Å; E768-N771 PolarHBondContact O-OD1 2.93Å
772	E	74.8	Confident	78.1	Confident	37 Å²	37	68.3 Å²	68.3	17%	0.173	35%	0.347	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-21.6	-173	-164.9	164.5	-150.9	0	0	114.1	S610 K662 F770 I776 K830	S610-E772 PolarHBondContact OG-OE1 3.37Å; K662-E772 VanDerWaalsContact CE-CD 3.41Å; K662-E772 WeakPolarHBondContact CE-OE1 3.39Å; K662-E772 IonicContact NZ-OE1 2.66Å; K662-E772 PolarHBondContact NZ-OE1 3.38Å; F770-E772 PolarHBondContact O-N 3.23Å; E772-I776 HydrophobicContact CG-CD1 3.93Å; E772-I776 WeakPolarHBondContact O-CD1 3.44Å; E772-I776 VanDerWaalsContact O-CG1 3.26Å; E772-I776 WeakPolarHBondContact O-CG1 3.38Å; E772-K830 IonicContact OE1-NZ 3.49Å; E772-K830 PolarHBondContact OE1-NZ 3.37Å
773	A	79.1	Confident	78.4	Confident	9 Å²	9	62.5 Å²	62.5	7%	0.074	32%	0.322	C	S	.	.	H	α-helix	trans	-72.9	-37.2	-175.8	0	0	0	0	0	114	I666 V766 I776 G777	I666-A773 HydrophobicContact CG2-CB 4.45Å; V766-A773 HydrophobicContact CB-CB 4.4Å; A773-I776 PolarHBondContact O-N 3.22Å; A773-G777 PolarHBondContact O-N 2.95Å
774	K	81.9	Confident	79	Confident	110 Å²	110	63.5 Å²	63.5	48%	0.478	33%	0.329	S	S	.	.	H	α-helix	trans	-65.4	-49.6	-179.9	-67.8	-179.2	-177	179.7	0	112.4	E768 I776 G777 F778	E768-K774 IonicContact OE1-NZ 2.62Å; E768-K774 PolarHBondContact OE1-NZ 2.96Å; K774-I776 VanDerWaalsContact C-N 3.3Å; K774-I776 PolarHBondContact O-N 2.79Å; K774-G777 PolarHBondContact O-N 3.39Å; K774-F778 HydrophobicContact CB-CE2 4.41Å; K774-F778 WeakPolarHBondContact O-CD2 3.23Å; K774-F778 PolarHBondContact O-N 2.79Å
775	P	85.3	Confident	79.6	Confident	41 Å²	41	60 Å²	60	27%	0.266	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-35	176.6	-23.9	34.7	0	0	0	113.8	F778 T779 L826	P775-F778 PolarHBondContact O-N 3.48Å; P775-T779 WeakPolarHBondContact O-CB 3.49Å; P775-T779 PolarHBondContact O-N 2.95Å; P775-T779 PolarHBondContact O-OG1 3.43Å; P775-L826 HydrophobicContact CB-CD2 4.29Å
776	I	86.9	Confident	80.6	Confident	2 Å²	2	58.5 Å²	58.5	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-62.1	-46.4	173.4	-70.6	173.4	0	0	0	110.9	M659 K662 T663 I666 E772 A773 K774 T779 M780 L826	M659-I776 HydrophobicContact CE-CB 4.36Å; M659-I776 HydrophobicContact CE-CG2 3.8Å; M659-I776 WeakPolarHBondContact CE-O 3.34Å; K662-I776 HydrophobicContact CD-CD1 4.43Å; K662-I776 HydrophobicContact CG-CD1 4.38Å; T663-I776 HydrophobicContact CG2-CG2 4.38Å; T663-I776 WeakPolarHBondContact OG1-CG2 3.34Å; I666-I776 HydrophobicContact CD1-CD1 3.91Å; E772-I776 HydrophobicContact CG-CD1 3.93Å; E772-I776 WeakPolarHBondContact O-CD1 3.44Å; E772-I776 VanDerWaalsContact O-CG1 3.26Å; E772-I776 WeakPolarHBondContact O-CG1 3.38Å; A773-I776 PolarHBondContact O-N 3.22Å; K774-I776 VanDerWaalsContact C-N 3.3Å; K774-I776 PolarHBondContact O-N 2.79Å; I776-T779 PolarHBondContact O-N 2.89Å; I776-M780 WeakPolarHBondContact O-CG 3.48Å; I776-M780 PolarHBondContact O-N 3.17Å; I776-L826 HydrophobicContact CB-CD2 4.33Å; I776-L826 HydrophobicContact CG1-CD2 3.59Å
777	G	86.8	Confident	81.4	Confident	5 Å²	5	58 Å²	58	5%	0.052	30%	0.297	C	S	.	.	H	α-helix	trans	-58.8	-48.8	175.8	0	0	0	0	0	112.8	A773 K774 T779 M780 Y781	A773-G777 PolarHBondContact O-N 2.95Å; K774-G777 PolarHBondContact O-N 3.39Å; G777-T779 PolarHBondContact O-N 3.32Å; G777-M780 PolarHBondContact O-N 3.47Å; G777-Y781 WeakPolarHBondContact O-CD2 3.32Å; G777-Y781 WeakPolarHBondContact O-CE2 3.48Å; G777-Y781 PolarHBondContact O-N 2.68Å
778	F	88.3	Confident	82.5	Confident	124 Å²	124	60.7 Å²	60.7	54%	0.544	31%	0.307	S	S	.	.	H	α-helix	trans	-60.2	-43.9	177.3	-72.1	-60.4	0	0	0	112.5	K774 P775 M780 Y781 T782 M825	K774-F778 HydrophobicContact CB-CE2 4.41Å; K774-F778 WeakPolarHBondContact O-CD2 3.23Å; K774-F778 PolarHBondContact O-N 2.79Å; P775-F778 PolarHBondContact O-N 3.48Å; F778-M780 VanDerWaalsContact C-N 3.34Å; F778-M780 PolarHBondContact O-N 2.92Å; F778-Y781 PolarHBondContact O-N 3.42Å; F778-T782 PolarHBondContact O-N 2.85Å; F778-T782 PolarHBondContact O-OG1 3.23Å; F778-T782 VanDerWaalsContact O-OG1 3.13Å; F778-M825 HydrophobicContact CB-SD 3.83Å
779	T	90.6	Very high	83.9	Confident	0 Å²	0	56.9 Å²	56.9	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-56.4	-49.3	175.8	-56.3	0	0	0	0	110.8	M659 P775 I776 G777 T782 T783 V821 M825 L826	M659-T779 HydrophobicContact CE-CG2 3.61Å; M659-T779 HydrophobicContact SD-CG2 4.24Å; P775-T779 WeakPolarHBondContact O-CB 3.49Å; P775-T779 PolarHBondContact O-N 2.95Å; P775-T779 PolarHBondContact O-OG1 3.43Å; I776-T779 PolarHBondContact O-N 2.89Å; G777-T779 PolarHBondContact O-N 3.32Å; T779-T782 PolarHBondContact O-N 3.19Å; T779-T783 VanDerWaalsContact O-CG2 3.3Å; T779-T783 WeakPolarHBondContact O-CG2 3.42Å; T779-T783 PolarHBondContact O-N 3.16Å; T779-T783 PolarHBondContact O-OG1 3.16Å; T779-T783 VanDerWaalsContact O-OG1 3.1Å; T779-V821 HydrophobicContact CG2-CG1 4.25Å; T779-M825 WeakPolarHBondContact OG1-CB 3.44Å; T779-L826 HydrophobicContact CG2-CD1 4.2Å; T779-L826 HydrophobicContact CG2-CG 4.32Å; T779-L826 WeakPolarHBondContact OG1-CG 3.48Å
780	M	89.9	Confident	85.4	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62.5	-46.7	179.7	-69.6	-49.4	-53.9	0	0	112.5	Y656 M659 M753 C756 T757 A760 I776 G777 F778 T782 T783 C784	Y656-M780 HydrophobicContact CD1-CE 4.46Å; Y656-M780 HydrophobicContact CE1-CE 4.4Å; M659-M780 HydrophobicContact CE-CG 3.53Å; M659-M780 HydrophobicContact CE-SD 3.3Å; M659-M780 WeakPolarHBondContact CE-SD 3.33Å; M659-M780 HydrophobicContact CG-SD 4.2Å; M659-M780 HydrophobicContact SD-CG 4.42Å; M659-M780 HydrophobicContact SD-SD 3.4Å; M753-M780 HydrophobicContact CB-CE 4.3Å; M753-M780 HydrophobicContact CG-CE 3.58Å; M753-M780 WeakPolarHBondContact O-CE 3.23Å; C756-M780 HydrophobicContact CB-CE 3.58Å; C756-M780 HydrophobicContact CB-SD 3.98Å; C756-M780 PolarHBondContact SG-SD 2.87Å; T757-M780 WeakPolarHBondContact OG1-CE 3.28Å; A760-M780 HydrophobicContact CB-CG 4.27Å; I776-M780 WeakPolarHBondContact O-CG 3.48Å; I776-M780 PolarHBondContact O-N 3.17Å; G777-M780 PolarHBondContact O-N 3.47Å; F778-M780 VanDerWaalsContact C-N 3.34Å; F778-M780 PolarHBondContact O-N 2.92Å; M780-T782 PolarHBondContact O-N 2.84Å; M780-T783 WeakPolarHBondContact CA-OG1 3.46Å; M780-T783 PolarHBondContact O-N 3.08Å; M780-T783 PolarHBondContact O-OG1 3.38Å; M780-C784 PolarHBondContact O-N 3.02Å; M780-C784 PolarHBondContact O-SG 3.32Å; M780-C784 VanDerWaalsContact O-SG 3.38Å
781	Y	90.7	Very high	86.6	Confident	67 Å²	67	47.7 Å²	47.7	26%	0.263	25%	0.252	S	S	.	.	H	α-helix	trans	-60.8	-46	-179.9	-58.1	-35.6	0	0	0	112.2	T757 I761 G777 F778 C784 I785	T757-Y781 HydrophobicContact CG2-CD1 3.97Å; T757-Y781 HydrophobicContact CG2-CE1 3.99Å; I761-Y781 HydrophobicContact CD1-CE1 4.31Å; I761-Y781 HydrophobicContact CG1-CE1 3.78Å; I761-Y781 WeakPolarHBondContact CG1-OH 3.29Å; G777-Y781 WeakPolarHBondContact O-CD2 3.32Å; G777-Y781 WeakPolarHBondContact O-CE2 3.48Å; G777-Y781 PolarHBondContact O-N 2.68Å; F778-Y781 PolarHBondContact O-N 3.42Å; Y781-C784 PolarHBondContact O-N 3.44Å; Y781-I785 WeakPolarHBondContact O-CG1 3.34Å; Y781-I785 PolarHBondContact O-N 2.66Å
782	T	91.9	Very high	87.8	Confident	45 Å²	45	45.5 Å²	45.5	28%	0.276	25%	0.245	S	C	.	.	H	α-helix	trans	-65.7	-40.7	178.9	-57.9	0	0	0	0	111.4	F778 T779 M780 C784 I785 I786 V821 M825	F778-T782 PolarHBondContact O-N 2.85Å; F778-T782 PolarHBondContact O-OG1 3.23Å; F778-T782 VanDerWaalsContact O-OG1 3.13Å; T779-T782 PolarHBondContact O-N 3.19Å; M780-T782 PolarHBondContact O-N 2.84Å; T782-C784 PolarHBondContact O-N 3.32Å; T782-I785 PolarHBondContact O-N 2.73Å; T782-I786 HydrophobicContact CG2-CD1 4.3Å; T782-I786 WeakPolarHBondContact O-CG1 3.48Å; T782-I786 PolarHBondContact O-N 2.96Å; T782-V821 HydrophobicContact CG2-CB 4.46Å; T782-V821 HydrophobicContact CG2-CG1 3.83Å; T782-V821 HydrophobicContact CG2-CG2 3.74Å; T782-M825 HydrophobicContact CG2-CE 4.43Å
783	T	90.9	Very high	88.4	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.3	-37.8	175.6	56.8	0	0	0	0	113	T779 M780 I785 I786 W787 S818 V821	T779-T783 VanDerWaalsContact O-CG2 3.3Å; T779-T783 WeakPolarHBondContact O-CG2 3.42Å; T779-T783 PolarHBondContact O-N 3.16Å; T779-T783 PolarHBondContact O-OG1 3.16Å; T779-T783 VanDerWaalsContact O-OG1 3.1Å; M780-T783 WeakPolarHBondContact CA-OG1 3.46Å; M780-T783 PolarHBondContact O-N 3.08Å; M780-T783 PolarHBondContact O-OG1 3.38Å; T783-I785 VanDerWaalsContact C-N 3.35Å; T783-I785 PolarHBondContact O-N 3.1Å; T783-I786 PolarHBondContact O-N 3.44Å; T783-W787 VanDerWaalsContact O-CD1 3.27Å; T783-W787 PolarHBondContact O-N 3.37Å; T783-W787 VanDerWaalsContact O-N 3.13Å; T783-S818 WeakPolarHBondContact CG2-OG 3.44Å; T783-V821 HydrophobicContact CG2-CB 4.44Å; T783-V821 HydrophobicContact CG2-CG1 4.19Å
784	C	91	Very high	88.6	Confident	23 Å²	23	47.3 Å²	47.3	16%	0.155	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-40.3	175.5	-72.7	0	0	0	0	112.3	T757 M780 Y781 T782 W787 L788	T757-C784 PolarHBondContact OG1-SG 2.91Å; M780-C784 PolarHBondContact O-N 3.02Å; M780-C784 PolarHBondContact O-SG 3.32Å; M780-C784 VanDerWaalsContact O-SG 3.38Å; Y781-C784 PolarHBondContact O-N 3.44Å; T782-C784 PolarHBondContact O-N 3.32Å; C784-W787 PolarHBondContact O-N 3.45Å; C784-L788 WeakPolarHBondContact O-CB 3.35Å; C784-L788 VanDerWaalsContact O-CG 3.3Å; C784-L788 WeakPolarHBondContact O-CG 3.39Å; C784-L788 PolarHBondContact O-N 3.5Å
785	I	92.4	Very high	88.7	Confident	116 Å²	116	47.5 Å²	47.5	60%	0.595	25%	0.254	S	S	*	.	H	α-helix	trans	-63.4	-43.2	177.6	-67.2	166.7	0	0	0	110.9	Y781 T782 T783 W787 L788 A789	Y781-I785 WeakPolarHBondContact O-CG1 3.34Å; Y781-I785 PolarHBondContact O-N 2.66Å; T782-I785 PolarHBondContact O-N 2.73Å; T783-I785 VanDerWaalsContact C-N 3.35Å; T783-I785 PolarHBondContact O-N 3.1Å; I785-W787 VanDerWaalsContact C-N 3.34Å; I785-W787 PolarHBondContact O-N 3.48Å; I785-L788 PolarHBondContact O-N 3.01Å; I785-A789 PolarHBondContact O-N 2.97Å
786	I	91.9	Very high	88.5	Confident	28 Å²	28	48.6 Å²	48.6	14%	0.144	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-45.7	177.7	-66.8	164.5	0	0	0	110.8	T782 T783 A789 F790 L817 V821	T782-I786 HydrophobicContact CG2-CD1 4.3Å; T782-I786 WeakPolarHBondContact O-CG1 3.48Å; T782-I786 PolarHBondContact O-N 2.96Å; T783-I786 PolarHBondContact O-N 3.44Å; I786-A789 PolarHBondContact O-N 3.32Å; I786-F790 PolarHBondContact O-N 3.42Å; I786-L817 HydrophobicContact CD1-CB 4.09Å; I786-V821 HydrophobicContact CD1-CG2 3.96Å
787	W	90	Very high	88.2	Confident	9 Å²	9	49.7 Å²	49.7	3%	0.034	28%	0.28	C	S	.	.	H	α-helix	trans	-72.6	-32.4	179.8	-78.8	104.4	0	0	0	113.4	M652 L746 I750 M753 T783 C784 I785 A789 F790 V791 M815	M652-W787 HydrophobicContact CE-CZ2 3.59Å; M652-W787 HydrophobicContact SD-CZ2 4.23Å; L746-W787 HydrophobicContact CD1-CH2 4.18Å; L746-W787 HydrophobicContact CD1-CZ3 4.1Å; L746-W787 HydrophobicContact CD2-CH2 4.35Å; I750-W787 HydrophobicContact CD1-CE3 4.47Å; M753-W787 HydrophobicContact CE-CB 3.94Å; M753-W787 HydrophobicContact CE-CG 4.14Å; M753-W787 HydrophobicContact SD-CB 4.41Å; M753-W787 VanDerWaalsContact SD-CD1 3.51Å; M753-W787 HydrophobicContact SD-CG 4.16Å; T783-W787 VanDerWaalsContact O-CD1 3.27Å; T783-W787 PolarHBondContact O-N 3.37Å; T783-W787 VanDerWaalsContact O-N 3.13Å; C784-W787 PolarHBondContact O-N 3.45Å; I785-W787 VanDerWaalsContact C-N 3.34Å; I785-W787 PolarHBondContact O-N 3.48Å; W787-A789 VanDerWaalsContact C-N 3.31Å; W787-F790 HydrophobicContact CE3-CB 4.39Å; W787-F790 AromaticContact CE3-CD1 3.75Å; W787-F790 HydrophobicContact CE3-CD1 3.75Å; W787-F790 HydrophobicContact CE3-CE1 4.41Å; W787-F790 HydrophobicContact CE3-CG 4.21Å; W787-F790 AromaticContact CZ3-CD1 3.74Å; W787-F790 HydrophobicContact CZ3-CD1 3.74Å; W787-F790 AromaticContact CZ3-CE1 3.98Å; W787-F790 HydrophobicContact CZ3-CE1 3.98Å; W787-F790 HydrophobicContact CZ3-CG 4.26Å; W787-F790 PolarHBondContact O-N 3.25Å; W787-V791 PolarHBondContact O-N 3.46Å; W787-M815 HydrophobicContact CH2-CE 4.19Å; W787-M815 HydrophobicContact CH2-CG 4.2Å; W787-M815 HydrophobicContact CZ2-CG 4.24Å
788	L	89.1	Confident	87.4	Confident	130 Å²	130	51.5 Å²	51.5	68%	0.681	30%	0.295	S	S	*	.	H	α-helix	trans	-65.2	-34.8	171.6	-75.7	173.3	0	0	0	112.2	C784 I785 P792	C784-L788 WeakPolarHBondContact O-CB 3.35Å; C784-L788 VanDerWaalsContact O-CG 3.3Å; C784-L788 WeakPolarHBondContact O-CG 3.39Å; C784-L788 PolarHBondContact O-N 3.5Å; I785-L788 PolarHBondContact O-N 3.01Å; L788-P792 WeakPolarHBondContact O-CD 3.4Å
789	A	90.1	Very high	86.3	Confident	49 Å²	49	54.9 Å²	54.9	41%	0.405	31%	0.312	S	S	.	.	H	α-helix	trans	-74.3	-33.4	174.9	0	0	0	0	0	112.8	I785 I786 W787 P792 I793	I785-A789 PolarHBondContact O-N 2.97Å; I786-A789 PolarHBondContact O-N 3.32Å; W787-A789 VanDerWaalsContact C-N 3.31Å; A789-P792 WeakPolarHBondContact O-CD 3.37Å; A789-P792 WeakPolarHBondContact O-CG 3.46Å; A789-I793 VanDerWaalsContact O-CD1 3.32Å; A789-I793 WeakPolarHBondContact O-CD1 3.14Å; A789-I793 VanDerWaalsContact O-CG1 3.3Å; A789-I793 WeakPolarHBondContact O-CG1 3.32Å
790	F	88.8	Confident	85.4	Confident	11 Å²	11	57.3 Å²	57.3	5%	0.048	33%	0.329	C	S	.	.	H	α-helix	trans	-60.6	-47.4	179.5	165.2	-99.9	0	0	0	113.1	I786 W787 I793 F794 T810 L811	I786-F790 PolarHBondContact O-N 3.42Å; W787-F790 HydrophobicContact CE3-CB 4.39Å; W787-F790 AromaticContact CE3-CD1 3.75Å; W787-F790 HydrophobicContact CE3-CD1 3.75Å; W787-F790 HydrophobicContact CE3-CE1 4.41Å; W787-F790 HydrophobicContact CE3-CG 4.21Å; W787-F790 AromaticContact CZ3-CD1 3.74Å; W787-F790 HydrophobicContact CZ3-CD1 3.74Å; W787-F790 AromaticContact CZ3-CE1 3.98Å; W787-F790 HydrophobicContact CZ3-CE1 3.98Å; W787-F790 HydrophobicContact CZ3-CG 4.26Å; W787-F790 PolarHBondContact O-N 3.25Å; F790-I793 PolarHBondContact O-N 3.01Å; F790-F794 HydrophobicContact CE1-CB 4.28Å; F790-F794 HydrophobicContact CE1-CG 4.45Å; F790-F794 HydrophobicContact CE2-CB 4.02Å; F790-F794 AromaticContact CE2-CD2 3.92Å; F790-F794 HydrophobicContact CE2-CD2 3.92Å; F790-F794 HydrophobicContact CE2-CG 4.29Å; F790-F794 HydrophobicContact CZ-CB 3.84Å; F790-F794 AromaticContact CZ-CD2 3.61Å; F790-F794 HydrophobicContact CZ-CD2 3.61Å; F790-F794 HydrophobicContact CZ-CE2 4.39Å; F790-F794 AromaticContact CZ-CG 3.82Å; F790-F794 HydrophobicContact CZ-CG 3.82Å; F790-F794 WeakPolarHBondContact O-CB 3.42Å; F790-F794 PolarHBondContact O-N 3.34Å; F790-T810 HydrophobicContact CD2-CG2 4.03Å; F790-T810 HydrophobicContact CE2-CG2 4.41Å; F790-L811 HydrophobicContact CE1-CD1 4.39Å; F790-L811 HydrophobicContact CE2-CB 4.03Å; F790-L811 HydrophobicContact CE2-CD1 3.72Å; F790-L811 HydrophobicContact CZ-CD1 3.57Å
791	V	84.9	Confident	84	Confident	66 Å²	66	62.8 Å²	62.8	40%	0.4	36%	0.363	S	S	.	.	H	α-helix	trans	-54.5	-53.3	-174.1	175.8	0	0	0	0	113.2	W787 I793 F794 F795	W787-V791 PolarHBondContact O-N 3.46Å; V791-I793 VanDerWaalsContact C-N 3.34Å; V791-I793 PolarHBondContact O-N 3Å; V791-F794 PolarHBondContact O-N 3.13Å; V791-F795 HydrophobicContact CG1-CD2 4.14Å; V791-F795 HydrophobicContact CG1-CE2 4.18Å; V791-F795 WeakPolarHBondContact O-CD2 3.46Å; V791-F795 PolarHBondContact O-N 3.2Å
792	P	87.5	Confident	83.1	Confident	84 Å²	84	63.5 Å²	63.5	55%	0.545	37%	0.369	S	S	.	.	H	α-helix	trans	-66.3	-32.3	179.1	24.6	-33.5	0	0	0	113.4	L788 A789 G796	L788-P792 WeakPolarHBondContact O-CD 3.4Å; A789-P792 WeakPolarHBondContact O-CD 3.37Å; A789-P792 WeakPolarHBondContact O-CG 3.46Å; P792-G796 PolarHBondContact O-N 3.33Å
793	I	87.7	Confident	82.5	Confident	81 Å²	81	63.3 Å²	63.3	42%	0.415	36%	0.364	S	S	.	.	H	α-helix	trans	-68.7	-40.5	177.8	-61.4	169.2	0	0	0	110.8	A789 F790 V791 F795 T797 T810	A789-I793 VanDerWaalsContact O-CD1 3.32Å; A789-I793 WeakPolarHBondContact O-CD1 3.14Å; A789-I793 VanDerWaalsContact O-CG1 3.3Å; A789-I793 WeakPolarHBondContact O-CG1 3.32Å; F790-I793 PolarHBondContact O-N 3.01Å; V791-I793 VanDerWaalsContact C-N 3.34Å; V791-I793 PolarHBondContact O-N 3Å; I793-F795 PolarHBondContact O-N 3.47Å; I793-T797 VanDerWaalsContact O-CG2 3.29Å; I793-T797 WeakPolarHBondContact O-CG2 3.36Å; I793-T797 PolarHBondContact O-N 3.05Å; I793-T797 PolarHBondContact O-OG1 2.86Å; I793-T810 HydrophobicContact CB-CG2 4.2Å; I793-T810 HydrophobicContact CG2-CG2 3.62Å
794	F	84.7	Confident	81.8	Confident	3 Å²	3	64.8 Å²	64.8	1%	0.013	37%	0.371	C	S	.	.	H	α-helix	trans	-63.7	-40.7	-179.7	-176.4	-94.1	0	0	0	112.8	D739 L742 I743 F790 V791 T797 Q807	D739-F794 HydrophobicContact CB-CE1 4.38Å; L742-F794 HydrophobicContact CD1-CE2 4.37Å; L742-F794 HydrophobicContact CD1-CZ 4.34Å; L742-F794 HydrophobicContact CD2-CE2 4.1Å; L742-F794 HydrophobicContact CD2-CZ 4.01Å; I743-F794 HydrophobicContact CD1-CE1 4.41Å; F790-F794 HydrophobicContact CE1-CB 4.28Å; F790-F794 HydrophobicContact CE1-CG 4.45Å; F790-F794 HydrophobicContact CE2-CB 4.02Å; F790-F794 AromaticContact CE2-CD2 3.92Å; F790-F794 HydrophobicContact CE2-CD2 3.92Å; F790-F794 HydrophobicContact CE2-CG 4.29Å; F790-F794 HydrophobicContact CZ-CB 3.84Å; F790-F794 AromaticContact CZ-CD2 3.61Å; F790-F794 HydrophobicContact CZ-CD2 3.61Å; F790-F794 HydrophobicContact CZ-CE2 4.39Å; F790-F794 AromaticContact CZ-CG 3.82Å; F790-F794 HydrophobicContact CZ-CG 3.82Å; F790-F794 WeakPolarHBondContact O-CB 3.42Å; F790-F794 PolarHBondContact O-N 3.34Å; V791-F794 PolarHBondContact O-N 3.13Å; F794-T797 PolarHBondContact O-OG1 3.31Å; F794-Q807 HydrophobicContact CD2-CB 4.16Å; F794-Q807 HydrophobicContact CD2-CG 4.07Å; F794-Q807 HydrophobicContact CE2-CB 3.88Å; F794-Q807 HydrophobicContact CE2-CG 3.99Å; F794-Q807 PolarHBondContact O-NE2 2.78Å
795	F	83.3	Confident	81.4	Confident	113 Å²	113	65.6 Å²	65.6	50%	0.496	37%	0.372	S	S	.	.	H	α-helix	trans	-83.5	-34.4	178.6	-74.3	-68	0	0	0	113.6	I743 V791 I793 T797 A798	I743-F795 HydrophobicContact CD1-CE1 3.93Å; I743-F795 HydrophobicContact CD1-CE2 4.02Å; I743-F795 HydrophobicContact CD1-CZ 3.27Å; V791-F795 HydrophobicContact CG1-CD2 4.14Å; V791-F795 HydrophobicContact CG1-CE2 4.18Å; V791-F795 WeakPolarHBondContact O-CD2 3.46Å; V791-F795 PolarHBondContact O-N 3.2Å; I793-F795 PolarHBondContact O-N 3.47Å; F795-T797 PolarHBondContact O-N 2.71Å; F795-A798 VanDerWaalsContact O-CB 3.23Å; F795-A798 WeakPolarHBondContact O-CB 3.18Å; F795-A798 PolarHBondContact O-N 3.34Å
796	G	81.2	Confident	81	Confident	65 Å²	65	61.5 Å²	61.5	67%	0.67	35%	0.351	S	S	*	.	H	α-helix	trans	-64.6	-21.2	178.9	0	0	0	0	0	113.9	P792	P792-G796 PolarHBondContact O-N 3.33Å
797	T	81.4	Confident	80.6	Confident	25 Å²	25	60.9 Å²	60.9	15%	0.153	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92	1.6	-179.5	52.4	0	0	0	0	113.3	I793 F794 F795 Q799 S800 I806	I793-T797 VanDerWaalsContact O-CG2 3.29Å; I793-T797 WeakPolarHBondContact O-CG2 3.36Å; I793-T797 PolarHBondContact O-N 3.05Å; I793-T797 PolarHBondContact O-OG1 2.86Å; F794-T797 PolarHBondContact O-OG1 3.31Å; F795-T797 PolarHBondContact O-N 2.71Å; T797-Q799 PolarHBondContact O-N 3.2Å; T797-Q799 VanDerWaalsContact O-N 3.16Å; T797-S800 PolarHBondContact O-N 3.06Å; T797-I806 HydrophobicContact CG2-CB 4.49Å; T797-I806 HydrophobicContact CG2-CG2 3.55Å
798	A	68.1	Low	80.4	Confident	43 Å²	43	61.4 Å²	61.4	36%	0.355	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-16.6	-176.9	0	0	0	0	0	114.7	F795	F795-A798 VanDerWaalsContact O-CB 3.23Å; F795-A798 WeakPolarHBondContact O-CB 3.18Å; F795-A798 PolarHBondContact O-N 3.34Å
799	Q	65.6	Low	80.4	Confident	195 Å²	195	56.1 Å²	56.1	91%	0.911	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.6	-1.5	179.1	-66.8	-173.8	-19.6	0	0	114.2	T797	T797-Q799 PolarHBondContact O-N 3.2Å; T797-Q799 VanDerWaalsContact O-N 3.16Å
800	S	71.3	Confident	80.4	Confident	50 Å²	50	55 Å²	55	35%	0.35	31%	0.313	S	S	.	.	S	Bend	trans	-80	144.4	-178	-178.8	0	0	0	0	111.9	T797 E802 K803	T797-S800 PolarHBondContact O-N 3.06Å; S800-E802 PolarHBondContact O-N 2.75Å; S800-E802 VanDerWaalsContact O-N 3.14Å; S800-E802 PolarHBondContact OG-N 3.44Å; S800-K803 VanDerWaalsContact O-CB 3.28Å; S800-K803 WeakPolarHBondContact O-CB 2.9Å; S800-K803 PolarHBondContact O-N 2.94Å
801	T	62	Low	80.4	Confident	116 Å²	116	54.6 Å²	54.6	71%	0.712	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-17.9	170.7	47.1	0	0	0	0	113
802	E	70.9	Confident	80.6	Confident	82 Å²	82	51.6 Å²	51.6	38%	0.383	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107	22	175.6	-62	-171.5	169.2	0	0	112.8	W576 S800 M804 F805 I806	W576-E802 PolarHBondContact NE1-OE2 3.23Å; S800-E802 PolarHBondContact O-N 2.75Å; S800-E802 VanDerWaalsContact O-N 3.14Å; S800-E802 PolarHBondContact OG-N 3.44Å; E802-M804 VanDerWaalsContact C-N 3.28Å; E802-M804 PolarHBondContact O-N 2.8Å; E802-M804 VanDerWaalsContact O-N 3.13Å; E802-F805 HydrophobicContact CB-CB 4.44Å; E802-F805 HydrophobicContact CB-CD2 4.02Å; E802-F805 HydrophobicContact CG-CD2 4.34Å; E802-F805 WeakPolarHBondContact O-CB 3.45Å; E802-F805 PolarHBondContact O-N 2.89Å; E802-I806 HydrophobicContact CB-CD1 4.12Å; E802-I806 HydrophobicContact CB-CG1 4.32Å; E802-I806 PolarHBondContact O-N 3.48Å; E802-I806 VanDerWaalsContact O-N 3.08Å
803	K	79.3	Confident	80.8	Confident	40 Å²	40	49.1 Å²	49.1	17%	0.174	28%	0.277	C	S	.	.	H	α-helix	trans	-41.6	-52.8	-177.2	175.9	-172.8	177.2	-172.4	0	112.8	D739 S800 F805 I806 Q807	D739-K803 IonicContact OD1-NZ 3.59Å; D739-K803 WeakPolarHBondContact OD2-CE 3.41Å; D739-K803 IonicContact OD2-NZ 2.71Å; D739-K803 PolarHBondContact OD2-NZ 3.49Å; S800-K803 VanDerWaalsContact O-CB 3.28Å; S800-K803 WeakPolarHBondContact O-CB 2.9Å; S800-K803 PolarHBondContact O-N 2.94Å; K803-F805 PolarHBondContact O-N 3.29Å; K803-I806 PolarHBondContact O-N 3.37Å; K803-Q807 VanDerWaalsContact CE-OE1 3.23Å; K803-Q807 HydrophobicContact CG-CG 4.29Å; K803-Q807 WeakPolarHBondContact O-CB 3.3Å; K803-Q807 WeakPolarHBondContact O-CG 3.45Å; K803-Q807 PolarHBondContact O-N 3Å
804	M	77.1	Confident	81	Confident	32 Å²	32	45.9 Å²	45.9	16%	0.158	26%	0.261	C	S	.	.	H	α-helix	trans	-60.1	-44.2	-177.6	179.9	-174.4	170.5	0	0	112.7	I732 K734 E802 T808	I732-M804 HydrophobicContact CG2-SD 3.36Å; I732-M804 WeakPolarHBondContact CG2-SD 3.49Å; K734-M804 HydrophobicContact CB-CE 4.36Å; K734-M804 HydrophobicContact CB-SD 4.4Å; E802-M804 VanDerWaalsContact C-N 3.28Å; E802-M804 PolarHBondContact O-N 2.8Å; E802-M804 VanDerWaalsContact O-N 3.13Å; M804-T808 WeakPolarHBondContact O-CB 3.33Å; M804-T808 PolarHBondContact O-N 3.27Å; M804-T808 PolarHBondContact O-OG1 2.88Å
805	F	81.5	Confident	81.3	Confident	40 Å²	40	45.9 Å²	45.9	18%	0.175	26%	0.261	C	S	.	.	H	α-helix	trans	-64.4	-46.7	-178.5	-62.7	-74	0	0	0	110.8	L570 W576 E802 K803 T809	L570-F805 HydrophobicContact CB-CE1 4.44Å; L570-F805 HydrophobicContact CD1-CD1 3.42Å; L570-F805 VanDerWaalsContact CD1-CD1 3.42Å; L570-F805 HydrophobicContact CD1-CE1 3.59Å; W576-F805 HydrophobicContact CG-CB 4.24Å; E802-F805 HydrophobicContact CB-CB 4.44Å; E802-F805 HydrophobicContact CB-CD2 4.02Å; E802-F805 HydrophobicContact CG-CD2 4.34Å; E802-F805 WeakPolarHBondContact O-CB 3.45Å; E802-F805 PolarHBondContact O-N 2.89Å; K803-F805 PolarHBondContact O-N 3.29Å; F805-T809 WeakPolarHBondContact O-CB 3.3Å; F805-T809 PolarHBondContact O-N 3.41Å; F805-T809 PolarHBondContact O-OG1 3.46Å
806	I	83.7	Confident	81.8	Confident	30 Å²	30	40.6 Å²	40.6	15%	0.154	24%	0.238	C	C	.	.	H	α-helix	trans	-70	-49.1	-176.4	-60.3	170.6	0	0	0	110.4	W576 T797 E802 K803 T808 T809 T810	W576-I806 HydrophobicContact CH2-CG1 4.26Å; W576-I806 HydrophobicContact CZ2-CG1 4.42Å; W576-I806 HydrophobicContact CZ3-CG1 4.48Å; T797-I806 HydrophobicContact CG2-CB 4.49Å; T797-I806 HydrophobicContact CG2-CG2 3.55Å; E802-I806 HydrophobicContact CB-CD1 4.12Å; E802-I806 HydrophobicContact CB-CG1 4.32Å; E802-I806 PolarHBondContact O-N 3.48Å; E802-I806 VanDerWaalsContact O-N 3.08Å; K803-I806 PolarHBondContact O-N 3.37Å; I806-T808 PolarHBondContact O-N 3.12Å; I806-T809 PolarHBondContact O-N 3.1Å; I806-T810 WeakPolarHBondContact O-CB 3.18Å; I806-T810 PolarHBondContact O-N 3.38Å; I806-T810 PolarHBondContact O-OG1 3.37Å
807	Q	85.2	Confident	82.3	Confident	15 Å²	15	41 Å²	41	7%	0.07	23%	0.225	C	C	.	.	H	α-helix	trans	-60.9	-42.6	-178.5	-74.4	-176.6	-29.2	0	0	112.7	F794 K803 L811	F794-Q807 HydrophobicContact CD2-CB 4.16Å; F794-Q807 HydrophobicContact CD2-CG 4.07Å; F794-Q807 HydrophobicContact CE2-CB 3.88Å; F794-Q807 HydrophobicContact CE2-CG 3.99Å; F794-Q807 PolarHBondContact O-NE2 2.78Å; K803-Q807 VanDerWaalsContact CE-OE1 3.23Å; K803-Q807 HydrophobicContact CG-CG 4.29Å; K803-Q807 WeakPolarHBondContact O-CB 3.3Å; K803-Q807 WeakPolarHBondContact O-CG 3.45Å; K803-Q807 PolarHBondContact O-N 3Å; Q807-L811 VanDerWaalsContact O-CB 3.31Å; Q807-L811 WeakPolarHBondContact O-CB 3.49Å; Q807-L811 PolarHBondContact O-N 3.08Å; Q807-L811 VanDerWaalsContact O-N 3.08Å
808	T	86.1	Confident	82.8	Confident	20 Å²	20	40 Å²	40	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-65.5	-41.9	178.3	-56.4	0	0	0	0	111.6	M632 M804 I806 T812	M632-T808 HydrophobicContact CB-CG2 4.28Å; M632-T808 HydrophobicContact CE-CG2 4.15Å; M804-T808 WeakPolarHBondContact O-CB 3.33Å; M804-T808 PolarHBondContact O-N 3.27Å; M804-T808 PolarHBondContact O-OG1 2.88Å; I806-T808 PolarHBondContact O-N 3.12Å; T808-T812 WeakPolarHBondContact O-CG2 3.41Å; T808-T812 PolarHBondContact O-N 3.15Å; T808-T812 VanDerWaalsContact O-N 3.16Å; T808-T812 PolarHBondContact O-OG1 3.04Å
809	T	88.4	Confident	84	Confident	18 Å²	18	38 Å²	38	11%	0.11	20%	0.202	C	C	.	.	H	α-helix	trans	-67.3	-48.9	179.2	-57.2	0	0	0	0	111.3	W576 P580 F805 I806 L811 T812 V813	W576-T809 HydrophobicContact CE3-CG2 4.36Å; W576-T809 WeakPolarHBondContact O-CG2 3.26Å; W576-T809 PolarHBondContact O-OG1 3.29Å; P580-T809 HydrophobicContact CG-CG2 3.87Å; F805-T809 WeakPolarHBondContact O-CB 3.3Å; F805-T809 PolarHBondContact O-N 3.41Å; F805-T809 PolarHBondContact O-OG1 3.46Å; I806-T809 PolarHBondContact O-N 3.1Å; T809-L811 VanDerWaalsContact C-N 3.32Å; T809-L811 PolarHBondContact O-N 2.89Å; T809-T812 PolarHBondContact O-N 2.82Å; T809-T812 PolarHBondContact O-OG1 3.05Å; T809-V813 HydrophobicContact CG2-CG2 4.35Å; T809-V813 WeakPolarHBondContact O-CB 3.44Å; T809-V813 VanDerWaalsContact O-CG2 3.27Å; T809-V813 WeakPolarHBondContact O-CG2 3.35Å; T809-V813 PolarHBondContact O-N 3.17Å
810	T	88.9	Confident	85.4	Confident	26 Å²	26	31.7 Å²	31.7	16%	0.16	18%	0.177	C	C	.	.	H	α-helix	trans	-59.7	-43.9	178.9	-55.3	0	0	0	0	111.2	F790 I793 I806 V813 S814	F790-T810 HydrophobicContact CD2-CG2 4.03Å; F790-T810 HydrophobicContact CE2-CG2 4.41Å; I793-T810 HydrophobicContact CB-CG2 4.2Å; I793-T810 HydrophobicContact CG2-CG2 3.62Å; I806-T810 WeakPolarHBondContact O-CB 3.18Å; I806-T810 PolarHBondContact O-N 3.38Å; I806-T810 PolarHBondContact O-OG1 3.37Å; T810-V813 PolarHBondContact O-N 3.5Å; T810-S814 WeakPolarHBondContact O-CB 3.38Å; T810-S814 PolarHBondContact O-N 3.47Å; T810-S814 PolarHBondContact O-OG 2.99Å; T810-S814 VanDerWaalsContact O-OG 3.09Å
811	L	88.9	Confident	86.4	Confident	2 Å²	2	30.4 Å²	30.4	1%	0.01	17%	0.167	C	C	.	.	H	α-helix	trans	-60.7	-48.8	179	-178	63	0	0	0	112.5	M632 L648 L742 L746 F790 Q807 T809 S814 M815	M632-L811 HydrophobicContact CE-CD2 4.04Å; L648-L811 HydrophobicContact CD1-CD2 3.92Å; L648-L811 HydrophobicContact CD1-CG 4.45Å; L742-L811 HydrophobicContact CD1-CD2 3.84Å; L742-L811 HydrophobicContact CD2-CD1 4.43Å; L742-L811 HydrophobicContact CD2-CD2 4.03Å; L742-L811 HydrophobicContact CG-CD2 4.27Å; L746-L811 HydrophobicContact CD1-CD1 3.82Å; F790-L811 HydrophobicContact CE1-CD1 4.39Å; F790-L811 HydrophobicContact CE2-CB 4.03Å; F790-L811 HydrophobicContact CE2-CD1 3.72Å; F790-L811 HydrophobicContact CZ-CD1 3.57Å; Q807-L811 VanDerWaalsContact O-CB 3.31Å; Q807-L811 WeakPolarHBondContact O-CB 3.49Å; Q807-L811 PolarHBondContact O-N 3.08Å; Q807-L811 VanDerWaalsContact O-N 3.08Å; T809-L811 VanDerWaalsContact C-N 3.32Å; T809-L811 PolarHBondContact O-N 2.89Å; L811-S814 PolarHBondContact O-N 2.98Å; L811-M815 HydrophobicContact CD1-CE 3.98Å; L811-M815 HydrophobicContact CG-CE 4.36Å; L811-M815 WeakPolarHBondContact O-CB 3.47Å; L811-M815 WeakPolarHBondContact O-CG 3.47Å; L811-M815 PolarHBondContact O-N 3.19Å
812	T	90.4	Very high	87.8	Confident	3 Å²	3	25.1 Å²	25.1	2%	0.018	14%	0.135	C	C	.	.	H	α-helix	trans	-67.8	-36.5	-179	50.5	0	0	0	0	112.7	P580 T629 M632 T808 T809 S816	P580-T812 WeakPolarHBondContact CB-OG1 3.46Å; T629-T812 HydrophobicContact CG2-CG2 4.31Å; M632-T812 HydrophobicContact CB-CG2 3.69Å; M632-T812 HydrophobicContact CG-CG2 3.97Å; T808-T812 WeakPolarHBondContact O-CG2 3.41Å; T808-T812 PolarHBondContact O-N 3.15Å; T808-T812 VanDerWaalsContact O-N 3.16Å; T808-T812 PolarHBondContact O-OG1 3.04Å; T809-T812 PolarHBondContact O-N 2.82Å; T809-T812 PolarHBondContact O-OG1 3.05Å; T812-S816 WeakPolarHBondContact O-CB 3.33Å; T812-S816 PolarHBondContact O-N 2.78Å; T812-S816 PolarHBondContact O-OG 3.06Å
813	V	91.8	Very high	88.8	Confident	33 Å²	33	21.6 Å²	21.6	20%	0.2	12%	0.119	C	C	.	.	H	α-helix	trans	-66.4	-47.3	174	171.8	0	0	0	0	111.2	P580 T809 T810 M815 S816 L817	P580-V813 HydrophobicContact CB-CG2 4.43Å; P580-V813 HydrophobicContact CG-CG2 3.98Å; T809-V813 HydrophobicContact CG2-CG2 4.35Å; T809-V813 WeakPolarHBondContact O-CB 3.44Å; T809-V813 VanDerWaalsContact O-CG2 3.27Å; T809-V813 WeakPolarHBondContact O-CG2 3.35Å; T809-V813 PolarHBondContact O-N 3.17Å; T810-V813 PolarHBondContact O-N 3.5Å; V813-M815 VanDerWaalsContact C-N 3.33Å; V813-M815 PolarHBondContact O-N 3.06Å; V813-S816 PolarHBondContact O-N 2.65Å; V813-L817 HydrophobicContact CG1-CD1 3.8Å; V813-L817 HydrophobicContact CG1-CG 4.26Å; V813-L817 WeakPolarHBondContact O-CB 3.43Å; V813-L817 WeakPolarHBondContact O-CG 3.18Å; V813-L817 PolarHBondContact O-N 3.39Å
814	S	91.3	Very high	89.3	Confident	13 Å²	13	20.9 Å²	20.9	9%	0.091	12%	0.122	C	C	.	.	H	α-helix	trans	-60	-42.4	177.9	-67.9	0	0	0	0	112.1	T810 L811 S818	T810-S814 WeakPolarHBondContact O-CB 3.38Å; T810-S814 PolarHBondContact O-N 3.47Å; T810-S814 PolarHBondContact O-OG 2.99Å; T810-S814 VanDerWaalsContact O-OG 3.09Å; L811-S814 PolarHBondContact O-N 2.98Å; S814-S818 WeakPolarHBondContact O-CB 3.4Å; S814-S818 PolarHBondContact O-N 3.37Å
815	M	90.9	Very high	89.8	Confident	3 Å²	3	22.6 Å²	22.6	2%	0.015	13%	0.13	C	C	.	.	H	α-helix	trans	-62.3	-47.9	174.2	-75.4	-170.2	172	0	0	112.4	I625 I628 L648 M652 L746 W787 L811 V813 L817 S818 A819	I625-M815 HydrophobicContact CG2-CB 3.95Å; I625-M815 WeakPolarHBondContact CG2-O 3.29Å; I628-M815 HydrophobicContact CG2-SD 4.48Å; L648-M815 HydrophobicContact CD1-CE 3.35Å; L648-M815 HydrophobicContact CD1-SD 3.9Å; L648-M815 HydrophobicContact CG-CE 3.89Å; M652-M815 HydrophobicContact CG-CE 4.47Å; L746-M815 HydrophobicContact CD1-CE 4.35Å; L746-M815 HydrophobicContact CD2-CE 3.44Å; L746-M815 VanDerWaalsContact CD2-CE 3.44Å; W787-M815 HydrophobicContact CH2-CE 4.19Å; W787-M815 HydrophobicContact CH2-CG 4.2Å; W787-M815 HydrophobicContact CZ2-CG 4.24Å; L811-M815 HydrophobicContact CD1-CE 3.98Å; L811-M815 HydrophobicContact CG-CE 4.36Å; L811-M815 WeakPolarHBondContact O-CB 3.47Å; L811-M815 WeakPolarHBondContact O-CG 3.47Å; L811-M815 PolarHBondContact O-N 3.19Å; V813-M815 VanDerWaalsContact C-N 3.33Å; V813-M815 PolarHBondContact O-N 3.06Å; M815-L817 PolarHBondContact O-N 2.75Å; M815-S818 WeakPolarHBondContact O-CB 3.33Å; M815-S818 PolarHBondContact O-N 2.77Å; M815-A819 PolarHBondContact O-N 3.42Å
816	S	93.1	Very high	90.1	Very high	1 Å²	1	21.2 Å²	21.2	1%	0.007	13%	0.125	C	C	.	.	H	α-helix	trans	-62.5	-41.7	179.6	-61.7	0	0	0	0	111.8	T812 V813 A819 T820	T812-S816 WeakPolarHBondContact O-CB 3.33Å; T812-S816 PolarHBondContact O-N 2.78Å; T812-S816 PolarHBondContact O-OG 3.06Å; V813-S816 PolarHBondContact O-N 2.65Å; S816-A819 PolarHBondContact O-N 2.91Å; S816-T820 WeakPolarHBondContact O-CB 3.44Å; S816-T820 PolarHBondContact O-N 3.13Å; S816-T820 PolarHBondContact O-OG1 3.09Å
817	L	92.9	Very high	90.4	Very high	74 Å²	74	19.8 Å²	19.8	39%	0.387	12%	0.118	S	C	.	.	H	α-helix	trans	-62.9	-42.5	175.3	-73.6	171	0	0	0	111.8	I786 V813 M815 A819 T820 V821	I786-L817 HydrophobicContact CD1-CB 4.09Å; V813-L817 HydrophobicContact CG1-CD1 3.8Å; V813-L817 HydrophobicContact CG1-CG 4.26Å; V813-L817 WeakPolarHBondContact O-CB 3.43Å; V813-L817 WeakPolarHBondContact O-CG 3.18Å; V813-L817 PolarHBondContact O-N 3.39Å; M815-L817 PolarHBondContact O-N 2.75Å; L817-A819 VanDerWaalsContact C-N 3.32Å; L817-A819 PolarHBondContact O-N 3.38Å; L817-T820 PolarHBondContact O-N 3.36Å; L817-V821 VanDerWaalsContact O-CG2 3.3Å; L817-V821 WeakPolarHBondContact O-CG2 3.47Å; L817-V821 PolarHBondContact O-N 3.48Å
818	S	92.3	Very high	90.5	Very high	3 Å²	3	23.8 Å²	23.8	2%	0.021	14%	0.138	C	C	.	.	H	α-helix	trans	-61	-40.6	176.5	-176.3	0	0	0	0	112.4	Y656 T783 S814 M815 S822	Y656-S818 PolarHBondContact OH-OG 3.15Å; T783-S818 WeakPolarHBondContact CG2-OG 3.44Å; S814-S818 WeakPolarHBondContact O-CB 3.4Å; S814-S818 PolarHBondContact O-N 3.37Å; M815-S818 WeakPolarHBondContact O-CB 3.33Å; M815-S818 PolarHBondContact O-N 2.77Å; S818-S822 PolarHBondContact O-N 3.46Å; S818-S822 PolarHBondContact O-OG 2.95Å
819	A	92.8	Very high	90.5	Very high	1 Å²	1	26 Å²	26	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-65.6	-43.4	173.6	0	0	0	0	0	112	I622 I625 Y626 M815 S816 L817 V821 S822 L823	I622-A819 HydrophobicContact CG2-CB 4.22Å; I625-A819 HydrophobicContact CB-CB 4.24Å; I625-A819 HydrophobicContact CG2-CB 3.85Å; Y626-A819 HydrophobicContact CD1-CB 4.49Å; Y626-A819 HydrophobicContact CD2-CB 4.42Å; Y626-A819 HydrophobicContact CE1-CB 3.91Å; Y626-A819 HydrophobicContact CE2-CB 3.82Å; M815-A819 PolarHBondContact O-N 3.42Å; S816-A819 PolarHBondContact O-N 2.91Å; L817-A819 VanDerWaalsContact C-N 3.32Å; L817-A819 PolarHBondContact O-N 3.38Å; A819-V821 PolarHBondContact O-N 2.95Å; A819-S822 WeakPolarHBondContact O-CB 3.06Å; A819-S822 PolarHBondContact O-N 3.45Å; A819-L823 PolarHBondContact O-N 3.31Å
820	T	94.1	Very high	90.4	Very high	64 Å²	64	26.8 Å²	26.8	39%	0.393	16%	0.155	S	C	.	.	H	α-helix	trans	-63.6	-41.3	179.9	-59.1	0	0	0	0	111.9	Y626 S816 L817 S822 L823 G824	Y626-T820 WeakPolarHBondContact OH-CA 3.47Å; Y626-T820 WeakPolarHBondContact OH-CB 3.44Å; Y626-T820 PolarHBondContact OH-N 2.74Å; Y626-T820 PolarHBondContact OH-OG1 2.65Å; S816-T820 WeakPolarHBondContact O-CB 3.44Å; S816-T820 PolarHBondContact O-N 3.13Å; S816-T820 PolarHBondContact O-OG1 3.09Å; L817-T820 PolarHBondContact O-N 3.36Å; T820-S822 VanDerWaalsContact C-N 3.33Å; T820-S822 PolarHBondContact O-N 2.76Å; T820-L823 PolarHBondContact O-N 2.99Å; T820-G824 WeakPolarHBondContact O-CA 3.27Å; T820-G824 PolarHBondContact O-N 3.2Å
821	V	93.7	Very high	90.3	Very high	23 Å²	23	26.6 Å²	26.6	14%	0.139	15%	0.154	C	C	.	.	H	α-helix	trans	-61.4	-44.4	175.2	170.2	0	0	0	0	110.6	T779 T782 T783 I786 L817 A819 G824 M825	T779-V821 HydrophobicContact CG2-CG1 4.25Å; T782-V821 HydrophobicContact CG2-CB 4.46Å; T782-V821 HydrophobicContact CG2-CG1 3.83Å; T782-V821 HydrophobicContact CG2-CG2 3.74Å; T783-V821 HydrophobicContact CG2-CB 4.44Å; T783-V821 HydrophobicContact CG2-CG1 4.19Å; I786-V821 HydrophobicContact CD1-CG2 3.96Å; L817-V821 VanDerWaalsContact O-CG2 3.3Å; L817-V821 WeakPolarHBondContact O-CG2 3.47Å; L817-V821 PolarHBondContact O-N 3.48Å; A819-V821 PolarHBondContact O-N 2.95Å; V821-G824 PolarHBondContact O-N 3.19Å; V821-M825 HydrophobicContact CG1-CE 4.18Å; V821-M825 HydrophobicContact CG1-CG 4.5Å; V821-M825 HydrophobicContact CG1-SD 4Å; V821-M825 WeakPolarHBondContact O-CB 3.22Å; V821-M825 PolarHBondContact O-N 3.3Å
822	S	90.7	Very high	90.2	Very high	4 Å²	4	32.2 Å²	32.2	3%	0.028	18%	0.176	C	C	.	.	H	α-helix	trans	-63.6	-42.1	178.4	-58.6	0	0	0	0	112.2	S818 A819 T820 L826	S818-S822 PolarHBondContact O-N 3.46Å; S818-S822 PolarHBondContact O-OG 2.95Å; A819-S822 WeakPolarHBondContact O-CB 3.06Å; A819-S822 PolarHBondContact O-N 3.45Å; T820-S822 VanDerWaalsContact C-N 3.33Å; T820-S822 PolarHBondContact O-N 2.76Å; S822-L826 VanDerWaalsContact O-CB 3.23Å; S822-L826 WeakPolarHBondContact O-CB 3.42Å; S822-L826 WeakPolarHBondContact O-CG 3.46Å; S822-L826 PolarHBondContact O-N 3.41Å
823	L	91.6	Very high	89.8	Confident	9 Å²	9	33.6 Å²	33.6	5%	0.047	18%	0.184	C	C	.	.	H	α-helix	trans	-67.1	-47.3	175.7	-169.4	67.8	0	0	0	111.5	A590 V594 L619 A819 T820 Y827 I828	A590-L823 HydrophobicContact CB-CD2 3.65Å; V594-L823 HydrophobicContact CB-CD1 4.22Å; V594-L823 HydrophobicContact CG1-CD1 4.45Å; V594-L823 HydrophobicContact CG2-CD1 3.82Å; V594-L823 HydrophobicContact CG2-CG 4.5Å; L619-L823 HydrophobicContact CD2-CD1 4.01Å; A819-L823 PolarHBondContact O-N 3.31Å; T820-L823 PolarHBondContact O-N 2.99Å; L823-Y827 WeakPolarHBondContact O-CB 3.35Å; L823-Y827 PolarHBondContact O-N 3.37Å; L823-Y827 VanDerWaalsContact O-N 3.09Å; L823-I828 PolarHBondContact O-N 3.12Å
824	G	89.9	Confident	89.4	Confident	24 Å²	24	32.3 Å²	32.3	25%	0.247	18%	0.176	C	C	.	.	H	α-helix	trans	-65.4	-48.8	-174.3	0	0	0	0	0	113.6	T820 V821 I828 P829	T820-G824 WeakPolarHBondContact O-CA 3.27Å; T820-G824 PolarHBondContact O-N 3.2Å; V821-G824 PolarHBondContact O-N 3.19Å; G824-I828 WeakPolarHBondContact O-CB 3.26Å; G824-P829 WeakPolarHBondContact O-CD 3.15Å
825	M	88.6	Confident	89.1	Confident	68 Å²	68	35.7 Å²	35.7	34%	0.335	19%	0.192	S	C	.	.	H	α-helix	trans	-83.2	-31.5	-174.6	-64.9	-172.1	-178.4	0	0	113	F778 T779 T782 V821	F778-M825 HydrophobicContact CB-SD 3.83Å; T779-M825 WeakPolarHBondContact OG1-CB 3.44Å; T782-M825 HydrophobicContact CG2-CE 4.43Å; V821-M825 HydrophobicContact CG1-CE 4.18Å; V821-M825 HydrophobicContact CG1-CG 4.5Å; V821-M825 HydrophobicContact CG1-SD 4Å; V821-M825 WeakPolarHBondContact O-CB 3.22Å; V821-M825 PolarHBondContact O-N 3.3Å
826	L	87.2	Confident	88.8	Confident	11 Å²	11	42 Å²	42	6%	0.058	22%	0.22	C	C	.	.	H	α-helix	trans	-92.4	-35.3	-175.2	-59.9	175.7	0	0	0	114.1	L618 M659 P775 I776 T779 S822 K830	L618-L826 HydrophobicContact CD2-CD1 4Å; M659-L826 HydrophobicContact CE-CD1 4.19Å; M659-L826 HydrophobicContact SD-CD1 4.37Å; P775-L826 HydrophobicContact CB-CD2 4.29Å; I776-L826 HydrophobicContact CB-CD2 4.33Å; I776-L826 HydrophobicContact CG1-CD2 3.59Å; T779-L826 HydrophobicContact CG2-CD1 4.2Å; T779-L826 HydrophobicContact CG2-CG 4.32Å; T779-L826 WeakPolarHBondContact OG1-CG 3.48Å; S822-L826 VanDerWaalsContact O-CB 3.23Å; S822-L826 WeakPolarHBondContact O-CB 3.42Å; S822-L826 WeakPolarHBondContact O-CG 3.46Å; S822-L826 PolarHBondContact O-N 3.41Å; L826-K830 WeakPolarHBondContact O-CD 3.39Å; L826-K830 WeakPolarHBondContact O-CE 3.35Å
827	Y	89.3	Confident	88.2	Confident	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-36.4	-167.3	-67.7	-85.9	0	0	0	113.6	V594 F598 S615 L618 L619 I622 L823 K830 V831	V594-Y827 HydrophobicContact CG1-CD1 3.91Å; V594-Y827 HydrophobicContact CG1-CG 4.07Å; F598-Y827 AromaticContact CE1-CD1 3.9Å; F598-Y827 HydrophobicContact CE1-CD1 3.9Å; F598-Y827 AromaticContact CE1-CE1 3.84Å; F598-Y827 HydrophobicContact CE1-CE1 3.84Å; F598-Y827 HydrophobicContact CE2-CD1 4.03Å; F598-Y827 AromaticContact CZ-CD1 3.52Å; F598-Y827 HydrophobicContact CZ-CD1 3.52Å; F598-Y827 AromaticContact CZ-CE1 3.97Å; F598-Y827 HydrophobicContact CZ-CE1 3.97Å; S615-Y827 WeakPolarHBondContact CA-OH 3.35Å; S615-Y827 PolarHBondContact O-OH 3.08Å; L618-Y827 HydrophobicContact CD2-CE2 3.88Å; L618-Y827 WeakPolarHBondContact CD2-OH 3.41Å; L618-Y827 HydrophobicContact CG-CE2 4.23Å; L619-Y827 HydrophobicContact CD1-CD1 4.37Å; L619-Y827 HydrophobicContact CD1-CE1 3.87Å; L619-Y827 HydrophobicContact CD2-CD1 4.26Å; L619-Y827 HydrophobicContact CD2-CD2 4.17Å; L619-Y827 HydrophobicContact CD2-CE1 4.1Å; L619-Y827 HydrophobicContact CD2-CE2 4.03Å; L619-Y827 HydrophobicContact CD2-CG 4.28Å; L619-Y827 HydrophobicContact CG-CE1 3.94Å; L619-Y827 HydrophobicContact CG-CE2 4.31Å; I622-Y827 HydrophobicContact CD1-CE2 4.42Å; L823-Y827 WeakPolarHBondContact O-CB 3.35Å; L823-Y827 PolarHBondContact O-N 3.37Å; L823-Y827 VanDerWaalsContact O-N 3.09Å; Y827-K830 WeakPolarHBondContact O-CB 3.34Å; Y827-K830 PolarHBondContact O-N 3.29Å; Y827-V831 WeakPolarHBondContact O-CG2 3.47Å; Y827-V831 PolarHBondContact O-N 3.1Å
828	I	87.8	Confident	87.4	Confident	99 Å²	99	45 Å²	45	51%	0.508	24%	0.238	S	C	.	.	H	α-helix	trans	-56.7	-46.9	178.4	-63.7	-177.2	0	0	0	112.2	L823 G824 K830 V831 Y832	L823-I828 PolarHBondContact O-N 3.12Å; G824-I828 WeakPolarHBondContact O-CB 3.26Å; I828-K830 PolarHBondContact O-N 3.13Å; I828-V831 PolarHBondContact O-N 2.87Å; I828-Y832 VanDerWaalsContact O-CB 3.28Å; I828-Y832 WeakPolarHBondContact O-CB 3.49Å; I828-Y832 PolarHBondContact O-N 3.46Å
829	P	86.1	Confident	86.4	Confident	68 Å²	68	50.2 Å²	50.2	44%	0.442	26%	0.263	S	S	.	.	H	α-helix	trans	-59.5	-33.5	177.8	-25	34.5	0	0	0	113	G824 V833	G824-P829 WeakPolarHBondContact O-CD 3.15Å; P829-V833 VanDerWaalsContact O-CG2 3.31Å; P829-V833 WeakPolarHBondContact O-CG2 3.07Å; P829-V833 PolarHBondContact O-N 3.26Å
830	K	85.9	Confident	85.2	Confident	33 Å²	33	55.8 Å²	55.8	14%	0.143	29%	0.289	C	S	.	.	H	α-helix	trans	-75.2	-43.9	179.5	-65.6	177.3	-179.2	166	0	111.7	F598 I606 S610 E772 L826 Y827 I828 Y832 V833 I834	F598-K830 HydrophobicContact CZ-CB 4.27Å; F598-K830 HydrophobicContact CZ-CD 4.27Å; I606-K830 HydrophobicContact CG2-CB 4.39Å; I606-K830 HydrophobicContact CG2-CG 4.43Å; S610-K830 PolarHBondContact OG-NZ 2.94Å; E772-K830 IonicContact OE1-NZ 3.49Å; E772-K830 PolarHBondContact OE1-NZ 3.37Å; L826-K830 WeakPolarHBondContact O-CD 3.39Å; L826-K830 WeakPolarHBondContact O-CE 3.35Å; Y827-K830 WeakPolarHBondContact O-CB 3.34Å; Y827-K830 PolarHBondContact O-N 3.29Å; I828-K830 PolarHBondContact O-N 3.13Å; K830-Y832 VanDerWaalsContact C-N 3.33Å; K830-V833 PolarHBondContact O-N 2.98Å; K830-I834 WeakPolarHBondContact O-CB 3.27Å; K830-I834 WeakPolarHBondContact O-CD1 3.43Å; K830-I834 WeakPolarHBondContact O-CG1 3.44Å; K830-I834 PolarHBondContact O-N 3.09Å
831	V	86.9	Confident	84	Confident	22 Å²	22	53.8 Å²	53.8	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-64.1	-41.5	176	172	0	0	0	0	110.7	V594 T597 F598 Y827 I828 V833 I834 I835	V594-V831 HydrophobicContact CB-CG2 4.48Å; V594-V831 HydrophobicContact CG1-CG2 4.1Å; V594-V831 HydrophobicContact CG2-CG2 4.13Å; T597-V831 HydrophobicContact CG2-CG1 4.3Å; T597-V831 HydrophobicContact CG2-CG2 4.5Å; F598-V831 HydrophobicContact CD2-CG2 4.21Å; F598-V831 HydrophobicContact CE2-CG2 3.74Å; Y827-V831 WeakPolarHBondContact O-CG2 3.47Å; Y827-V831 PolarHBondContact O-N 3.1Å; I828-V831 PolarHBondContact O-N 2.87Å; V831-V833 PolarHBondContact O-N 2.63Å; V831-I834 PolarHBondContact O-N 3.05Å; V831-I835 HydrophobicContact CG1-CD1 3.62Å; V831-I835 HydrophobicContact CG1-CG1 4.31Å; V831-I835 WeakPolarHBondContact O-CG1 3.47Å; V831-I835 PolarHBondContact O-N 3.42Å
832	Y	86.1	Confident	82.8	Confident	121 Å²	121	57.6 Å²	57.6	48%	0.475	30%	0.299	S	S	.	.	H	α-helix	trans	-56.7	-48.6	175.6	-179.7	-96.7	0	0	0	111.7	I828 K830 I835 F836 H837	I828-Y832 VanDerWaalsContact O-CB 3.28Å; I828-Y832 WeakPolarHBondContact O-CB 3.49Å; I828-Y832 PolarHBondContact O-N 3.46Å; K830-Y832 VanDerWaalsContact C-N 3.33Å; Y832-I835 PolarHBondContact O-N 3.48Å; Y832-F836 AromaticContact CD2-CD2 3.62Å; Y832-F836 HydrophobicContact CD2-CD2 3.62Å; Y832-F836 HydrophobicContact CD2-CE2 4.21Å; Y832-F836 HydrophobicContact CD2-CG 4.35Å; Y832-F836 HydrophobicContact CE2-CB 4.27Å; Y832-F836 AromaticContact CE2-CD2 3.84Å; Y832-F836 HydrophobicContact CE2-CD2 3.84Å; Y832-F836 HydrophobicContact CE2-CE2 4.49Å; Y832-F836 HydrophobicContact CE2-CG 4.17Å; Y832-F836 HydrophobicContact CG-CD2 4.36Å; Y832-F836 WeakPolarHBondContact O-CB 3.25Å; Y832-F836 PolarHBondContact O-N 3.28Å; Y832-H837 AromaticContact CE1-CD2 3.48Å; Y832-H837 VanDerWaalsContact CE1-CD2 3.48Å; Y832-H837 WeakPolarHBondContact CE1-CD2 3.22Å; Y832-H837 AromaticContact CE1-NE2 3.72Å; Y832-H837 AromaticContact CZ-NE2 3.92Å; Y832-H837 PolarHBondContact OH-NE2 3.3Å
833	V	82.8	Confident	81.2	Confident	31 Å²	31	65.9 Å²	65.9	19%	0.188	34%	0.337	C	S	.	.	H	α-helix	trans	-65.6	-39.8	177	175	0	0	0	0	112	I606 P829 K830 V831 I835 H837 Q840	I606-V833 HydrophobicContact CD1-CB 4.42Å; I606-V833 HydrophobicContact CD1-CG1 3.59Å; P829-V833 VanDerWaalsContact O-CG2 3.31Å; P829-V833 WeakPolarHBondContact O-CG2 3.07Å; P829-V833 PolarHBondContact O-N 3.26Å; K830-V833 PolarHBondContact O-N 2.98Å; V831-V833 PolarHBondContact O-N 2.63Å; V833-I835 PolarHBondContact O-N 2.87Å; V833-H837 HydrophobicContact CG1-CB 4.49Å; V833-H837 CarbonylContact O-C 3.09Å; V833-H837 WeakPolarHBondContact O-CA 3.34Å; V833-H837 PolarHBondContact O-N 3.48Å; V833-H837 VanDerWaalsContact O-N 3.16Å; V833-H837 VanDerWaalsContact O-O 3.05Å; V833-Q840 HydrophobicContact CG1-CB 3.96Å
834	I	84.4	Confident	79.3	Confident	6 Å²	6	74.9 Å²	74.9	3%	0.031	38%	0.376	C	S	.	.	H	α-helix	trans	-64.7	-37.7	179.9	-70.5	164.3	0	0	0	112.1	T597 F601 I606 V607 K830 V831	T597-I834 HydrophobicContact CG2-CG2 4.12Å; F601-I834 HydrophobicContact CB-CG2 4.1Å; F601-I834 HydrophobicContact CD1-CG2 4.47Å; F601-I834 HydrophobicContact CD2-CG2 3.64Å; F601-I834 HydrophobicContact CE2-CG2 4.14Å; F601-I834 HydrophobicContact CG-CG2 3.82Å; I606-I834 HydrophobicContact CD1-CG1 4.41Å; I606-I834 HydrophobicContact CG2-CD1 4.31Å; I606-I834 HydrophobicContact CG2-CG1 4.46Å; V607-I834 HydrophobicContact CG2-CD1 3.82Å; K830-I834 WeakPolarHBondContact O-CB 3.27Å; K830-I834 WeakPolarHBondContact O-CD1 3.43Å; K830-I834 WeakPolarHBondContact O-CG1 3.44Å; K830-I834 PolarHBondContact O-N 3.09Å; V831-I834 PolarHBondContact O-N 3.05Å
835	I	83.9	Confident	76.8	Confident	84 Å²	84	85.3 Å²	85.3	43%	0.431	41%	0.407	S	S	.	.	H	α-helix	trans	-89.6	-48.7	-174.8	-64.8	177.6	0	0	0	112.1	T597 V831 Y832 V833	T597-I835 HydrophobicContact CG2-CD1 4.3Å; T597-I835 HydrophobicContact CG2-CG1 4.33Å; V831-I835 HydrophobicContact CG1-CD1 3.62Å; V831-I835 HydrophobicContact CG1-CG1 4.31Å; V831-I835 WeakPolarHBondContact O-CG1 3.47Å; V831-I835 PolarHBondContact O-N 3.42Å; Y832-I835 PolarHBondContact O-N 3.48Å; V833-I835 PolarHBondContact O-N 2.87Å
836	F	84.5	Confident	74.7	Confident	135 Å²	135	92.3 Å²	92.3	59%	0.592	44%	0.436	S	S	*	.	H	α-helix	trans	-97.4	-20.2	-169.8	-66	-79.6	0	0	0	114	Y832 P838	Y832-F836 AromaticContact CD2-CD2 3.62Å; Y832-F836 HydrophobicContact CD2-CD2 3.62Å; Y832-F836 HydrophobicContact CD2-CE2 4.21Å; Y832-F836 HydrophobicContact CD2-CG 4.35Å; Y832-F836 HydrophobicContact CE2-CB 4.27Å; Y832-F836 AromaticContact CE2-CD2 3.84Å; Y832-F836 HydrophobicContact CE2-CD2 3.84Å; Y832-F836 HydrophobicContact CE2-CE2 4.49Å; Y832-F836 HydrophobicContact CE2-CG 4.17Å; Y832-F836 HydrophobicContact CG-CD2 4.36Å; Y832-F836 WeakPolarHBondContact O-CB 3.25Å; Y832-F836 PolarHBondContact O-N 3.28Å; F836-P838 VanDerWaalsContact C-CD 3.48Å
837	H	81.3	Confident	72.4	Confident	57 Å²	57	103 Å²	103	26%	0.264	48%	0.476	S	S	.	.			trans	-130.7	58.7	-178	-69.1	-68.5	0	0	0	112.9	Y832 V833 E839 Q840	Y832-H837 AromaticContact CE1-CD2 3.48Å; Y832-H837 VanDerWaalsContact CE1-CD2 3.48Å; Y832-H837 WeakPolarHBondContact CE1-CD2 3.22Å; Y832-H837 AromaticContact CE1-NE2 3.72Å; Y832-H837 AromaticContact CZ-NE2 3.92Å; Y832-H837 PolarHBondContact OH-NE2 3.3Å; V833-H837 HydrophobicContact CG1-CB 4.49Å; V833-H837 CarbonylContact O-C 3.09Å; V833-H837 WeakPolarHBondContact O-CA 3.34Å; V833-H837 PolarHBondContact O-N 3.48Å; V833-H837 VanDerWaalsContact O-N 3.16Å; V833-H837 VanDerWaalsContact O-O 3.05Å; H837-E839 WeakPolarHBondContact CA-OE1 3.22Å; H837-E839 VanDerWaalsContact CA-OE2 3.23Å; H837-E839 WeakPolarHBondContact CA-OE2 3.31Å; H837-E839 WeakPolarHBondContact CB-OE1 3.38Å; H837-E839 IonicContact CE1-OE1 2.66Å; H837-E839 IonicContact CG-OE1 2.85Å; H837-E839 IonicContact ND1-OE1 2.63Å; H837-E839 PolarHBondContact ND1-OE1 2.84Å; H837-E839 PolarHBondContact O-N 3.28Å; H837-E839 VanDerWaalsContact O-N 3.1Å; H837-Q840 HydrophobicContact CB-CG 4.25Å; H837-Q840 PolarHBondContact O-N 3.47Å
838	P	76.5	Confident	70.2	Confident	81 Å²	81	106.9 Å²	106.9	53%	0.526	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-59.9	-22.5	-178.3	27.2	-35.4	0	0	0	113.2	F836 Q840 N841	F836-P838 VanDerWaalsContact C-CD 3.48Å; P838-Q840 PolarHBondContact O-N 2.91Å; P838-N841 VanDerWaalsContact O-CB 3.25Å; P838-N841 WeakPolarHBondContact O-CB 3.42Å; P838-N841 PolarHBondContact O-N 3.14Å
839	E	71.3	Confident	68.3	Low	113 Å²	113	109.3 Å²	109.3	53%	0.528	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-63.8	-22	174.8	71.9	-73.9	173.3	0	0	113.7	H837 N841 V842	H837-E839 WeakPolarHBondContact CA-OE1 3.22Å; H837-E839 VanDerWaalsContact CA-OE2 3.23Å; H837-E839 WeakPolarHBondContact CA-OE2 3.31Å; H837-E839 WeakPolarHBondContact CB-OE1 3.38Å; H837-E839 IonicContact CE1-OE1 2.66Å; H837-E839 IonicContact CG-OE1 2.85Å; H837-E839 IonicContact ND1-OE1 2.63Å; H837-E839 PolarHBondContact ND1-OE1 2.84Å; H837-E839 PolarHBondContact O-N 3.28Å; H837-E839 VanDerWaalsContact O-N 3.1Å; E839-N841 VanDerWaalsContact C-N 3.34Å; E839-V842 WeakPolarHBondContact O-CG2 3.43Å
840	Q	67.6	Low	66.3	Low	118 Å²	118	114.5 Å²	114.5	55%	0.551	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-88.7	-5.1	175.3	-58.5	-173.6	9.2	0	0	112.5	V833 H837 P838 V842	V833-Q840 HydrophobicContact CG1-CB 3.96Å; H837-Q840 HydrophobicContact CB-CG 4.25Å; H837-Q840 PolarHBondContact O-N 3.47Å; P838-Q840 PolarHBondContact O-N 2.91Å; Q840-V842 VanDerWaalsContact C-N 3.33Å; Q840-V842 PolarHBondContact O-N 2.92Å
841	N	67.4	Low	64.4	Low	23 Å²	23	115.7 Å²	115.7	12%	0.123	54%	0.542	C	S	.	.			trans	-93.7	36.4	-175.6	-162	13.5	0	0	0	113.4	T604 P605 I606 P838 E839	T604-N841 WeakPolarHBondContact CB-ND2 3.22Å; T604-N841 WeakPolarHBondContact CB-OD1 3.31Å; T604-N841 VanDerWaalsContact CG2-ND2 3.26Å; T604-N841 WeakPolarHBondContact CG2-ND2 3.47Å; P605-N841 WeakPolarHBondContact CD-OD1 3.45Å; P605-N841 VanDerWaalsContact CG-O 3.26Å; P605-N841 WeakPolarHBondContact CG-O 3.11Å; I606-N841 HydrophobicContact CD1-CB 4.08Å; I606-N841 WeakPolarHBondContact CD1-OD1 3.29Å; I606-N841 WeakPolarHBondContact CG1-OD1 3.22Å; P838-N841 VanDerWaalsContact O-CB 3.25Å; P838-N841 WeakPolarHBondContact O-CB 3.42Å; P838-N841 PolarHBondContact O-N 3.14Å; E839-N841 VanDerWaalsContact C-N 3.34Å
842	V	69.1	Low	62.8	Low	103 Å²	103	119.8 Å²	119.8	62%	0.624	57%	0.566	S	S	*	*	S	Bend	trans	-113.4	148.8	178.5	-87.4	0	0	0	0	112.2	E839 Q840 K844	E839-V842 WeakPolarHBondContact O-CG2 3.43Å; Q840-V842 VanDerWaalsContact C-N 3.33Å; Q840-V842 PolarHBondContact O-N 2.92Å; V842-K844 PolarHBondContact O-N 3.45Å
843	Q	56.7	Low	61.3	Low	177 Å²	177	118.1 Å²	118.1	83%	0.827	57%	0.569	S	S	*	*			trans	-71.4	101	-177.7	-156.7	169.7	16.2	0	0	110.4	R845	Q843-R845 PolarHBondContact O-N 3.23Å
844	K	52.8	Low	59.6	Low	198 Å²	198	123.7 Å²	123.7	86%	0.861	59%	0.592	S	S	*	*			trans	-61.6	120.8	174.2	-72.2	-176.4	179	177.8	0	109.5	V842 K846	V842-K844 PolarHBondContact O-N 3.45Å; K844-K846 PolarHBondContact O-N 2.85Å
845	R	37.1	Very low	57.9	Low	243 Å²	243	126.7 Å²	126.7	92%	0.917	62%	0.618	S	S	*	*			trans	-47.8	130	-179.1	-116.3	177.3	-175.3	178.3	1.6	111.1	Q843 R847	Q843-R845 PolarHBondContact O-N 3.23Å; R845-R847 PolarHBondContact O-N 3.21Å
846	K	43.3	Very low	56.2	Low	215 Å²	215	125.8 Å²	125.8	94%	0.935	62%	0.623	S	S	*	*			trans	-51.9	104.2	173.3	-77.9	178.3	175.9	176.2	0	110.3	K844 S848	K844-K846 PolarHBondContact O-N 2.85Å; K846-S848 PolarHBondContact O-N 3.5Å
847	R	39	Very low	54.5	Low	236 Å²	236	123.5 Å²	123.5	89%	0.891	62%	0.621	S	S	*	*			trans	-74.2	121	159.7	-89.6	-177.2	173	175	-1.8	107.7	R845	R845-R847 PolarHBondContact O-N 3.21Å
848	S	42.8	Very low	53	Low	81 Å²	81	125.3 Å²	125.3	57%	0.566	64%	0.635	S	S	*	*			trans	-51.3	135.6	-176.8	179.9	0	0	0	0	112.3	K846 K850 A851	K846-S848 PolarHBondContact O-N 3.5Å; S848-K850 PolarHBondContact O-N 3.02Å; S848-A851 PolarHBondContact O-N 2.93Å
849	F	49.3	Very low	51.5	Low	150 Å²	150	125.8 Å²	125.8	66%	0.658	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.6	-19.7	177.3	-142.5	-100.9	0	0	0	113.3	V677 A851	V677-F849 HydrophobicContact CG1-CD1 4.36Å; V677-F849 HydrophobicContact CG1-CE1 4.21Å; F849-A851 PolarHBondContact O-N 3.23Å
850	K	44.6	Very low	50.3	Low	178 Å²	178	125.2 Å²	125.2	77%	0.774	65%	0.645	S	S	*	*	H	α-helix	trans	-64.1	-31.4	174	-98.5	-179.2	171.9	-180	0	114.6	S848	S848-K850 PolarHBondContact O-N 3.02Å
851	A	44.3	Very low	49.3	Very low	58 Å²	58	130 Å²	130	48%	0.479	66%	0.658	S	S	.	*	H	α-helix	trans	-81.8	-25.7	-173.5	0	0	0	0	0	113.8	S848 F849	S848-A851 PolarHBondContact O-N 2.93Å; F849-A851 PolarHBondContact O-N 3.23Å
852	V	54.4	Low	48.2	Very low	108 Å²	108	135.3 Å²	135.3	66%	0.655	69%	0.685	S	S	*	*	H	α-helix	trans	-77.9	-32.5	-178.1	179.6	0	0	0	0	111.5	A856	V852-A856 PolarHBondContact O-N 3.48Å
853	V	55	Low	46.9	Very low	86 Å²	86	135.5 Å²	135.5	52%	0.521	69%	0.692	S	S	.	*	H	α-helix	trans	-72.5	-31	177.6	-179.3	0	0	0	0	111.8	A856 T857	V853-A856 PolarHBondContact O-N 2.83Å; V853-T857 PolarHBondContact O-N 3.32Å; V853-T857 PolarHBondContact O-OG1 3.4Å
854	Q	46.1	Very low	46.3	Very low	147 Å²	147	135.8 Å²	135.8	69%	0.687	69%	0.693	S	S	*	*	H	α-helix	trans	-68.6	-35.3	176.8	-124.3	172.1	-8.5	0	0	112.5	V858	Q854-V858 WeakPolarHBondContact O-CG2 3.44Å
855	A	48.5	Very low	45.6	Very low	70 Å²	70	135.6 Å²	135.6	58%	0.579	69%	0.692	S	S	*	*	H	α-helix	trans	-71.2	-34.1	174.6	0	0	0	0	0	113.2	T857	A855-T857 VanDerWaalsContact C-N 3.34Å; A855-T857 PolarHBondContact O-N 3.37Å
856	A	48.9	Very low	45.7	Very low	64 Å²	64	130 Å²	130	53%	0.529	69%	0.685	S	S	.	*	H	α-helix	trans	-72.3	-23.8	178.3	0	0	0	0	0	113.7	V852 V853 T860	V852-A856 PolarHBondContact O-N 3.48Å; V853-A856 PolarHBondContact O-N 2.83Å; A856-T860 PolarHBondContact O-OG1 3.38Å
857	T	49.6	Very low	45.3	Very low	88 Å²	88	127.8 Å²	127.8	54%	0.54	68%	0.683	S	S	.	*	H	α-helix	trans	-85.9	-21.5	-178.8	-38.4	0	0	0	0	112.8	V853 A855	V853-T857 PolarHBondContact O-N 3.32Å; V853-T857 PolarHBondContact O-OG1 3.4Å; A855-T857 VanDerWaalsContact C-N 3.34Å; A855-T857 PolarHBondContact O-N 3.37Å
858	V	49	Very low	45.1	Very low	94 Å²	94	123.9 Å²	123.9	57%	0.57	68%	0.68	S	S	*	*	H	α-helix	trans	-81.9	-31	179.3	175.3	0	0	0	0	111.8	Q854 T860 R861	Q854-V858 WeakPolarHBondContact O-CG2 3.44Å; V858-T860 VanDerWaalsContact C-N 3.31Å; V858-T860 PolarHBondContact O-N 3.18Å; V858-R861 PolarHBondContact O-N 3.48Å
859	S	44.8	Very low	44.6	Very low	91 Å²	91	129.2 Å²	129.2	64%	0.636	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-22.4	-179.7	-155.2	0	0	0	0	113.8
860	T	46.1	Very low	43.9	Very low	101 Å²	101	130.7 Å²	130.7	62%	0.62	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.3	-16.4	-179.2	-16.1	0	0	0	0	113.5	A856 V858	A856-T860 PolarHBondContact O-OG1 3.38Å; V858-T860 VanDerWaalsContact C-N 3.31Å; V858-T860 PolarHBondContact O-N 3.18Å
861	R	45.7	Very low	43.2	Very low	220 Å²	220	130.4 Å²	130.4	83%	0.83	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-15.7	176.6	-80.4	-171.4	179.7	-176	0.3	114.4	V858	V858-R861 PolarHBondContact O-N 3.48Å
862	L	46.1	Very low	42.6	Very low	133 Å²	133	131.2 Å²	131.2	70%	0.696	72%	0.722	S	S	*	*	S	Bend	trans	-89.2	-16.2	178.4	-99.1	116.1	0	0	0	114.3	Q864	L862-Q864 PolarHBondContact O-N 3.5Å
863	S	41.7	Very low	41.5	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-1.1	-176.8	-158.6	0	0	0	0	114.7
864	Q	43	Very low	40.3	Very low	182 Å²	182	136.4 Å²	136.4	85%	0.85	75%	0.745	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	4.6	-178.3	-114.3	177.2	-9.7	0	0	114.4	L862	L862-Q864 PolarHBondContact O-N 3.5Å
865	K	39.3	Very low	39.4	Very low	195 Å²	195	138.2 Å²	138.2	85%	0.848	75%	0.751	S	S	*	*	S	Bend	trans	-121.7	12.4	-171.8	-140.3	-179.1	-177.8	-177.5	0	116.3
866	V	38.9	Very low	38.5	Very low	126 Å²	126	142.5 Å²	142.5	76%	0.764	76%	0.761	S	S	*	*	S	Bend	trans	-122.3	6.4	-173.7	-174.1	0	0	0	0	113.9
867	N	33.8	Very low	37.6	Very low	168 Å²	168	148.6 Å²	148.6	90%	0.898	78%	0.778	S	S	*	*			trans	-98.7	22	-175	-122.1	27.4	0	0	0	116.2
868	D	35.7	Very low	37.5	Very low	154 Å²	154	149.9 Å²	149.9	82%	0.824	79%	0.788	S	S	*	*			trans	-123.9	88.9	170	-95.3	-30.6	0	0	0	110
869	K	32.8	Very low	36.8	Very low	192 Å²	192	151.8 Å²	151.8	84%	0.835	80%	0.795	S	S	*	*				162.9	136	129.9	-93.6	172.7	174.6	177.7	0	113.4
870	Q	33.3	Very low	36.6	Very low	182 Å²	182	157.8 Å²	157.8	85%	0.85	80%	0.804	S	S	*	*			trans	93.4	89.3	148.6	-77.4	172	-23.8	0	0	119.5
871	N	30.8	Very low	36.3	Very low	172 Å²	172	158.3 Å²	158.3	92%	0.92	81%	0.812	S	S	*	*			trans	-34.9	143.2	136.7	-72.8	-20	0	0	0	114.2
872	G	31.7	Very low	35.8	Very low	74 Å²	74	161 Å²	161	76%	0.763	83%	0.834	S	S	*	*			trans	-167.1	90.6	167.2	0	0	0	0	0	111.7
873	E	31.2	Very low	35.3	Very low	202 Å²	202	162.4 Å²	162.4	94%	0.944	84%	0.841	S	S	*	*			trans	37.7	143.2	149.1	-73.9	176.8	144.6	0	0	124.6
874	S	28.9	Very low	35	Very low	102 Å²	102	165.2 Å²	165.2	71%	0.713	85%	0.845	S	S	*	*			trans	-103.8	165.4	-172.5	55.2	0	0	0	0	114.1
875	K	28.3	Very low	34.6	Very low	184 Å²	184	164.3 Å²	164.3	80%	0.8	85%	0.845	S	S	*	*			trans	84.8	144.1	161.8	-74	179.4	174.2	179.1	0	115.4
876	M	28.7	Very low	34.3	Very low	161 Å²	161	162.5 Å²	162.5	79%	0.793	85%	0.845	S	S	*	*			cis	-164.7	148	23.6	-130.4	173.1	-59.9	0	0	107.9
877	E	30.1	Very low	34	Very low	191 Å²	191	164.8 Å²	164.8	89%	0.893	85%	0.85	S	S	*	*				176.1	138.3	118.9	-136.5	158.7	-169.1	0	0	111.9
878	P	47.7	Very low	34	Very low	116 Å²	116	164.5 Å²	164.5	75%	0.753	85%	0.846	S	S	*	*			trans	-113.9	157.1	166.9	37.8	-26.1	0	0	0	113.9
879	D	35.1	Very low	33.9	Very low	134 Å²	134	165.3 Å²	165.3	72%	0.717	85%	0.848	S	S	*	*			trans	101.9	126.1	143.5	-140.3	16	0	0	0	121.8
880	R	40.2	Very low	34	Very low	216 Å²	216	163.2 Å²	163.2	82%	0.815	85%	0.849	S	S	*	*			trans	41.1	123.2	150.3	-94.4	167.7	160.1	163.5	-5.1	122.3
881	S	39.2	Very low	34	Very low	113 Å²	113	161.7 Å²	161.7	79%	0.79	85%	0.849	S	S	*	*				168.8	150.2	86.9	44.3	0	0	0	0	112.5
882	Q	36.5	Very low	34.3	Very low	275 Å²	275	160.7 Å²	160.7	100%	1.285	84%	0.842	S	S	*	*			trans	83.5	0	-178.7	-66	-171.8	-6.7	0	0	117.9

Retrieved 882 of 882 residues in 272.1 ms (Link to these results)

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